data_2khs_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 2khs _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 37.5 m80 . . . . . 0 N--CA 1.433 -1.286 0 CA-C-O 121.529 0.68 . . . . 0.0 112.072 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 37.0 ttmt -115.73 134.37 55.09 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 114.093 -1.412 . . . . 0.0 108.554 177.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -138.19 146.34 51.31 Favored Pre-proline 0 C--N 1.3 -1.558 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 176.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -69.22 150.59 71.67 Favored 'Trans proline' 0 C--O 1.246 0.891 0 C-N-CA 122.228 1.952 . . . . 0.0 112.388 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -141.45 165.04 28.61 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.142 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.521 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 8.4 m -100.23 133.81 44.08 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.4 tp -81.84 124.76 29.97 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 178.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 59.4 mt -95.78 -54.87 6.63 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 176.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -162.68 153.83 17.49 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.197 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.32 107.47 16.75 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 176.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.4 mt -81.04 -63.53 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.237 0 CA-C-O 121.59 0.71 . . . . 0.0 109.357 -173.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -112.77 -171.37 1.85 Allowed 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.186 -0.916 . . . . 0.0 109.856 -176.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -92.29 40.18 2.92 Favored Glycine 0 C--O 1.202 -1.884 0 N-CA-C 109.779 -1.328 . . . . 0.0 109.779 177.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.602 ' OD1' ' HG2' ' A' ' 35' ' ' ARG . 2.5 t0 -174.9 -57.46 0.01 OUTLIER 'General case' 0 CA--C 1.505 -0.761 0 N-CA-C 106.534 -1.654 . . . . 0.0 106.534 -174.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.3 111.37 18.92 Favored 'General case' 0 N--CA 1.425 -1.704 0 CA-C-N 113.826 -1.534 . . . . 0.0 109.103 -176.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 22.2 m -134.6 163.16 37.48 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.892 0 C-N-CA 123.499 0.72 . . . . 0.0 109.058 -176.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -116.26 116.26 27.44 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.619 -0.676 . . . . 0.0 110.107 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.8 mp -121.92 159.44 26.88 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 121.409 0.623 . . . . 0.0 111.001 178.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.521 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 26.9 ttt -120.08 105.93 11.48 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -178.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.424 ' CD1' ' HZ ' ' A' ' 34' ' ' PHE . 11.3 p90 -106.74 120.61 42.46 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -177.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 60.9 mttp 55.79 28.71 12.72 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.438 0.637 . . . . 0.0 111.916 -178.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 93.43 6.08 62.96 Favored Glycine 0 N--CA 1.434 -1.464 0 C-N-CA 120.513 -0.851 . . . . 0.0 113.197 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.435 ' O ' ' HA ' ' A' ' 26' ' ' MET . 84.0 mm-40 -105.62 104.01 46.29 Favored Pre-proline 0 C--N 1.311 -1.081 0 CA-C-N 117.122 0.461 . . . . 0.0 110.938 178.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -76.77 117.09 4.4 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.682 2.254 . . . . 0.0 110.703 176.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 25.8 mmt -137.42 147.58 45.5 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 90.3 m -85.59 116.73 24.05 Favored 'General case' 0 N--CA 1.425 -1.685 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 173.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.424 ' HZ ' ' CD1' ' A' ' 27' ' ' TYR . 90.5 m-85 -102.53 157.59 16.82 Favored 'General case' 0 C--N 1.291 -1.962 0 C-N-CA 123.686 0.794 . . . . 0.0 109.847 -177.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.602 ' HG2' ' OD1' ' A' ' 21' ' ' ASP . 11.9 ttt-85 -132.66 156.44 46.96 Favored 'General case' 0 C--N 1.286 -2.157 0 N-CA-C 104.127 -2.546 . . . . 0.0 104.127 172.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.463 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 84.1 mt -89.88 116.88 28.28 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -170.413 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 37.3 mt -55.71 135.82 51.21 Favored 'General case' 0 C--O 1.245 0.816 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.009 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 95.6 mt 72.24 13.14 5.73 Favored 'General case' 0 C--O 1.209 -1.031 0 O-C-N 124.872 1.357 . . . . 0.0 112.132 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 57.3 t -125.88 143.38 39.59 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.433 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -140.08 107.8 5.64 Favored 'General case' 0 C--O 1.249 1.052 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 175.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.431 HG23 ' O ' ' A' ' 108' ' ' LEU . 2.6 m . . . . . 0 CA--C 1.571 1.785 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 -173.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 1.552 0 N-CA-C 116.328 1.291 . . . . 0.0 116.328 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo -49.06 -52.0 9.55 Favored 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 123.059 2.506 . . . . 0.0 113.774 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -70.45 -48.57 55.25 Favored 'General case' 0 C--O 1.206 -1.197 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.5 -48.1 72.28 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -177.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.512 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 46.0 p -69.08 -33.77 74.07 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-O 121.146 0.498 . . . . 0.0 111.876 -178.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.592 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -71.04 -38.62 72.56 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 175.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -61.51 -43.13 99.41 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 124.917 1.287 . . . . 0.0 111.509 -176.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.52 ' O ' HG23 ' A' ' 66' ' ' VAL . 5.0 p -64.28 -41.47 96.88 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.951 177.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.512 ' HG3' ' O ' ' A' ' 59' ' ' SER . 57.7 mttp -57.11 -39.12 74.47 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 123.541 0.526 . . . . 0.0 111.096 177.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.592 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 82.1 mttt -59.51 -54.27 48.52 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -179.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -67.35 -39.56 85.77 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -177.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 62' ' ' THR . 34.5 m -82.32 -39.02 15.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 113.634 0.975 . . . . 0.0 113.634 -176.22 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -75.55 -22.85 56.68 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -177.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -83.94 -9.44 58.69 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.766 0.793 . . . . 0.0 109.766 178.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.17 140.35 30.25 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.476 0.655 . . . . 0.0 112.436 -177.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -87.04 -38.52 16.48 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.042 -0.981 . . . . 0.0 108.977 175.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -119.11 119.78 35.21 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.522 -176.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 74.6 mt -118.23 121.37 67.04 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.452 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 22.8 mt-10 -115.9 137.95 51.63 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.199 -173.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.8 m -110.7 118.67 57.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 174.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.411 ' HA ' ' HA ' ' A' ' 9' ' ' LYS . 39.6 tt0 -111.71 133.76 53.73 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.458 ' CE1' ' HG3' ' A' ' 81' ' ' ARG . 60.8 m-85 -108.65 147.3 32.09 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -175.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -97.33 -174.54 2.96 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 120.939 0.4 . . . . 0.0 110.816 -176.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.0 mtpm? -76.82 -8.41 57.26 Favored 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 123.787 0.835 . . . . 0.0 110.79 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -69.13 -93.65 0.05 OUTLIER Glycine 0 C--N 1.335 0.508 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -145.97 158.74 43.86 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 176.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.458 ' HG3' ' CE1' ' A' ' 76' ' ' PHE . 37.0 ttm180 -88.52 -35.37 17.0 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 173.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 8.4 p . . . . . 0 C--N 1.313 -1.021 0 CA-C-N 115.285 -0.87 . . . . 0.0 112.119 -175.351 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.412 -2.339 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -87.9 157.47 28.49 Favored Glycine 0 N--CA 1.427 -1.966 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.412 -175.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 72.7 mt -122.39 108.55 13.34 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 -178.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.42 ' O ' ' HA ' ' A' ' 36' ' ' LEU . . . -150.66 167.61 26.82 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 119.992 -0.683 . . . . 0.0 112.543 -175.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -106.22 127.93 53.58 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 171.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 65.5 mt -103.14 126.7 57.42 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.978 0 C-N-CA 119.503 -0.879 . . . . 0.0 111.608 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.452 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 35.4 m-85 -112.45 133.94 54.26 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.278 178.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.34 105.83 16.04 Favored 'General case' 0 C--N 1.283 -2.306 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 174.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.2 p30 46.96 26.53 0.61 Allowed 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 125.201 1.4 . . . . 0.0 113.866 -172.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.46 -6.94 36.46 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.694 -0.765 . . . . 0.0 113.396 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -89.07 115.38 26.57 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 175.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 51.8 ttp -76.11 112.55 12.68 Favored 'General case' 0 C--N 1.294 -1.846 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 -178.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 57.5 t -62.41 -32.77 56.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.245 0.545 . . . . 0.0 110.138 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.463 ' ND2' ' HB3' ' A' ' 36' ' ' LEU . 1.3 m-20 -57.79 -37.95 74.63 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.073 178.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -66.3 -46.01 78.4 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.758 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.36 -39.77 88.38 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.662 -178.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 97.2 mt -62.19 -53.46 54.94 Favored 'General case' 0 C--O 1.244 0.795 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 19.3 m -69.54 -37.88 75.6 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 116.222 -0.444 . . . . 0.0 112.156 -177.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 53.2 ttp180 -68.26 -24.64 64.91 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 123.405 0.682 . . . . 0.0 111.16 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 50.7 tp60 -92.01 -5.74 52.43 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.547 0.689 . . . . 0.0 109.375 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.476 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 73.23 27.19 68.69 Favored Glycine 0 N--CA 1.441 -0.976 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.766 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.431 ' O ' HG23 ' A' ' 41' ' ' THR . 83.3 mt -97.63 -7.04 31.93 Favored 'General case' 0 CA--C 1.495 -1.138 0 O-C-N 122.864 -0.198 . . . . 0.0 111.186 -179.104 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -150.61 164.67 35.47 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 -177.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -112.66 156.92 21.91 Favored 'General case' 0 CA--C 1.488 -1.421 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 174.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.473 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 75.2 t -73.77 136.13 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.755 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 174.04 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.424 -1.766 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -177.741 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 65.8 m80 . . . . . 0 N--CA 1.467 0.398 0 CA-C-O 118.706 -0.664 . . . . 0.0 112.377 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -60.98 -41.75 97.05 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 118.889 0.768 . . . . 0.0 110.628 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -65.9 -33.6 76.21 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.319 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 95.0 mt -68.52 -49.73 57.41 Favored 'General case' 0 C--O 1.246 0.871 0 CA-C-O 121.657 0.741 . . . . 0.0 109.136 178.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -63.55 -44.56 93.81 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.288 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . 0.436 48.6 mtt180 -75.13 -18.39 60.24 Favored 'General case' 0 N--CA 1.436 -1.159 0 N-CA-C 117.62 2.452 . . . . 0.0 117.62 -175.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -72.68 -42.78 63.91 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 169.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 15.0 m -66.4 -37.12 84.51 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 114.651 -1.159 . . . . 0.0 110.275 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.575 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 39.0 tt0 -63.39 -51.17 66.92 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.694 175.143 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.61 -39.21 70.47 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.65 0.78 . . . . 0.0 111.65 -176.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -60.17 -47.54 85.53 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.432 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -74.45 -34.29 63.13 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.423 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 146' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 39.6 mtpt -59.82 -47.71 84.63 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-O 121.131 0.491 . . . . 0.0 110.208 179.402 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -67.98 -26.95 66.18 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.541 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -82.85 -8.54 59.57 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . 0.536 ' O ' ' HB2' ' B' ' 154' ' ' SER . 29.8 mmmt 58.35 42.72 21.07 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 36.3 mt -79.13 112.28 16.18 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.19 -176.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 151' ' ' ASN . . . . . 0.476 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 85.6 m-20 54.16 -92.85 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.084 1.354 . . . . 0.0 112.671 174.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 52.1 mt -67.69 -32.73 58.06 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.948 0 CA-C-O 121.206 0.527 . . . . 0.0 110.387 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 52.8 m95 -75.69 -5.43 45.56 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-O 121.765 0.793 . . . . 0.0 111.473 -177.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 154' ' ' SER . . . . . 0.536 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 23.2 t -93.72 12.66 24.81 Favored 'General case' 0 N--CA 1.423 -1.787 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.604 173.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -70.79 -24.3 62.55 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.615 0.722 . . . . 0.0 109.08 175.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 30.2 t70 . . . . . 0 N--CA 1.429 -1.488 0 CA-C-N 114.356 -1.293 . . . . 0.0 109.295 -178.351 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 14.9 p-80 . . . . . 0 N--CA 1.444 -0.728 0 CA-C-O 120.733 0.302 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 21.4 pttp -111.46 145.9 38.17 Favored 'General case' 0 C--N 1.291 -1.951 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 173.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -138.85 147.6 54.81 Favored Pre-proline 0 C--N 1.259 -3.34 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -74.96 149.76 37.39 Favored 'Trans proline' 0 C--O 1.244 0.804 0 C-N-CA 122.212 1.941 . . . . 0.0 113.193 -177.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -138.12 155.05 49.13 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.542 -0.753 . . . . 0.0 109.448 178.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.454 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 21.6 m -100.59 137.02 39.55 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 62.2 tp -83.36 132.97 34.97 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.979 -0.451 . . . . 0.0 111.594 -176.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 51.0 mm -95.92 -59.47 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.481 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 172.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.24 142.3 0.8 Allowed 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 -178.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -92.04 122.53 34.63 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 171.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.4 mt -90.15 -64.8 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -175.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -134.83 -178.82 5.25 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.643 -178.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.7 56.01 4.9 Favored Glycine 0 C--O 1.238 0.379 0 C-N-CA 121.732 -0.27 . . . . 0.0 112.95 -176.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.567 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 3.2 p-10 177.71 -34.06 0.01 OUTLIER 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 124.546 1.139 . . . . 0.0 108.259 179.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -110.12 109.89 20.58 Favored 'General case' 0 N--CA 1.419 -2.002 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.953 -177.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 7.3 p -129.33 139.2 52.39 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.881 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 178.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -106.0 119.48 39.31 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -175.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.445 ' O ' ' HA ' ' A' ' 31' ' ' PRO . 4.7 mp -127.24 156.28 42.13 Favored 'General case' 0 CA--C 1.496 -1.119 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.958 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.454 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 49.3 ttm -110.83 99.94 8.77 Favored 'General case' 0 C--N 1.29 -2.019 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 175.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -98.29 113.26 25.14 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.329 -0.949 . . . . 0.0 108.717 -177.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 96.8 mttt 56.71 31.62 19.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.878 0.847 . . . . 0.0 111.563 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 95.52 4.2 60.86 Favored Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 114.815 -1.084 . . . . 0.0 113.938 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.413 ' O ' ' HA ' ' A' ' 26' ' ' MET . 33.5 mm-40 -105.97 103.46 44.64 Favored Pre-proline 0 C--N 1.309 -1.173 0 CA-C-N 117.403 0.601 . . . . 0.0 111.163 175.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.445 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 1.9 Cg_endo -82.69 107.69 1.6 Allowed 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 122.798 2.332 . . . . 0.0 111.124 177.328 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 92.0 mtp -131.52 156.49 45.62 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-O 121.081 0.467 . . . . 0.0 111.463 -177.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.8 m -78.31 108.95 12.02 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 175.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -95.1 142.7 27.25 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-O 121.291 0.567 . . . . 0.0 111.572 -178.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.567 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 8.2 tpt180 -110.88 112.25 23.96 Favored 'General case' 0 N--CA 1.417 -2.105 0 N-CA-C 105.443 -2.058 . . . . 0.0 105.443 172.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.474 ' HB3' HD22 ' A' ' 100' ' ' ASN . 3.9 mp -62.93 122.08 15.11 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -177.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 78.9 mt -69.09 146.58 52.46 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.306 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 70.3 mt 75.47 4.27 4.02 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 124.935 1.294 . . . . 0.0 112.265 177.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 94.1 t -120.3 125.79 74.57 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.223 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.599 -178.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.459 ' HA ' ' NH2' ' A' ' 35' ' ' ARG . 31.9 t70 -121.89 134.9 54.87 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 173.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.548 ' OG1' ' HB3' ' A' ' 21' ' ' ASP . 1.7 m . . . . . 0 C--N 1.307 -1.242 0 C-N-CA 123.741 0.816 . . . . 0.0 109.547 -177.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.598 0 CA-C-O 118.836 -0.98 . . . . 0.0 114.395 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.432 ' HA ' ' OG ' ' A' ' 59' ' ' SER . 32.4 Cg_exo -64.12 -21.48 67.85 Favored 'Trans proline' 0 C--N 1.364 1.381 0 C-N-CA 122.842 2.362 . . . . 0.0 112.357 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -68.8 -47.38 66.25 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 177.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.88 -46.47 68.34 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.078 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.501 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 12.9 p -65.88 -45.16 83.07 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -177.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.38 -39.46 90.73 Favored 'General case' 0 CA--C 1.51 -0.58 0 C-N-CA 121.255 -0.178 . . . . 0.0 110.864 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -63.92 -45.19 90.38 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.496 ' O ' HG21 ' A' ' 66' ' ' VAL . 44.8 m -56.84 -49.86 74.17 Favored 'General case' 0 N--CA 1.445 -0.708 0 O-C-N 124.181 0.926 . . . . 0.0 109.425 177.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.501 ' HG3' ' O ' ' A' ' 59' ' ' SER . 59.7 mtpt -56.83 -54.59 44.66 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.821 179.482 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -57.48 -42.01 81.8 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.69 0.618 . . . . 0.0 111.89 -177.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.8 ttt -72.35 -44.87 61.99 Favored 'General case' 0 N--CA 1.441 -0.911 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.854 -177.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.496 HG21 ' O ' ' A' ' 62' ' ' THR . 33.2 m -74.88 -30.91 24.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -70.8 -31.56 68.36 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.338 0.589 . . . . 0.0 109.774 176.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -84.23 -13.44 52.64 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.384 -178.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.57 132.43 46.91 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.025 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -79.51 -38.27 34.75 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-O 122.004 0.906 . . . . 0.0 109.226 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 44.5 mtmt -133.18 150.44 52.0 Favored 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 106.02 -1.845 . . . . 0.0 106.02 178.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 53.3 mt -119.1 130.69 73.53 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.744 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 171.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.519 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 14.2 mm-40 -111.49 133.11 54.01 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 106.222 -1.77 . . . . 0.0 106.222 -178.364 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 m -112.64 122.81 67.54 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.916 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 174.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.427 ' HA ' ' HA ' ' A' ' 9' ' ' LYS . 33.7 tt0 -106.51 135.16 48.51 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 120.902 0.382 . . . . 0.0 110.526 -177.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -79.13 116.6 19.51 Favored 'General case' 0 N--CA 1.415 -2.215 0 CA-C-N 114.919 -1.037 . . . . 0.0 108.882 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.467 ' CG ' ' H ' ' A' ' 78' ' ' LYS . 25.9 t70 -96.8 -175.2 3.21 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 123.926 0.766 . . . . 0.0 109.924 -177.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.467 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 43.1 tptt -73.05 -9.4 58.69 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 124.443 1.097 . . . . 0.0 112.353 -173.009 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -81.05 -113.54 0.33 Allowed Glycine 0 C--N 1.314 -0.675 0 C-N-CA 120.337 -0.935 . . . . 0.0 110.927 174.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -130.21 175.01 9.27 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 176.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 40.4 ttt180 -96.15 -32.75 12.34 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 43.0 p . . . . . 0 N--CA 1.441 -0.923 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.834 177.654 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 27.8 mmt85 . . . . . 0 N--CA 1.439 -0.98 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -89.19 141.58 16.34 Favored Glycine 0 C--N 1.291 -1.919 0 N-CA-C 109.105 -1.598 . . . . 0.0 109.105 175.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.6 mt -124.4 105.84 9.75 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -178.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.54 164.18 38.51 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-O 120.631 0.253 . . . . 0.0 110.434 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.407 ' CZ ' ' HB2' ' A' ' 100' ' ' ASN . 13.1 t80 -89.21 130.77 35.57 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 173.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 45.2 mm -99.99 123.94 53.13 Favored 'Isoleucine or valine' 0 C--O 1.251 1.14 0 CA-C-O 120.954 0.407 . . . . 0.0 111.623 -175.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.519 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 50.1 m-85 -113.94 145.65 41.21 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 173.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.19 100.4 9.99 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 175.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.338 4.2 p-10 43.83 42.5 4.51 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 125.46 1.504 . . . . 0.0 114.256 -176.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.25 -17.84 39.99 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-N 114.687 -1.142 . . . . 0.0 113.52 177.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.2 mtmt -97.97 132.29 43.66 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 120.937 0.398 . . . . 0.0 110.908 -177.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' MET . . . . . 0.431 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 1.9 mpt? -70.39 109.99 5.06 Favored 'General case' 0 C--N 1.305 -1.334 0 C-N-CA 123.999 0.92 . . . . 0.0 112.95 -173.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 58.7 t -73.41 -43.78 55.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 121.441 0.639 . . . . 0.0 109.941 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.474 HD22 ' HB3' ' A' ' 36' ' ' LEU . 14.3 m120 -60.65 -45.16 95.15 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.247 -176.467 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -61.91 -38.0 86.76 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.05 178.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.546 ' O ' ' HG2' ' A' ' 106' ' ' GLN . . . -65.33 -46.69 79.25 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.265 179.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 97.2 mt -53.57 -48.66 68.95 Favored 'General case' 0 C--O 1.244 0.777 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -179.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 12.7 m -70.81 -36.97 66.76 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.474 ' HB2' ' HB3' ' B' ' 141' ' ' SER . 29.2 ttp180 -72.26 -21.81 61.32 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.546 ' HG2' ' O ' ' A' ' 102' ' ' ALA . 82.0 mm-40 -87.54 -2.67 58.78 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.32 0.581 . . . . 0.0 109.508 176.326 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.417 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 69.75 28.7 71.76 Favored Glycine 0 N--CA 1.444 -0.833 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.993 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.4 mt -94.98 -13.98 24.79 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-O 121.189 0.518 . . . . 0.0 110.577 -177.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -151.22 167.41 27.9 Favored 'General case' 0 N--CA 1.428 -1.569 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.231 -176.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -112.57 153.11 28.04 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 175.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.477 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 11.7 p -76.9 125.55 36.8 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-O 121.516 0.674 . . . . 0.0 110.475 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.439 ' CB ' ' HB2' ' A' ' 40' ' ' ASP . . . . . . . . 0 C--N 1.305 -1.368 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.867 176.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 . . . . . 0 N--CA 1.47 0.552 0 CA-C-O 120.994 0.426 . . . . 0.0 110.49 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -54.82 -55.35 31.22 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.926 -1.033 . . . . 0.0 112.892 -175.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 56.9 mm-40 -56.74 -45.92 81.69 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.043 -171.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.0 mt -62.9 -51.1 68.25 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 123.78 0.675 . . . . 0.0 111.019 -176.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 7.6 mp -70.04 -32.95 71.33 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 139' ' ' ARG . . . . . 0.428 ' HG2' HG13 ' A' ' 111' ' ' VAL . 34.1 mtp180 -68.25 -34.26 75.89 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.378 176.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 19.4 mmmt -70.46 -32.04 69.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.875 0.369 . . . . 0.0 110.941 173.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 141' ' ' SER . . . . . 0.474 ' HB3' ' HB2' ' A' ' 105' ' ' ARG . 43.3 m -65.82 -41.96 91.2 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.807 177.106 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.553 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 48.0 mt-10 -63.65 -46.96 83.27 Favored 'General case' 0 C--O 1.198 -1.612 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.455 172.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . 0.537 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -51.04 -44.41 61.08 Favored 'General case' 0 CA--C 1.509 -0.617 0 O-C-N 123.899 0.749 . . . . 0.0 111.608 -176.178 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -61.31 -47.41 86.09 Favored 'General case' 0 N--CA 1.441 -0.876 0 O-C-N 123.864 0.728 . . . . 0.0 109.503 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.1 -40.79 91.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.055 -178.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 146' ' ' LYS . . . . . 0.553 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 56.0 mttm -54.55 -45.09 73.4 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.102 0.477 . . . . 0.0 110.52 177.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . 0.537 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 31.1 mmtp -79.9 -24.01 41.43 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.772 -174.161 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -87.23 -9.86 54.01 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.584 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . 0.562 ' O ' ' HB2' ' B' ' 154' ' ' SER . 27.4 mmmt 61.97 55.91 2.45 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.387 1.075 . . . . 0.0 108.428 -178.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 88.7 mt -95.06 123.25 38.44 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.038 -177.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 151' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 54.2 m-80 46.26 -97.11 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.766 1.626 . . . . 0.0 113.574 -179.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 152' ' ' ILE . . . . . 0.557 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 64.4 mt -60.98 -36.01 69.22 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.632 0 CA-C-O 121.767 0.794 . . . . 0.0 110.401 -178.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -80.61 1.0 31.63 Favored 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.6 -175.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 154' ' ' SER . . . . . 0.562 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 25.0 t -99.72 -6.73 26.59 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.49 177.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . 0.557 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 12.5 pt-20 -79.94 -19.67 47.46 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 119.939 -0.704 . . . . 0.0 109.24 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 18.4 t70 . . . . . 0 CA--C 1.487 -1.473 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -178.027 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 28.9 t-80 . . . . . 0 N--CA 1.433 -1.277 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -96.33 125.02 40.54 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 115.32 -0.854 . . . . 0.0 108.926 179.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -135.38 143.4 45.2 Favored Pre-proline 0 C--N 1.303 -1.454 0 CA-C-N 116.78 -0.191 . . . . 0.0 110.489 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -79.97 147.36 18.91 Favored 'Trans proline' 0 C--O 1.249 1.046 0 C-N-CA 122.472 2.115 . . . . 0.0 113.903 -176.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -129.86 171.26 12.91 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.208 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.405 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 28.1 m -117.13 145.6 43.7 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 107.081 -1.452 . . . . 0.0 107.081 178.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.1 tp -88.28 127.93 35.47 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 118.721 0.691 . . . . 0.0 110.381 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.6 mm -93.13 -51.47 11.2 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 176.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -169.48 134.12 1.41 Allowed 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.347 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -84.79 131.51 34.53 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 172.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.429 ' HB ' ' O ' ' A' ' 22' ' ' THR . 59.7 mt -105.89 -64.45 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 C-N-CA 120.544 -0.463 . . . . 0.0 111.016 -175.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.463 ' HB2' ' OG1' ' A' ' 22' ' ' THR . 36.9 m-20 -122.71 -152.71 0.52 Allowed 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.051 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -101.69 44.43 1.54 Allowed Glycine 0 CA--C 1.498 -0.971 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 -178.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.461 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 33.0 t0 -179.73 -56.12 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 -178.177 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.463 ' OG1' ' HB2' ' A' ' 19' ' ' ASP . 1.0 OUTLIER -76.4 106.34 7.98 Favored 'General case' 0 N--CA 1.411 -2.377 0 CA-C-N 114.627 -1.169 . . . . 0.0 110.059 -178.296 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.5 m -130.68 151.04 35.27 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.451 -178.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 45.7 tttp -108.49 114.48 28.35 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 -176.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.7 mp -121.5 159.69 25.77 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 121.382 0.611 . . . . 0.0 111.416 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.517 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 64.0 ttp -119.46 116.24 25.71 Favored 'General case' 0 C--N 1.294 -1.83 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 177.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.2 p90 -119.66 119.53 33.98 Favored 'General case' 0 C--N 1.286 -2.154 0 C-N-CA 119.368 -0.933 . . . . 0.0 109.272 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 98.0 mttt 60.85 27.52 17.33 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.266 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.43 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 94.31 3.67 63.11 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-N 115.232 -0.895 . . . . 0.0 113.034 -179.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.517 ' O ' ' HA ' ' A' ' 26' ' ' MET . 1.7 mp0 -100.47 102.39 18.59 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.95 0.375 . . . . 0.0 110.446 177.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.43 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 1.5 Cg_endo -83.34 101.96 1.01 Allowed 'Trans proline' 0 N--CA 1.443 -1.45 0 C-N-CA 122.31 2.007 . . . . 0.0 109.856 176.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 66.7 mtt -124.98 147.47 48.91 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.492 -176.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.53 ' O ' ' HD3' ' A' ' 87' ' ' ARG . 23.7 m -85.91 121.37 28.45 Favored 'General case' 0 N--CA 1.422 -1.839 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 177.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -99.57 161.58 13.53 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-O 122.256 1.026 . . . . 0.0 113.532 -174.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.461 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 9.0 tpt180 -134.51 131.02 37.52 Favored 'General case' 0 N--CA 1.412 -2.327 0 N-CA-C 105.037 -2.208 . . . . 0.0 105.037 173.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.1 mp -69.94 129.3 39.13 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 119.658 -0.817 . . . . 0.0 111.859 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 50.2 mt -57.42 126.07 25.67 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 115.047 -0.979 . . . . 0.0 112.629 177.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 40.2 mt 72.03 23.4 3.47 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-N 113.485 -1.688 . . . . 0.0 112.562 173.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 51.1 t -111.41 135.57 50.2 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.033 0 CA-C-O 121.113 0.482 . . . . 0.0 110.596 177.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.464 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 35.8 t70 -122.36 106.79 11.39 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 174.364 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.8 p . . . . . 0 N--CA 1.421 -1.925 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.774 177.522 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.616 0 CA-C-O 118.803 -0.998 . . . . 0.0 114.758 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.47 -25.2 70.46 Favored 'Trans proline' 0 C--N 1.366 1.47 0 C-N-CA 122.409 2.073 . . . . 0.0 112.899 -178.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -70.3 -50.46 39.07 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 178.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.3 -43.06 98.91 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.296 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.7 p -64.91 -49.41 70.54 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.444 -178.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.33 -39.12 93.27 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 120.52 0.2 . . . . 0.0 110.853 -178.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -59.74 -52.73 64.21 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 123.435 0.694 . . . . 0.0 109.562 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 25.6 m -61.72 -47.15 86.56 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.313 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -58.36 -48.05 81.85 Favored 'General case' 0 CA--C 1.503 -0.839 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.191 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -60.7 -39.86 90.11 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.426 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 84.9 mtp -66.8 -47.71 71.22 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 120.141 -0.624 . . . . 0.0 111.633 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.9 m -75.09 -29.9 22.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -176.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -85.62 -29.52 24.01 Favored 'General case' 0 C--N 1.315 -0.933 0 O-C-N 121.83 -0.543 . . . . 0.0 112.182 -179.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -84.99 -11.71 54.87 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.296 0.57 . . . . 0.0 109.92 178.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.31 123.26 11.41 Favored 'General case' 0 C--O 1.244 0.791 0 C-N-CA 123.7 0.8 . . . . 0.0 112.069 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -74.54 -40.82 61.48 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 177.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -126.57 122.59 35.52 Favored 'General case' 0 N--CA 1.416 -2.169 0 CA-C-N 113.513 -1.676 . . . . 0.0 107.915 -179.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 63.5 mt -97.44 112.5 29.62 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.251 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 177.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.515 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 30.2 mt-10 -113.07 133.8 54.83 Favored 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 120.525 -0.47 . . . . 0.0 109.925 -175.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.0 m -110.93 127.01 68.33 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.693 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 171.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -115.33 128.85 56.37 Favored 'General case' 0 C--N 1.279 -2.495 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -175.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.448 ' CE1' ' HB2' ' A' ' 81' ' ' ARG . 32.2 t80 -97.41 131.86 43.67 Favored 'General case' 0 N--CA 1.414 -2.228 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.458 -175.149 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -85.66 -174.95 5.42 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -75.79 -14.95 60.32 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -175.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -97.93 -116.52 3.57 Favored Glycine 0 C--N 1.313 -0.742 0 C-N-CA 120.19 -1.005 . . . . 0.0 115.586 -172.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -96.07 141.22 29.72 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -175.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.448 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . 19.3 ttm180 -96.82 -22.4 16.95 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 124.145 0.903 . . . . 0.0 108.859 176.668 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.4 p . . . . . 0 C--N 1.3 -1.583 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.985 -177.263 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.53 ' HD3' ' O ' ' A' ' 33' ' ' THR . 10.8 tpp85 . . . . . 0 N--CA 1.433 -1.316 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -76.62 141.17 26.18 Favored Glycine 0 N--CA 1.441 -0.967 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.2 mt -122.95 102.04 7.78 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -178.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -153.13 167.75 28.24 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 -178.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -88.28 141.99 28.11 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 174.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 46.5 mm -111.62 123.42 67.42 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.515 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 13.4 m-85 -118.91 139.0 52.37 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 176.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.63 98.85 8.49 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 174.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.276 4.3 p-10 42.91 43.34 3.48 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.749 1.22 . . . . 0.0 113.714 -175.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.3 -19.48 37.08 Favored Glycine 0 N--CA 1.443 -0.878 0 C-N-CA 120.858 -0.686 . . . . 0.0 113.412 178.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.3 mttp -82.85 113.15 20.28 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 179.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' MET . . . . . 0.461 ' CE ' ' HB2' ' A' ' 101' ' ' GLU . 44.7 ttp -77.48 106.85 9.52 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 45.4 t -59.73 -44.32 93.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.424 -173.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -65.62 -30.05 70.72 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.461 ' HB2' ' CE ' ' A' ' 98' ' ' MET . 7.9 tp10 -62.24 -53.82 49.76 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 173.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.76 -44.5 96.65 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.047 -0.979 . . . . 0.0 112.061 -177.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 90.3 mt -56.64 -51.7 67.7 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.1 t -73.17 -38.02 53.81 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.204 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.586 -177.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.428 ' HB2' ' O ' ' A' ' 101' ' ' GLU . 3.9 tpt180 -69.46 -25.95 64.34 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.164 0.586 . . . . 0.0 111.415 -176.287 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.2 tp60 -95.67 -1.84 49.29 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.265 0.555 . . . . 0.0 109.565 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.426 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 73.23 39.71 51.63 Favored Glycine 0 N--CA 1.442 -0.953 0 CA-C-N 115.316 -0.856 . . . . 0.0 113.597 177.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 78.8 mt -104.24 -10.09 18.14 Favored 'General case' 0 C--N 1.296 -1.756 0 O-C-N 122.431 -0.452 . . . . 0.0 110.337 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -153.17 168.21 26.72 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.824 -177.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.557 ' HG3' ' CZ3' ' B' ' 153' ' ' TRP . 0.9 OUTLIER -99.87 168.07 10.12 Favored 'General case' 0 CA--C 1.492 -1.268 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 176.024 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 12.7 p -93.08 138.12 20.89 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.475 0 N-CA-C 106.576 -1.638 . . . . 0.0 106.576 173.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.282 -2.353 0 N-CA-C 104.458 -2.423 . . . . 0.0 104.458 174.685 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 73.5 m80 . . . . . 0 N--CA 1.472 0.627 0 CA-C-O 119.749 -0.167 . . . . 0.0 111.277 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -51.07 -65.72 0.51 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.789 1.236 . . . . 0.0 109.523 -178.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . 0.556 ' O ' ' HG3' ' B' ' 140' ' ' LYS . 14.6 mm100 -60.86 -47.55 85.88 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.038 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 84.4 mt -58.65 -49.4 77.65 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -175.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 28.6 mt -70.03 -26.61 64.13 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 178.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -71.48 -25.39 62.26 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 119.831 -0.747 . . . . 0.0 110.532 173.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . 0.556 ' HG3' ' O ' ' B' ' 136' ' ' GLN . 29.5 mtpp -72.89 -38.07 67.09 Favored 'General case' 0 C--O 1.243 0.745 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 175.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 15.7 m -60.88 -45.53 94.19 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.322 -0.854 . . . . 0.0 108.805 175.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.468 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 5.0 tt0 -57.9 -58.54 7.92 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.828 176.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -51.58 -50.73 59.57 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.614 0.766 . . . . 0.0 112.537 -176.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 144' ' ' GLN . . . . . 0.427 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 50.5 tt0 -61.37 -47.11 87.35 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.945 -178.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -71.69 -33.04 68.47 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.713 -176.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 146' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 77.3 mttt -64.0 -43.33 96.0 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 175.031 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -60.11 -38.46 83.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.146 178.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 13.3 mm-40 -81.58 -17.93 46.61 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.592 -179.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . 0.468 ' HZ3' ' CG ' ' B' ' 156' ' ' ASP . 31.2 mtpt 54.48 60.99 3.21 Favored 'General case' 0 C--O 1.244 0.78 0 C-N-CA 124.987 1.315 . . . . 0.0 109.342 -174.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 53.4 mt -82.78 116.86 22.31 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 113.591 -1.64 . . . . 0.0 110.841 -176.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 151' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 93.6 m-20 47.44 -89.97 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 125.371 1.469 . . . . 0.0 114.616 174.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 152' ' ' ILE . . . . . 0.405 HG12 ' HE3' ' A' ' 110' ' ' LYS . 6.8 tt -70.46 -27.24 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -175.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 153' ' ' TRP . . . . . 0.557 ' CZ3' ' HG3' ' A' ' 110' ' ' LYS . 56.2 m95 -74.18 -18.41 60.77 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-O 121.646 0.736 . . . . 0.0 110.612 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 8.4 t -87.19 61.66 6.84 Favored 'General case' 0 N--CA 1.426 -1.646 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 176.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -97.3 -4.64 38.33 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 114.795 -1.093 . . . . 0.0 111.688 -179.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 156' ' ' ASP . . . . . 0.468 ' CG ' ' HZ3' ' B' ' 149' ' ' LYS . 6.3 p-10 . . . . . 0 C--N 1.295 -1.774 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . 0.557 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 17.2 m-70 . . . . . 0 CA--C 1.493 -1.24 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.426 ' HG3' ' OE1' ' A' ' 75' ' ' GLU . 18.2 mtmm -93.9 117.92 30.76 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 172.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.482 ' CD ' HH22 ' A' ' 81' ' ' ARG . 9.3 pt-20 -127.85 139.14 34.5 Favored Pre-proline 0 C--N 1.28 -2.44 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 17.0 Cg_exo -67.76 142.98 59.8 Favored 'Trans proline' 0 C--O 1.25 1.096 0 C-N-CA 122.443 2.095 . . . . 0.0 113.309 -178.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -134.43 159.27 41.61 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.421 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 7.0 m -96.91 138.62 34.17 Favored 'General case' 0 N--CA 1.423 -1.818 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 179.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 49.8 tp -84.97 124.01 31.19 Favored 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 120.164 -0.614 . . . . 0.0 109.5 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 75.1 mt -84.72 -52.69 12.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.532 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 174.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -179.02 163.6 1.35 Allowed 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 115.177 -0.919 . . . . 0.0 108.993 175.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.451 ' HB1' ' HG2' ' A' ' 63' ' ' LYS . . . -107.28 126.08 51.98 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 174.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.411 ' HB ' ' HB ' ' A' ' 22' ' ' THR . 44.8 mm -78.44 -64.13 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -175.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -113.25 -161.62 0.77 Allowed 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 178.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -97.47 27.27 19.44 Favored Glycine 0 C--N 1.296 -1.649 0 N-CA-C 108.863 -1.695 . . . . 0.0 108.863 169.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.715 ' OD2' ' HD2' ' A' ' 35' ' ' ARG . 4.9 t70 -143.78 -62.19 0.39 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 -171.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.411 ' HB ' ' HB ' ' A' ' 18' ' ' ILE . 1.8 m -83.77 128.22 34.38 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 114.631 -1.168 . . . . 0.0 108.75 178.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.4 m -133.23 155.65 41.07 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 C-N-CA 122.78 0.432 . . . . 0.0 110.656 -177.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -119.61 112.11 18.91 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 -176.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.1 mp -126.0 159.5 32.54 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.519 0.676 . . . . 0.0 112.532 -176.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.421 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 25.3 ttt -127.62 102.78 6.99 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.464 -1.244 . . . . 0.0 108.741 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -105.1 119.1 38.21 Favored 'General case' 0 C--N 1.287 -2.127 0 C-N-CA 118.931 -1.108 . . . . 0.0 109.867 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 88.2 mttt 59.43 27.92 17.17 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 122.092 0.948 . . . . 0.0 110.754 175.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.436 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 93.07 7.04 62.75 Favored Glycine 0 N--CA 1.439 -1.114 0 CA-C-N 114.619 -1.173 . . . . 0.0 113.245 179.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -105.57 101.42 32.02 Favored Pre-proline 0 C--N 1.31 -1.127 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.436 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 5.5 Cg_exo -79.67 118.3 3.82 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 122.628 2.219 . . . . 0.0 110.47 177.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 63.7 mtt -136.1 149.0 48.52 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.092 0.472 . . . . 0.0 110.819 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.6 m -83.87 107.48 16.28 Favored 'General case' 0 N--CA 1.427 -1.579 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 176.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -101.99 163.78 12.06 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-O 121.602 0.715 . . . . 0.0 110.246 -177.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.715 ' HD2' ' OD2' ' A' ' 21' ' ' ASP . 25.3 ttp85 -137.46 141.79 41.58 Favored 'General case' 0 C--N 1.27 -2.88 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 169.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.492 ' HB2' ' HB ' ' A' ' 39' ' ' VAL . 28.6 mt -60.94 109.43 1.07 Allowed 'General case' 0 C--N 1.307 -1.261 0 O-C-N 124.115 0.884 . . . . 0.0 109.213 -177.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.4 tt -63.71 126.29 27.1 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 -179.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 91.0 mt 85.99 8.48 0.31 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.16 1.784 . . . . 0.0 113.85 -178.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.492 ' HB ' ' HB2' ' A' ' 36' ' ' LEU . 99.7 t -118.33 130.93 72.48 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.15 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 176.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -133.53 107.86 8.27 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 177.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.8 m . . . . . 0 CA--C 1.569 1.68 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -177.002 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.365 0 N-CA-C 115.186 0.834 . . . . 0.0 115.186 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -56.49 -32.08 88.24 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 123.035 2.49 . . . . 0.0 113.984 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -68.21 -57.1 6.55 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.918 0.39 . . . . 0.0 111.616 -176.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.3 -41.41 98.95 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.559 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 37.0 m -63.96 -35.69 81.5 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.137 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.94 -37.86 88.71 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.023 0.44 . . . . 0.0 110.333 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -68.91 -53.09 22.98 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.774 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 28.5 m -57.11 -48.11 79.45 Favored 'General case' 0 C--N 1.318 -0.79 0 O-C-N 124.101 0.876 . . . . 0.0 112.306 -178.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.465 ' O ' ' HG3' ' A' ' 67' ' ' GLU . 51.8 mttp -60.61 -54.54 44.16 Favored 'General case' 0 C--N 1.344 0.359 0 C-N-CA 120.962 -0.295 . . . . 0.0 110.963 -178.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.518 ' HB2' ' HZ2' ' A' ' 64' ' ' LYS . 10.6 mtmp? -67.5 -23.24 65.45 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 15.5 tpt -67.05 -45.11 78.4 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.21 0.529 . . . . 0.0 109.629 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.0 m -86.93 -26.13 6.06 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.438 -178.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' A' ' 63' ' ' LYS . 51.0 mt-10 -73.9 -34.15 64.29 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.368 177.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -83.96 -16.34 44.47 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 121.01 0.433 . . . . 0.0 110.415 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.74 143.12 48.03 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.018 -178.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 44.2 mttp -74.44 -44.31 52.34 Favored 'General case' 0 CA--C 1.493 -1.236 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt -133.78 147.35 51.26 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-N 113.846 -1.524 . . . . 0.0 107.047 -179.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.408 ' O ' ' HA ' ' A' ' 11' ' ' PRO . 4.0 mp -105.9 120.99 57.67 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.719 0 N-CA-C 105.106 -2.183 . . . . 0.0 105.106 173.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.532 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 23.9 mm-40 -111.83 132.95 54.36 Favored 'General case' 0 C--N 1.292 -1.908 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 -175.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.6 m -112.3 129.72 67.32 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.989 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 175.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.557 ' HA ' ' O ' ' A' ' 8' ' ' HIS . 28.4 tt0 -106.52 118.97 38.04 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 119.525 -0.87 . . . . 0.0 111.229 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -87.24 124.24 33.1 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-N 113.395 -1.729 . . . . 0.0 109.232 177.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -88.31 -175.58 5.06 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 177.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.55 -3.81 56.08 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -173.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -93.2 -87.67 1.59 Allowed Glycine 0 N--CA 1.435 -1.421 0 C-N-CA 119.913 -1.137 . . . . 0.0 112.473 -177.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -125.59 139.24 53.75 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -175.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.482 HH22 ' CD ' ' A' ' 10' ' ' GLU . 25.6 ttt180 -98.96 -13.35 19.99 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.648 0.737 . . . . 0.0 109.129 178.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 13.6 p . . . . . 0 C--N 1.311 -1.101 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.333 177.255 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 12.2 mmt85 . . . . . 0 N--CA 1.433 -1.298 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -74.78 121.22 6.62 Favored Glycine 0 N--CA 1.425 -2.033 0 O-C-N 123.712 0.632 . . . . 0.0 111.575 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.3 mt -103.58 93.05 4.72 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 178.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -145.13 155.08 43.1 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -179.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -85.25 132.04 34.33 Favored 'General case' 0 C--N 1.29 -2.02 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 48.3 mm -99.5 126.38 52.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 C-N-CA 119.247 -0.981 . . . . 0.0 110.073 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.584 ' CE2' ' HG3' ' A' ' 98' ' ' MET . 27.0 m-85 -120.3 144.07 48.01 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 114.682 -1.145 . . . . 0.0 109.125 179.078 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -106.67 99.54 9.11 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 176.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.5 p30 42.79 38.31 1.32 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 125.146 1.378 . . . . 0.0 113.907 -176.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.78 -11.4 38.35 Favored Glycine 0 N--CA 1.444 -0.785 0 CA-C-N 115.449 -0.796 . . . . 0.0 114.131 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -87.63 135.27 33.43 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 176.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' MET . . . . . 0.584 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 3.6 mpp? -80.4 111.69 17.04 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 177.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 82.8 t -70.14 -45.63 75.28 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 19.1 m-20 -55.35 -50.13 70.46 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.421 -179.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.439 ' O ' ' HB2' ' A' ' 105' ' ' ARG . 9.3 tp10 -55.8 -51.01 68.94 Favored 'General case' 0 C--O 1.211 -0.96 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.226 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.93 -43.29 95.04 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.829 -176.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 79.0 mt -60.29 -48.98 79.42 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 179.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 52.1 t -73.06 -31.5 35.47 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.47 -178.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.439 ' HB2' ' O ' ' A' ' 101' ' ' GLU . 1.8 tpt180 -72.57 -28.02 62.55 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.997 -178.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -87.51 -8.7 56.06 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.239 0.543 . . . . 0.0 109.76 175.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.97 41.52 87.48 Favored Glycine 0 N--CA 1.431 -1.695 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.186 -176.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 90.7 mt -96.89 -18.21 19.66 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.063 0.459 . . . . 0.0 110.768 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -149.7 171.32 16.88 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -176.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -110.2 171.55 7.38 Favored 'General case' 0 N--CA 1.425 -1.678 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 8.0 p -84.01 133.35 29.39 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.782 0 CA-C-O 121.066 0.46 . . . . 0.0 110.359 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.486 -1.503 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 176.403 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 63.0 m80 . . . . . 0 N--CA 1.448 -0.53 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -66.66 -38.03 86.01 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.902 -176.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -58.52 -37.93 76.65 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.153 -178.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.1 mt -64.83 -51.09 64.01 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.811 -178.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 8.2 mp -70.25 -23.26 62.87 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 178.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 84.9 mtt-85 -66.03 -31.24 72.02 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.278 -0.569 . . . . 0.0 110.537 174.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . 0.482 ' HE2' ' HA ' ' B' ' 140' ' ' LYS . 10.8 mmpt? -71.35 -39.7 71.15 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 176.022 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 3.5 m -59.99 -49.73 76.52 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.672 177.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.555 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 0.8 OUTLIER -64.22 -43.17 95.79 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.838 179.04 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -61.66 -40.93 96.68 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.995 0.426 . . . . 0.0 110.888 179.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -69.21 -48.02 63.19 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.453 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.55 -32.49 73.87 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.564 -0.743 . . . . 0.0 112.081 -175.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 146' ' ' LYS . . . . . 0.555 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 84.0 mttt -65.33 -40.38 93.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.498 0.19 . . . . 0.0 110.648 174.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm -64.79 -37.88 89.11 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.501 0.667 . . . . 0.0 109.582 178.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 49.3 mm-40 -79.24 -13.87 59.41 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 114.709 -1.132 . . . . 0.0 113.043 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm 54.32 47.49 22.86 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.54 0.736 . . . . 0.0 109.834 -178.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 96.3 mt -74.98 95.59 3.02 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 114.943 -1.026 . . . . 0.0 112.0 -174.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 51.9 t30 53.92 -69.84 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 127.775 2.43 . . . . 0.0 114.154 173.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 12.0 tt -75.84 -28.74 19.48 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.075 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -78.13 -15.58 58.73 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.365 0.602 . . . . 0.0 111.407 -178.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 22.9 t -88.8 11.09 18.77 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.548 177.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -66.79 -28.73 68.62 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.147 0.579 . . . . 0.0 112.41 -178.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.1 t70 . . . . . 0 C--N 1.299 -1.592 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 -170.577 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . 0.415 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 7.7 m-70 . . . . . 0 CA--C 1.494 -1.209 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.52 107.48 15.21 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 105.022 -2.214 . . . . 0.0 105.022 175.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -138.99 159.0 68.73 Favored Pre-proline 0 C--N 1.3 -1.582 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.454 -173.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -78.94 147.17 21.06 Favored 'Trans proline' 0 C--O 1.25 1.075 0 C-N-CA 122.729 2.286 . . . . 0.0 114.123 -174.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -144.14 155.59 43.99 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.343 177.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.424 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 9.1 m -104.35 142.67 34.16 Favored 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 179.108 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -84.22 142.9 29.95 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 118.109 -1.437 . . . . 0.0 109.538 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 70.4 mt -103.0 -57.59 4.4 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.055 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 171.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 51.1 mttm -152.57 154.14 34.81 Favored 'General case' 0 N--CA 1.428 -1.536 0 C-N-CA 124.013 0.925 . . . . 0.0 110.552 -178.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.403 ' HB2' ' HG2' ' A' ' 63' ' ' LYS . . . -108.8 95.97 6.01 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 105.824 -1.917 . . . . 0.0 105.824 169.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 60.5 mt -68.4 -37.67 78.21 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.923 -171.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.417 ' CG ' ' H ' ' A' ' 20' ' ' GLY . 20.6 t70 -152.44 -165.03 2.09 Favored 'General case' 0 C--N 1.291 -1.97 0 N-CA-C 106.366 -1.716 . . . . 0.0 106.366 -176.12 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.417 ' H ' ' CG ' ' A' ' 19' ' ' ASP . . . -90.96 -25.76 23.82 Favored Glycine 0 C--N 1.286 -2.206 0 N-CA-C 109.029 -1.628 . . . . 0.0 109.029 176.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.709 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 10.5 t70 -92.87 -36.32 12.88 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 122.035 0.922 . . . . 0.0 109.504 -177.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.8 m -114.13 127.29 55.85 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 114.902 -1.045 . . . . 0.0 111.294 -173.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.9 p -132.79 153.75 38.54 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.629 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -178.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -112.85 112.96 24.82 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 -175.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -115.75 159.1 21.86 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.764 0.792 . . . . 0.0 111.737 -178.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.424 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 46.7 ttm -123.01 104.85 9.49 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 175.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -109.87 118.13 35.67 Favored 'General case' 0 C--N 1.286 -2.158 0 C-N-CA 118.147 -1.421 . . . . 0.0 109.626 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 78.9 mttt 62.41 27.69 16.46 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.222 1.009 . . . . 0.0 110.199 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.08 1.86 64.74 Favored Glycine 0 CA--C 1.524 0.598 0 CA-C-N 115.365 -0.834 . . . . 0.0 113.164 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -104.11 107.55 57.5 Favored Pre-proline 0 C--N 1.32 -0.68 0 O-C-N 122.462 -0.434 . . . . 0.0 110.48 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -83.23 120.31 2.9 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.119 2.546 . . . . 0.0 111.992 178.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' MET . . . . . 0.475 ' HB2' ' CE2' ' A' ' 34' ' ' PHE . 90.4 mtp -134.82 156.35 49.04 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 120.892 0.377 . . . . 0.0 110.273 178.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.2 m -92.98 119.5 32.31 Favored 'General case' 0 C--N 1.295 -1.786 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.475 ' CE2' ' HB2' ' A' ' 32' ' ' MET . 86.0 m-85 -116.78 142.57 46.75 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -176.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.709 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 31.6 mtm105 -106.3 153.89 21.54 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 166.119 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.521 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 73.9 mt -83.82 129.4 34.94 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-O 121.651 0.738 . . . . 0.0 112.464 -175.027 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.5 mt -57.04 130.29 45.45 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.452 176.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.593 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 78.5 mt 73.55 11.27 4.79 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 124.551 1.157 . . . . 0.0 112.481 177.603 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 86.3 t -110.84 131.05 63.08 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 CA-C-O 121.252 0.548 . . . . 0.0 110.646 -179.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -128.31 107.17 9.54 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 174.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.524 ' HB ' ' HB2' ' A' ' 21' ' ' ASP . 1.3 m . . . . . 0 C--N 1.287 -2.11 0 CA-C-O 118.139 -0.934 . . . . 0.0 112.357 175.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 1.643 0 CA-C-O 119.141 -0.811 . . . . 0.0 113.451 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo -56.26 -36.34 96.73 Favored 'Trans proline' 0 C--N 1.373 1.837 0 C-N-CA 122.911 2.407 . . . . 0.0 112.517 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.8 mp0 -62.36 -51.77 66.3 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 122.973 0.509 . . . . 0.0 110.406 178.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.29 -41.64 85.07 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.841 -178.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.0 m -67.83 -33.97 75.81 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.395 0.617 . . . . 0.0 111.357 -177.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.478 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -70.95 -39.07 72.8 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.042 175.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -62.8 -41.95 99.5 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.318 -176.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.534 ' O ' HG22 ' A' ' 66' ' ' VAL . 7.5 p -63.47 -44.61 93.92 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.85 178.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.494 ' NZ ' ' HB3' ' A' ' 63' ' ' LYS . 9.1 mtpm? -57.67 -49.03 77.84 Favored 'General case' 0 CA--C 1.513 -0.475 0 O-C-N 123.385 0.428 . . . . 0.0 110.472 176.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.478 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 97.1 mttt -57.36 -39.89 76.92 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.139 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.407 ' HE2' ' HA ' ' A' ' 65' ' ' MET . 1.6 mmt -72.19 -51.38 21.44 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 179.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.534 HG22 ' O ' ' A' ' 62' ' ' THR . 34.6 m -74.33 -27.21 21.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 -174.018 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -86.19 -20.15 28.98 Favored 'General case' 0 C--N 1.314 -0.953 0 O-C-N 121.847 -0.533 . . . . 0.0 110.577 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -83.59 -24.66 31.4 Favored 'General case' 0 C--O 1.245 0.856 0 CA-C-O 121.158 0.504 . . . . 0.0 109.822 174.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.57 131.25 38.32 Favored 'General case' 0 C--O 1.248 1.013 0 CA-C-N 114.819 -1.082 . . . . 0.0 112.027 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -82.99 -37.49 23.94 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 115.117 -0.947 . . . . 0.0 108.69 177.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -133.09 119.8 20.46 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.781 -1.1 . . . . 0.0 108.182 -178.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 63.4 mt -99.51 112.56 32.17 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.658 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -114.31 142.14 46.7 Favored 'General case' 0 C--N 1.289 -2.023 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.083 -177.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -110.34 124.95 67.53 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.756 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.415 ' HA ' ' O ' ' A' ' 8' ' ' HIS . 34.2 tt0 -115.28 125.62 53.51 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -96.55 129.18 43.98 Favored 'General case' 0 N--CA 1.406 -2.627 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.851 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -85.51 -174.37 5.14 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 125.117 1.367 . . . . 0.0 110.031 -176.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.642 ' NZ ' ' HA ' ' A' ' 78' ' ' LYS . 1.1 mmpm? -94.78 7.85 44.52 Favored 'General case' 0 C--N 1.313 -0.993 0 O-C-N 121.458 -0.776 . . . . 0.0 112.144 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -84.15 -137.2 3.43 Favored Glycine 0 N--CA 1.428 -1.867 0 C-N-CA 120.775 -0.726 . . . . 0.0 111.899 175.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -95.23 144.22 26.01 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.6 ttm180 -87.07 -29.18 22.09 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.162 0.506 . . . . 0.0 110.528 178.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.0 p . . . . . 0 C--N 1.294 -1.829 0 CA-C-O 121.353 0.597 . . . . 0.0 111.561 -178.152 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.413 ' HG2' ' HG3' ' A' ' 35' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.509 -0.598 0 CA-C-O 121.326 0.584 . . . . 0.0 110.176 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -103.76 152.28 17.79 Favored Glycine 0 N--CA 1.42 -2.374 0 N-CA-C 106.859 -2.496 . . . . 0.0 106.859 168.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 93.6 mt -109.03 122.5 47.39 Favored 'General case' 0 C--N 1.282 -2.333 0 CA-C-N 117.972 0.886 . . . . 0.0 110.442 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -144.16 157.85 44.06 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.116 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.482 ' CZ ' ' HB2' ' A' ' 100' ' ' ASN . 4.3 t80 -103.83 129.73 51.32 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 105.546 -2.02 . . . . 0.0 105.546 174.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 41.6 mm -99.32 125.73 52.8 Favored 'Isoleucine or valine' 0 C--O 1.249 1.042 0 C-N-CA 119.731 -0.788 . . . . 0.0 111.892 -178.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -110.79 131.6 54.91 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.983 173.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.67 98.26 8.03 Favored 'General case' 0 C--N 1.289 -2.052 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 175.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.251 4.1 p30 44.92 32.12 0.79 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.209 1.404 . . . . 0.0 114.137 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.21 2.16 35.77 Favored Glycine 0 CA--C 1.521 0.442 0 CA-C-N 115.676 -0.693 . . . . 0.0 113.445 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.7 mttp -99.78 126.88 45.92 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 175.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -78.13 105.5 9.39 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 122.815 0.446 . . . . 0.0 110.401 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 57.6 t -71.51 -43.05 72.46 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.332 -178.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.521 ' ND2' ' HB3' ' A' ' 36' ' ' LEU . 1.7 m-20 -58.76 -49.82 76.2 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.957 -178.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -63.84 -37.16 86.34 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.542 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.55 -44.6 93.19 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.898 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.13 -52.75 64.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.747 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.1 t -65.05 -41.45 92.02 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.276 -177.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 34.4 ttp85 -64.23 -31.98 73.39 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.922 0.391 . . . . 0.0 111.291 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -87.99 -1.05 57.75 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.954 0.354 . . . . 0.0 111.954 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.411 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 74.44 22.14 77.85 Favored Glycine 0 N--CA 1.441 -0.997 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.428 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.3 mt -91.67 -6.24 52.44 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -151.85 162.95 40.22 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.005 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt -120.34 154.74 34.62 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 178.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.6 p -76.98 127.97 37.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 C-N-CA 118.656 -1.218 . . . . 0.0 112.28 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.593 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . . . . . . 0 C--N 1.299 -1.603 0 N-CA-C 105.225 -2.139 . . . . 0.0 105.225 171.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 69.9 m80 . . . . . 0 C--O 1.223 -0.309 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -60.64 -59.84 4.75 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.467 -174.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . 0.446 ' O ' ' HG2' ' B' ' 140' ' ' LYS . 13.7 mm100 -54.99 -44.57 74.6 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 123.946 0.779 . . . . 0.0 111.885 -176.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 91.2 mt -60.24 -47.4 86.14 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.652 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.58 -35.5 75.4 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 178.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -60.62 -45.21 94.89 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 120.759 0.314 . . . . 0.0 110.296 176.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . 0.446 ' HG2' ' O ' ' B' ' 136' ' ' GLN . 2.8 mmmp? -63.43 -44.91 93.21 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.436 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 8.1 p -70.2 -41.07 74.17 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.327 -178.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.518 ' HG3' ' CZ2' ' B' ' 153' ' ' TRP . 39.3 tt0 -65.94 -44.84 83.86 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.516 177.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -54.29 -43.4 71.03 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 120.999 0.428 . . . . 0.0 110.591 -179.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -64.73 -46.85 80.47 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.526 178.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.13 -35.73 80.36 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.915 -178.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 146' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 88.8 mttt -62.33 -38.77 90.76 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.971 0.415 . . . . 0.0 110.334 176.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . 0.458 ' HB3' ' HZ2' ' B' ' 147' ' ' LYS . 9.9 mtpm? -63.99 -40.63 96.79 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.226 179.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -86.35 -8.12 57.94 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.337 -175.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . 0.517 ' O ' ' HB2' ' B' ' 154' ' ' SER . 51.0 mtpt 49.7 58.83 5.0 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 124.092 0.957 . . . . 0.0 111.119 -177.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 90.8 mt -88.52 119.51 29.04 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.299 -178.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 151' ' ' ASN . . . . . 0.411 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 90.9 m-20 52.5 -93.46 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.163 1.385 . . . . 0.0 113.885 176.021 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 35.3 mt -65.64 -31.4 53.61 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.593 0 CA-C-O 121.087 0.47 . . . . 0.0 110.569 178.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 153' ' ' TRP . . . . . 0.518 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 58.8 m95 -77.94 -6.49 54.54 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-O 122.101 0.953 . . . . 0.0 111.117 -178.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 154' ' ' SER . . . . . 0.517 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 19.9 t -99.87 18.62 17.87 Favored 'General case' 0 N--CA 1.411 -2.4 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.14 175.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -71.25 -17.62 62.48 Favored 'General case' 0 C--N 1.356 0.86 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 173.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.1 t70 . . . . . 0 CA--C 1.5 -0.966 0 CA-C-N 113.339 -1.755 . . . . 0.0 112.1 175.08 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 25.5 p80 . . . . . 0 C--O 1.232 0.148 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.491 ' H ' ' HD3' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -94.49 132.23 39.37 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 174.7 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -117.38 144.37 33.85 Favored Pre-proline 0 C--N 1.262 -3.217 0 CA-C-N 114.423 -1.262 . . . . 0.0 110.847 -175.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.92 138.91 65.34 Favored 'Trans proline' 0 C--N 1.359 1.098 0 C-N-CA 123.07 2.514 . . . . 0.0 114.301 -174.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.572 ' O ' ' HB ' ' A' ' 72' ' ' ILE . . . -136.08 151.68 50.08 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.488 178.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 86.7 m -98.94 133.2 43.55 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 178.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -80.93 141.31 34.64 Favored 'General case' 0 C--N 1.306 -1.292 0 C-N-CA 118.498 -1.281 . . . . 0.0 109.255 177.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 74.1 mt -101.36 -53.56 7.51 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 175.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -161.67 156.99 23.82 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.489 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.54 119.11 37.06 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 174.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 59.8 mt -85.71 -64.03 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 CA-C-O 121.192 0.52 . . . . 0.0 109.747 -175.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -135.93 -168.79 2.28 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.172 -0.922 . . . . 0.0 108.526 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -74.11 -22.54 77.69 Favored Glycine 0 C--N 1.314 -0.661 0 C-N-CA 120.657 -0.783 . . . . 0.0 112.615 -177.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.421 ' HB2' ' NE ' ' A' ' 35' ' ' ARG . 9.6 p-10 -100.63 -20.36 15.69 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 122.304 0.242 . . . . 0.0 110.756 -176.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 p -127.73 118.8 24.46 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.3 m -128.11 157.45 40.33 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.916 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 176.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -119.89 119.22 32.87 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -178.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.9 mp -125.25 159.57 31.33 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.501 0.667 . . . . 0.0 112.2 -175.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.447 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 48.0 ttm -122.8 107.09 11.51 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 124.177 0.991 . . . . 0.0 108.497 177.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -113.18 126.89 55.93 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.9 mttt 59.0 27.66 16.66 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 121.613 0.721 . . . . 0.0 111.0 178.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 88.03 7.05 74.49 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.749 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.447 ' O ' ' HA ' ' A' ' 26' ' ' MET . 17.6 mm-40 -103.88 104.11 41.11 Favored Pre-proline 0 C--N 1.319 -0.74 0 O-C-N 122.422 -0.457 . . . . 0.0 110.511 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -81.07 113.83 2.77 Favored 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.623 2.215 . . . . 0.0 110.685 176.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 65.6 mtt -135.14 149.85 50.07 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.6 m -87.75 129.68 35.09 Favored 'General case' 0 C--N 1.295 -1.804 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 175.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -113.51 138.9 49.47 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -173.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.421 ' NE ' ' HB2' ' A' ' 21' ' ' ASP . 10.6 tpp85 -107.99 129.46 55.12 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 106.324 -1.732 . . . . 0.0 106.324 168.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.9 mp -64.94 122.02 16.02 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.5 0.667 . . . . 0.0 111.066 178.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.4 tt -66.35 130.18 42.33 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.98 -1.009 . . . . 0.0 108.699 -177.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.447 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 70.3 mt 79.5 8.16 1.76 Allowed 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 124.938 1.295 . . . . 0.0 111.611 -177.281 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 54.2 t -115.41 126.44 72.97 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 CA-C-O 121.175 0.512 . . . . 0.0 110.543 179.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -141.68 108.01 5.27 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.325 175.121 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.3 m . . . . . 0 C--N 1.282 -2.351 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.143 173.159 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.863 0 CA-C-O 119.121 -0.821 . . . . 0.0 113.157 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -54.44 -38.74 89.66 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 122.776 2.317 . . . . 0.0 111.852 176.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -63.25 -56.82 13.35 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.737 178.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.48 -51.07 69.85 Favored 'General case' 0 CA--C 1.516 -0.351 0 O-C-N 124.018 0.824 . . . . 0.0 111.943 -176.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.511 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 13.9 p -64.8 -44.46 89.87 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.846 -0.616 . . . . 0.0 112.661 -177.099 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.404 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -69.98 -34.81 73.84 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -59.66 -49.22 78.58 Favored 'General case' 0 C--O 1.244 0.767 0 C-N-CA 123.116 0.566 . . . . 0.0 110.758 -177.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.9 m -61.6 -42.02 98.27 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.138 178.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.511 ' HG3' ' O ' ' A' ' 59' ' ' SER . 29.7 mtpp -57.28 -46.79 82.79 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.646 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.404 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 97.6 mttt -65.89 -42.43 90.29 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.641 -0.708 . . . . 0.0 111.331 -178.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.1 mmt -64.05 -44.71 91.66 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 123.557 0.536 . . . . 0.0 112.373 -179.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.5 m -72.38 -29.23 30.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -176.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -82.65 -26.97 31.66 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 119.915 -0.714 . . . . 0.0 110.979 178.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -73.08 -27.87 61.97 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.51 ' HA ' ' OD1' ' A' ' 95' ' ' ASP . . . -55.09 121.02 7.85 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 114.63 -1.168 . . . . 0.0 112.481 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.449 ' HD2' ' N ' ' A' ' 70' ' ' LYS . 9.3 mptt -82.88 -31.09 28.07 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 174.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.6 mtpp -127.21 126.97 43.71 Favored 'General case' 0 N--CA 1.426 -1.64 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.572 ' HB ' ' O ' ' A' ' 12' ' ' ALA . 3.7 mp -113.64 113.15 43.1 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.194 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 178.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.472 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 24.8 mt-10 -113.01 137.46 51.37 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 -177.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.1 m -110.29 127.04 67.53 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 177.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -114.11 140.45 48.48 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.717 -175.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -109.92 116.82 32.31 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 124.204 1.002 . . . . 0.0 110.963 -177.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -88.36 -174.28 4.55 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 176.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -60.1 -13.08 10.12 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -175.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -76.6 -151.08 3.73 Favored Glycine 0 C--N 1.313 -0.706 0 CA-C-O 121.497 0.499 . . . . 0.0 114.155 -173.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -89.81 155.86 18.88 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 42.4 ttt180 -91.75 -3.51 56.12 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 122.357 1.075 . . . . 0.0 108.615 178.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.8 p . . . . . 0 N--CA 1.438 -1.058 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.566 179.331 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.443 -0.787 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -112.79 144.64 18.02 Favored Glycine 0 N--CA 1.42 -2.403 0 N-CA-C 108.789 -1.724 . . . . 0.0 108.789 171.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 59.4 mt -101.64 110.48 22.48 Favored 'General case' 0 CA--C 1.491 -1.307 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 178.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.12 155.47 32.6 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 177.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . 0.302 54.2 p90 -110.06 140.84 43.68 Favored 'General case' 0 N--CA 1.424 -1.746 0 C-N-CA 119.241 -0.983 . . . . 0.0 112.456 176.205 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 34.4 mm -98.92 131.0 46.96 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 CA-C-N 115.551 -0.749 . . . . 0.0 112.695 -166.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.472 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 82.8 m-85 -107.66 127.67 53.87 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 168.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.15 99.4 9.02 Favored 'General case' 0 C--N 1.289 -2.05 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 176.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.51 ' OD1' ' HA ' ' A' ' 69' ' ' ALA . 6.2 p-10 45.01 41.72 5.68 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.09 1.356 . . . . 0.0 113.191 -178.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.95 -23.39 27.74 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.293 -0.867 . . . . 0.0 113.337 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -87.52 113.65 23.4 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' MET . . . . . 0.429 ' CE ' ' HB2' ' A' ' 101' ' ' GLU . 52.2 ttp -74.99 105.42 6.0 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 45.2 t -64.12 -29.82 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-O 121.679 0.752 . . . . 0.0 109.665 -175.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -61.08 -40.07 92.32 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.067 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.495 ' OE2' ' HD3' ' A' ' 105' ' ' ARG . 11.4 tp10 -64.94 -54.05 36.75 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 114.883 -1.053 . . . . 0.0 108.338 176.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -53.1 -48.38 67.84 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.112 -0.949 . . . . 0.0 113.129 -176.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 85.1 mt -59.87 -48.14 82.89 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 78.7 t -73.01 -35.06 47.57 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 CA-C-O 120.981 0.42 . . . . 0.0 110.292 -178.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.495 ' HD3' ' OE2' ' A' ' 101' ' ' GLU . 4.0 tpt180 -65.5 -41.05 93.65 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 123.388 0.675 . . . . 0.0 110.174 -178.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -83.99 -3.1 57.75 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.887 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.98 39.05 85.31 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 121.077 -0.582 . . . . 0.0 112.744 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 92.3 mt -102.17 4.4 39.43 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-O 121.938 0.875 . . . . 0.0 109.586 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -165.18 165.36 19.8 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 114.513 -1.221 . . . . 0.0 107.862 178.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.415 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 83.1 mttt -111.53 165.75 11.73 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 174.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.447 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 78.1 t -76.76 136.46 24.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.631 177.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.379 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.976 179.971 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 . . . . . 0 CA--C 1.504 -0.804 0 CA-C-O 120.973 0.416 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.537 ' OE2' ' HD2' ' B' ' 139' ' ' ARG . 2.4 tm-20 -69.15 -47.92 63.72 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.373 -178.527 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -63.84 -33.32 75.43 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.354 0.597 . . . . 0.0 110.516 176.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 78.8 mt -70.41 -50.57 37.19 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.729 -177.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.21 -33.6 75.71 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.713 0.292 . . . . 0.0 111.586 177.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 139' ' ' ARG . . . . . 0.537 ' HD2' ' OE2' ' B' ' 135' ' ' GLU . 84.2 mtt180 -66.81 -27.92 67.95 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 177.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 28.5 ttpp -71.37 -39.88 70.96 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 177.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 15.2 m -62.39 -45.66 92.15 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 114.832 -1.076 . . . . 0.0 109.249 175.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.502 ' HG3' ' CZ2' ' B' ' 153' ' ' TRP . 40.2 tt0 -59.44 -48.08 83.01 Favored 'General case' 0 C--O 1.204 -1.291 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.652 177.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -56.65 -40.97 76.42 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 122.693 0.397 . . . . 0.0 110.993 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -67.78 -47.37 69.34 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.04 178.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -64.15 -34.06 77.21 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.707 -178.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 146' ' ' LYS . . . . . 0.5 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 89.8 mttt -61.87 -46.88 87.48 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 177.248 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -69.85 -35.41 74.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.222 -177.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 59.7 mm-40 -74.36 -17.25 60.85 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.195 177.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt 57.03 56.51 5.25 Favored 'General case' 0 CA--C 1.514 -0.424 0 C-N-CA 124.785 1.234 . . . . 0.0 110.49 -178.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 91.8 mt -91.55 121.37 33.18 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.76 -176.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 51.24 -92.51 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 125.481 1.513 . . . . 0.0 113.898 178.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 24.5 mt -65.2 -33.98 67.37 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.899 0 CA-C-O 121.058 0.456 . . . . 0.0 110.979 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 153' ' ' TRP . . . . . 0.502 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 63.7 m95 -75.96 -6.09 49.31 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.573 0.701 . . . . 0.0 111.465 -177.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 42.3 t -92.72 16.31 12.57 Favored 'General case' 0 N--CA 1.425 -1.704 0 CA-C-N 115.433 -0.803 . . . . 0.0 108.916 174.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -63.03 -21.79 66.41 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.494 0.664 . . . . 0.0 110.11 174.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 . . . . . 0 N--CA 1.427 -1.592 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 176.989 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 83.8 t60 . . . . . 0 N--CA 1.435 -1.192 0 CA-C-O 121.277 0.56 . . . . 0.0 112.035 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -116.13 159.62 21.5 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.042 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -134.71 159.8 70.81 Favored Pre-proline 0 C--N 1.3 -1.551 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 178.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -81.68 140.51 11.75 Favored 'Trans proline' 0 C--O 1.244 0.824 0 C-N-CA 123.007 2.472 . . . . 0.0 111.138 175.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -127.64 162.87 25.51 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.805 178.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.481 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 36.5 m -98.16 131.47 44.51 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.6 tp -84.28 122.19 28.55 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 -179.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 72.4 mt -93.0 -59.74 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.501 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -161.22 143.58 12.24 Favored 'General case' 0 N--CA 1.416 -2.128 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.055 -178.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -96.25 108.31 20.77 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 105.966 -1.864 . . . . 0.0 105.966 171.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 70.6 mt -81.85 -53.87 11.08 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.417 0 CA-C-O 121.345 0.593 . . . . 0.0 110.795 -173.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -128.55 -175.35 3.5 Favored 'General case' 0 C--N 1.295 -1.803 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 -179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -94.98 46.43 2.06 Favored Glycine 0 C--N 1.304 -1.218 0 N-CA-C 108.571 -1.812 . . . . 0.0 108.571 173.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.572 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 9.6 t70 -171.48 -52.74 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 105.926 -1.879 . . . . 0.0 105.926 -172.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 m -91.54 118.49 30.64 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 113.868 -1.514 . . . . 0.0 110.56 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.4 m -133.16 151.04 33.27 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.931 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 177.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -116.03 116.04 27.18 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 -177.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.9 mp -123.93 159.06 30.55 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.274 0.559 . . . . 0.0 111.028 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.481 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 57.2 ttp -120.67 111.83 18.12 Favored 'General case' 0 C--N 1.293 -1.862 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 175.127 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 44.1 p90 -106.93 110.34 22.46 Favored 'General case' 0 CA--C 1.485 -1.523 0 C-N-CA 119.163 -1.015 . . . . 0.0 110.748 -178.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 97.2 mttt 53.43 38.99 29.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.716 -178.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.495 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 95.26 2.18 62.25 Favored Glycine 0 N--CA 1.448 -0.535 0 CA-C-N 113.796 -1.547 . . . . 0.0 113.766 177.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.446 ' O ' ' HA ' ' A' ' 26' ' ' MET . 2.4 mp0 -100.48 97.56 6.69 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 117.0 0.4 . . . . 0.0 110.545 177.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.495 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 1.8 Cg_endo -83.39 105.51 1.27 Allowed 'Trans proline' 0 C--O 1.243 0.743 0 C-N-CA 122.964 2.443 . . . . 0.0 111.192 179.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 66.3 mtt -129.32 153.18 48.1 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.082 0.467 . . . . 0.0 110.385 -177.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.8 m -89.67 119.72 30.32 Favored 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 107.646 -1.242 . . . . 0.0 107.646 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -101.52 150.18 23.33 Favored 'General case' 0 C--N 1.282 -2.357 0 CA-C-O 121.654 0.74 . . . . 0.0 111.629 -176.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.603 ' HB2' ' NH1' ' A' ' 87' ' ' ARG . 9.7 mmt85 -127.43 127.07 43.51 Favored 'General case' 0 C--N 1.283 -2.295 0 N-CA-C 103.541 -2.763 . . . . 0.0 103.541 171.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.3 mt -68.72 133.08 47.89 Favored 'General case' 0 C--N 1.289 -2.038 0 O-C-N 123.709 0.631 . . . . 0.0 109.995 -173.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.4 mt -61.4 137.03 58.23 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.891 176.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 67.5 mt 73.92 14.35 4.02 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 124.391 1.057 . . . . 0.0 113.056 175.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 85.3 t -110.74 126.46 68.08 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.569 0 CA-C-O 121.109 0.48 . . . . 0.0 110.662 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -125.01 108.24 11.63 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 115.421 -0.808 . . . . 0.0 109.549 175.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 p . . . . . 0 C--N 1.29 -1.985 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.935 176.916 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.492 0 CA-C-O 119.077 -0.846 . . . . 0.0 114.844 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -60.09 -38.99 73.65 Favored 'Trans proline' 0 C--N 1.366 1.462 0 C-N-CA 122.65 2.233 . . . . 0.0 112.663 -179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -62.43 -47.9 82.03 Favored 'General case' 0 C--O 1.245 0.868 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.624 -177.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.93 -43.79 87.05 Favored 'General case' 0 C--O 1.242 0.709 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.772 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.7 p -64.8 -46.07 83.6 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -67.86 -36.04 79.6 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 120.589 0.233 . . . . 0.0 111.421 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -61.49 -47.37 85.93 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.076 178.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.45 ' O ' HG22 ' A' ' 66' ' ' VAL . 40.8 m -60.47 -44.93 95.39 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.688 -178.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -59.22 -49.79 76.51 Favored 'General case' 0 C--N 1.345 0.402 0 O-C-N 123.23 0.331 . . . . 0.0 110.468 178.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -55.42 -44.48 76.29 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.986 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.9 mmt -71.02 -38.38 72.6 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -177.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.45 HG22 ' O ' ' A' ' 62' ' ' THR . 35.3 m -80.67 -31.83 12.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 -178.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -76.09 -27.71 57.28 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 121.4 0.619 . . . . 0.0 110.36 177.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -67.42 -31.39 71.56 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.905 176.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.512 ' HA ' ' OD2' ' A' ' 95' ' ' ASP . . . -69.89 131.31 44.25 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.737 -177.031 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -78.95 -41.34 29.56 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 171.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.3 mtmt -113.96 131.42 56.33 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 114.832 -1.076 . . . . 0.0 108.664 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 3.9 mp -111.43 117.92 56.24 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.364 0 N-CA-C 105.221 -2.14 . . . . 0.0 105.221 174.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.502 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 23.2 mt-10 -112.75 140.01 47.89 Favored 'General case' 0 C--N 1.295 -1.776 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.875 -172.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.467 HG11 ' CD1' ' A' ' 92' ' ' ILE . 10.1 m -116.38 117.66 56.23 Favored 'Isoleucine or valine' 0 C--O 1.25 1.092 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.398 178.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -109.14 143.5 38.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.842 0.353 . . . . 0.0 111.188 -176.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -94.14 147.81 22.79 Favored 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 124.7 1.2 . . . . 0.0 110.31 -176.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -116.29 -175.81 2.82 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 176.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.52 -26.73 68.03 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.409 0.684 . . . . 0.0 112.16 -175.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -72.64 -115.43 0.06 OUTLIER Glycine 0 N--CA 1.445 -0.719 0 CA-C-N 115.888 -0.596 . . . . 0.0 113.436 -177.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -124.64 165.09 18.51 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 122.28 -0.541 . . . . 0.0 109.761 -178.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 44.2 ttt85 -104.65 -13.18 16.04 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-O 121.783 0.801 . . . . 0.0 108.987 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.8 p . . . . . 0 N--CA 1.436 -1.14 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.176 178.19 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.603 ' NH1' ' HB2' ' A' ' 35' ' ' ARG . 0.8 OUTLIER . . . . . 0 N--CA 1.442 -0.842 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -80.82 144.89 25.54 Favored Glycine 0 C--N 1.305 -1.185 0 C-N-CA 121.031 -0.604 . . . . 0.0 113.281 -177.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.0 mt -117.48 97.9 6.12 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.172 -1.048 . . . . 0.0 108.172 177.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.63 161.64 39.89 Favored 'General case' 0 C--N 1.313 -0.999 0 C-N-CA 120.223 -0.591 . . . . 0.0 111.414 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -88.86 127.4 35.63 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 105.951 -1.87 . . . . 0.0 105.951 170.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.467 ' CD1' HG11 ' A' ' 74' ' ' VAL . 45.7 mm -99.55 123.75 52.48 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.072 -179.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.502 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 77.5 m-85 -109.18 132.51 54.05 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 175.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.461 ' HB3' ' HB2' ' A' ' 69' ' ' ALA . . . -105.35 100.54 10.11 Favored 'General case' 0 C--N 1.285 -2.234 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 176.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.512 ' OD2' ' HA ' ' A' ' 69' ' ' ALA . 3.0 p30 46.32 29.97 0.95 Allowed 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 124.928 1.291 . . . . 0.0 113.472 -174.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.44 -9.8 38.67 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.852 -0.613 . . . . 0.0 113.435 -179.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -83.53 121.87 27.79 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 175.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 34.2 ttp -80.68 99.47 8.2 Favored 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 179.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 48.7 t -58.36 -43.62 86.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 114.781 -1.1 . . . . 0.0 112.795 -169.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -66.5 -31.4 72.1 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.499 -176.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -77.61 -40.64 41.35 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.94 -39.25 77.58 Favored 'General case' 0 C--O 1.222 -0.351 0 O-C-N 123.741 0.651 . . . . 0.0 110.737 179.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.17 -44.66 94.83 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.915 177.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 95.0 t -70.26 -47.57 66.19 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.302 -178.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 11.5 ttp85 -60.45 -37.82 82.2 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 177.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -82.3 0.93 39.31 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-O 120.678 0.275 . . . . 0.0 111.575 177.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.85 38.06 93.95 Favored Glycine 0 C--O 1.221 -0.712 0 CA-C-N 116.276 -0.42 . . . . 0.0 113.688 177.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.4 mt -100.62 -13.66 18.48 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.377 0.608 . . . . 0.0 110.22 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -152.13 160.19 43.47 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -105.56 164.15 12.11 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 106.759 -1.571 . . . . 0.0 106.759 177.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.46 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 82.5 t -71.38 128.39 34.44 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.507 177.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -1.034 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 176.243 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 . . . . . 0 N--CA 1.448 -0.57 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.3 -38.7 91.02 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.988 -1.005 . . . . 0.0 109.689 -175.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -61.79 -33.92 74.96 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.981 178.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 88.4 mt -66.12 -46.43 77.57 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.618 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 7.8 mp -65.98 -29.13 69.46 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.367 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -61.85 -41.41 97.79 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.334 0.587 . . . . 0.0 109.866 175.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -70.65 -39.73 73.46 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.32 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 50.3 m -63.88 -46.18 86.05 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.487 177.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.549 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 41.7 tt0 -61.73 -50.75 71.18 Favored 'General case' 0 C--O 1.204 -1.326 0 O-C-N 123.469 0.481 . . . . 0.0 109.825 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.15 -38.15 73.12 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 123.48 0.488 . . . . 0.0 111.243 -179.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 144' ' ' GLN . . . . . 0.49 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 14.6 tt0 -66.47 -48.81 68.72 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -65.34 -33.61 76.39 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.483 -176.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 146' ' ' LYS . . . . . 0.549 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 88.1 mttt -59.33 -51.33 70.38 Favored 'General case' 0 C--N 1.345 0.409 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 176.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -69.7 -34.41 73.88 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.375 -0.83 . . . . 0.0 112.052 -177.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 57.6 mm-40 -74.08 -18.63 60.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.644 177.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 23.4 mtpp 59.28 48.17 10.55 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 125.234 1.414 . . . . 0.0 110.437 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 99.4 mt -84.45 119.99 25.78 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.233 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 53.9 -93.43 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.229 0 O-C-N 124.781 1.3 . . . . 0.0 112.6 176.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 152' ' ' ILE . . . . . 0.512 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 29.5 mt -60.34 -43.8 94.5 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.654 0 C-N-CA 122.121 0.168 . . . . 0.0 111.331 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -71.48 -4.03 24.36 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.987 0.899 . . . . 0.0 112.774 -172.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 27.9 t -80.35 -5.23 56.05 Favored 'General case' 0 C--N 1.291 -1.942 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.45 171.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 21.4 pt-20 -69.93 -25.08 63.49 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 121.543 0.687 . . . . 0.0 109.704 175.36 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.5 t70 . . . . . 0 C--N 1.309 -1.166 0 CA-C-N 114.843 -1.072 . . . . 0.0 109.654 -178.175 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 45.3 m80 . . . . . 0 CA--C 1.516 -0.351 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.7 ttmt -105.14 127.1 52.75 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 172.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -114.0 149.35 41.76 Favored Pre-proline 0 C--N 1.296 -1.749 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 173.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -80.16 141.1 14.41 Favored 'Trans proline' 0 C--N 1.311 -1.408 0 C-N-CA 121.928 1.752 . . . . 0.0 110.399 174.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.406 ' HB1' ' HB3' ' A' ' 25' ' ' LEU . . . -136.19 155.98 49.35 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 121.103 0.477 . . . . 0.0 112.156 -178.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 72.7 m -111.86 140.76 46.25 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 176.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.431 ' HB2' ' CD1' ' A' ' 72' ' ' ILE . 52.3 tp -83.14 125.48 31.56 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 118.312 0.505 . . . . 0.0 110.424 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 44.5 mm -89.18 -53.18 9.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 174.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -164.36 145.83 8.44 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -105.99 119.44 39.19 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 49.5 mm -90.56 -55.77 5.88 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -177.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.416 ' HB2' ' H ' ' A' ' 22' ' ' THR . 32.4 m-20 -125.83 -166.56 1.58 Allowed 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -85.2 -13.61 70.88 Favored Glycine 0 C--O 1.21 -1.397 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 173.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.542 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 0.4 OUTLIER -101.29 -54.03 2.87 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 122.485 1.136 . . . . 0.0 108.099 -178.864 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.416 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 6.8 m -82.49 105.81 13.85 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 114.268 -1.333 . . . . 0.0 111.334 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.3 m -129.27 137.27 57.46 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.609 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 177.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.469 ' HA ' ' HA ' ' A' ' 33' ' ' THR . 46.6 tttp -101.19 119.1 38.24 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.61 -0.682 . . . . 0.0 110.144 -176.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.406 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 3.3 mm? -116.25 146.73 42.13 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 121.453 0.644 . . . . 0.0 110.765 -177.464 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.485 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 26.5 ttt -107.01 108.59 20.17 Favored 'General case' 0 C--N 1.286 -2.17 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 175.019 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 10.8 p90 -115.55 116.88 28.91 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 -177.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 99.3 mttt 57.51 32.59 22.04 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 124.131 0.895 . . . . 0.0 110.921 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.96 3.76 61.87 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 114.738 -1.119 . . . . 0.0 114.142 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.485 ' O ' ' HA ' ' A' ' 26' ' ' MET . 20.3 mt-30 -107.53 103.86 50.53 Favored Pre-proline 0 C--N 1.311 -1.08 0 O-C-N 122.401 -0.47 . . . . 0.0 111.224 -179.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -80.85 95.26 0.97 Allowed 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 122.757 2.304 . . . . 0.0 111.268 177.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 26.5 mmt -119.78 145.49 46.53 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.745 -176.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.469 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 11.4 m -86.52 118.76 26.15 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -109.21 162.07 14.64 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 123.551 0.74 . . . . 0.0 111.071 -176.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.542 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 20.7 mtp180 -133.23 142.6 48.65 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 169.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.6 mp -61.48 119.55 8.8 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -175.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.1 mt -55.36 128.08 32.52 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.767 176.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.0 mt 68.17 23.2 8.0 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 124.829 1.331 . . . . 0.0 112.211 174.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 90.6 t -128.75 131.53 68.42 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.155 0 O-C-N 122.101 -0.374 . . . . 0.0 110.301 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -107.33 106.87 17.51 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 105.634 -1.987 . . . . 0.0 105.634 168.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.5 m . . . . . 0 CA--C 1.567 1.612 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 175.617 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.448 ' N ' ' HD2' ' A' ' 56' ' ' PRO . . . . . . . . 0 CA--C 1.534 1.254 0 CA-C-O 119.412 -0.66 . . . . 0.0 113.322 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.448 ' HD2' ' N ' ' A' ' 55' ' ' GLY . 4.7 Cg_endo -49.64 -34.31 34.3 Favored 'Trans proline' 0 CA--C 1.553 1.427 0 C-N-CA 123.44 2.76 . . . . 0.0 114.016 175.628 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -83.39 -39.4 20.7 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 121.864 -0.523 . . . . 0.0 110.921 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.95 -40.25 94.74 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.929 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.425 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 9.0 p -65.33 -43.53 90.65 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.461 179.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.408 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -58.92 -47.38 85.24 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 123.614 0.571 . . . . 0.0 109.885 177.57 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -57.26 -49.83 74.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.14 178.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 36.8 m -59.94 -50.83 72.2 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.827 -177.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.486 ' HE3' ' OE1' ' A' ' 67' ' ' GLU 0.339 0.1 OUTLIER -64.38 -38.23 90.3 Favored 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -179.482 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.418 ' N ' ' HD3' ' A' ' 63' ' ' LYS . 28.9 mtpp -66.45 -40.67 89.55 Favored 'General case' 0 N--CA 1.436 -1.169 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 177.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 14.7 tpt -62.68 -45.85 90.87 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.266 -178.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.8 m -80.71 -31.44 12.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -176.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.486 ' OE1' ' HE3' ' A' ' 63' ' ' LYS . 45.1 mt-10 -77.66 -33.42 53.41 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.146 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -78.1 -20.81 51.46 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.22 147.74 51.68 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.793 179.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -71.12 -61.34 1.8 Allowed 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.853 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.0 mtmm -125.55 150.91 47.04 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 178.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.431 ' CD1' ' HB2' ' A' ' 14' ' ' LEU . 69.2 mt -105.58 134.26 47.6 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.231 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 175.009 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.491 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 1.5 mm-40 -111.92 133.24 54.24 Favored 'General case' 0 N--CA 1.424 -1.771 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -178.177 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 31.4 m -111.52 118.19 56.91 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 174.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -114.22 137.33 51.91 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.153 0.501 . . . . 0.0 109.756 -178.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -106.86 138.99 41.99 Favored 'General case' 0 C--N 1.282 -2.338 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.176 -178.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -86.51 -174.27 4.92 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -76.31 -2.5 31.9 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -176.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.59 -119.25 1.15 Allowed Glycine 0 N--CA 1.442 -0.927 0 C-N-CA 121.576 -0.345 . . . . 0.0 112.857 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 70.6 mm-40 -99.75 164.04 12.21 Favored 'General case' 0 C--N 1.293 -1.869 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -175.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -108.89 -37.96 5.72 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.6 p . . . . . 0 C--N 1.312 -1.051 0 CA-C-N 115.363 -0.835 . . . . 0.0 108.827 179.604 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.409 ' HD3' ' O ' ' A' ' 33' ' ' THR . 3.3 tpp180 . . . . . 0 N--CA 1.415 -2.176 0 N-CA-C 106.759 -1.571 . . . . 0.0 106.759 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -78.66 151.58 36.11 Favored Glycine 0 N--CA 1.428 -1.867 0 N-CA-C 111.209 -0.757 . . . . 0.0 111.209 -179.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 85.6 mt -119.94 105.04 10.68 Favored 'General case' 0 C--N 1.288 -2.093 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -138.76 152.48 47.98 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-O 121.279 0.561 . . . . 0.0 111.689 -176.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -95.21 123.57 38.79 Favored 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 105.078 -2.193 . . . . 0.0 105.078 175.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 47.4 mm -99.27 129.06 50.29 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-O 121.452 0.644 . . . . 0.0 112.131 -171.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.491 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 26.1 m-85 -114.83 142.94 45.87 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 172.292 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.38 98.85 8.49 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 175.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.4 t70 45.71 40.04 5.79 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.179 1.392 . . . . 0.0 110.544 -173.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.69 -22.07 31.02 Favored Glycine 0 N--CA 1.444 -0.811 0 CA-C-N 115.182 -0.917 . . . . 0.0 114.509 178.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -80.83 132.98 35.52 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 117.975 0.888 . . . . 0.0 110.772 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 51.9 mtm -77.78 100.86 6.45 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -175.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 57.9 t -66.83 -48.02 81.02 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.618 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -56.63 -44.75 81.54 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.659 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -68.2 -42.53 79.74 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.3 -179.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.74 -45.13 86.26 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.066 0.546 . . . . 0.0 111.407 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 89.3 mt -57.82 -50.25 73.91 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.95 0.405 . . . . 0.0 111.297 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.6 t -69.89 -36.55 69.77 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.778 -178.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 14.3 tpp85 -62.69 -37.93 88.4 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.96 0.904 . . . . 0.0 111.18 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -91.07 3.9 53.54 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.976 -177.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.1 36.21 92.69 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 121.278 -0.487 . . . . 0.0 112.16 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 97.8 mt -102.28 -11.36 18.77 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 120.896 0.379 . . . . 0.0 110.031 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -153.19 161.13 42.77 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -107.15 152.4 24.11 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 177.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.3 p -82.88 130.17 36.19 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.439 0 CA-C-O 121.106 0.479 . . . . 0.0 109.932 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.298 -1.633 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.082 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 72.9 m80 . . . . . 0 N--CA 1.47 0.562 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' B' ' 139' ' ' ARG . 13.0 tm-20 -67.27 -47.48 70.54 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.411 -172.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 2.9 tm0? -72.51 -33.6 67.03 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -176.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 72.4 mt -57.6 -49.68 75.61 Favored 'General case' 0 C--O 1.254 1.338 0 CA-C-O 121.824 0.821 . . . . 0.0 109.256 177.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 11.2 mp -69.14 -28.89 66.85 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.591 177.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 139' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' B' ' 135' ' ' GLU . 31.2 mmt180 -60.8 -42.76 98.27 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.443 0.535 . . . . 0.0 112.443 176.287 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -64.08 -35.29 80.28 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.639 0.733 . . . . 0.0 110.028 178.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.3 m -70.12 -43.17 71.54 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.149 178.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.614 ' O ' ' HG2' ' B' ' 146' ' ' LYS . 34.5 tt0 -60.47 -45.29 94.26 Favored 'General case' 0 C--O 1.22 -0.467 0 O-C-N 123.862 0.726 . . . . 0.0 109.677 177.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.75 -46.26 77.89 Favored 'General case' 0 CA--C 1.514 -0.419 0 O-C-N 124.007 0.817 . . . . 0.0 111.41 -177.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -70.51 -41.7 72.28 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.454 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -62.87 -39.98 96.12 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.709 -179.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 146' ' ' LYS . . . . . 0.614 ' HG2' ' O ' ' B' ' 142' ' ' GLU . 18.4 ptpt -73.28 -35.69 66.2 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 176.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -59.77 -47.58 85.12 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 122.023 0.916 . . . . 0.0 109.599 176.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -89.33 -3.2 58.57 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 113.88 -1.509 . . . . 0.0 112.123 -173.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' B' ' 154' ' ' SER . 34.1 mmtp 54.24 47.54 22.87 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.048 0.939 . . . . 0.0 111.113 178.132 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 90.5 mt -78.96 117.64 20.22 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.201 -176.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 48.7 -89.8 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.303 1.841 . . . . 0.0 113.646 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 41.6 mt -59.38 -49.18 84.49 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.989 0 C-N-CA 122.988 0.515 . . . . 0.0 111.764 -177.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -69.33 -10.41 57.75 Favored 'General case' 0 CA--C 1.495 -1.139 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -171.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 154' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 23.0 t -72.52 2.33 6.54 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.037 174.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -60.5 -32.86 71.85 Favored 'General case' 0 C--N 1.355 0.809 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 168.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.6 t70 . . . . . 0 C--O 1.24 0.566 0 C-N-CA 125.593 1.557 . . . . 0.0 111.241 178.05 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 32.8 m170 . . . . . 0 N--CA 1.429 -1.495 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -110.24 150.97 27.92 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-O 121.317 0.579 . . . . 0.0 110.481 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -138.86 143.97 39.58 Favored Pre-proline 0 C--N 1.277 -2.558 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.823 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_exo -73.75 138.81 26.9 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.788 2.326 . . . . 0.0 113.625 -177.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.404 ' O ' ' HB ' ' A' ' 72' ' ' ILE . . . -125.68 153.94 43.13 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.191 -178.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.402 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 42.8 m -105.34 135.5 46.59 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 177.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.1 tp -80.35 137.9 36.62 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 118.143 0.429 . . . . 0.0 110.711 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 72.6 mt -107.11 -49.81 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 172.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -161.67 138.01 8.11 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.289 -177.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -101.93 107.46 18.62 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 174.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 56.3 mt -89.5 -52.64 10.52 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-O 120.778 0.323 . . . . 0.0 111.367 -173.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.461 ' HA ' ' HB3' ' A' ' 59' ' ' SER . 28.1 m-20 -138.15 -176.22 4.37 Favored 'General case' 0 CA--C 1.499 -0.997 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -178.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -92.95 54.38 2.58 Favored Glycine 0 CA--C 1.489 -1.543 0 N-CA-C 107.348 -2.301 . . . . 0.0 107.348 178.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -177.59 -54.67 0.01 OUTLIER 'General case' 0 CA--C 1.486 -1.502 0 C-N-CA 125.271 1.428 . . . . 0.0 107.222 -171.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.665 ' HA ' ' O ' ' A' ' 34' ' ' PHE . 1.9 m -101.88 113.06 25.94 Favored 'General case' 0 N--CA 1.407 -2.597 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.465 -173.147 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 35.4 m -124.71 167.05 19.27 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.803 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 173.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -121.47 114.13 20.82 Favored 'General case' 0 C--N 1.27 -2.855 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 176.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.465 ' O ' ' HA ' ' A' ' 31' ' ' PRO . 2.4 pp -136.11 159.41 41.8 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -176.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.412 ' HA ' ' HA ' ' A' ' 31' ' ' PRO . 47.4 ttm -117.51 114.98 24.25 Favored 'General case' 0 C--N 1.295 -1.775 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.536 -176.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -119.14 126.71 52.25 Favored 'General case' 0 C--N 1.281 -2.392 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 176.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt 59.97 27.21 16.56 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 123.804 0.69 . . . . 0.0 110.67 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.46 9.11 82.24 Favored Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.9 -178.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -111.7 102.2 52.91 Favored Pre-proline 0 C--N 1.312 -1.043 0 O-C-N 122.57 -0.37 . . . . 0.0 110.411 178.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.465 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 4.9 Cg_exo -81.47 134.77 8.99 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.379 2.72 . . . . 0.0 111.834 178.168 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 48.1 mtt -140.83 156.09 46.21 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 178.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 85.4 m -85.13 118.29 24.6 Favored 'General case' 0 N--CA 1.423 -1.819 0 N-CA-C 103.047 -2.946 . . . . 0.0 103.047 170.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.665 ' O ' ' HA ' ' A' ' 22' ' ' THR . 34.0 t80 -112.22 151.78 29.18 Favored 'General case' 0 C--N 1.271 -2.83 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -162.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.1 mmt180 -117.76 131.57 56.58 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 127.494 2.317 . . . . 0.0 106.186 172.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.441 ' HB2' ' CG2' ' A' ' 39' ' ' VAL . 32.6 mt -80.75 140.16 35.68 Favored 'General case' 0 C--N 1.289 -2.024 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 177.494 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.43 ' HG ' ' C ' ' A' ' 90' ' ' ALA . 41.2 mt -65.68 133.45 51.12 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 178.061 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.517 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 2.9 mp 66.44 48.92 1.46 Allowed 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 125.674 1.59 . . . . 0.0 111.821 177.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.441 ' CG2' ' HB2' ' A' ' 36' ' ' LEU . 96.4 t -122.73 125.29 72.24 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.063 0 CA-C-O 121.035 0.445 . . . . 0.0 110.461 177.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.487 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 12.2 t70 -102.25 107.13 18.07 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.702 -1.222 . . . . 0.0 107.702 175.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 30.0 p . . . . . 0 C--N 1.307 -1.249 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.267 172.574 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.843 0 CA-C-O 118.754 -1.026 . . . . 0.0 114.663 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -64.8 -12.77 35.72 Favored 'Trans proline' 0 C--N 1.371 1.737 0 C-N-CA 123.006 2.471 . . . . 0.0 113.164 -178.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -89.92 -43.45 10.58 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.86 -43.62 87.89 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.753 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.461 ' HB3' ' HA ' ' A' ' 19' ' ' ASP . 35.3 p -66.56 -36.11 81.85 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.824 -179.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.82 -44.51 96.83 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -66.27 -46.89 75.46 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.531 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.484 ' O ' HG23 ' A' ' 66' ' ' VAL . 60.3 m -55.37 -51.68 66.01 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 123.684 0.615 . . . . 0.0 111.394 -178.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 39.4 mttp -53.69 -51.87 61.85 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 120.926 0.393 . . . . 0.0 111.432 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.42 ' HZ2' ' HB2' ' A' ' 64' ' ' LYS . 10.5 mtmp? -64.62 -40.9 96.31 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.535 -177.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.441 ' HE2' ' HA ' ' A' ' 65' ' ' MET . 0.3 OUTLIER -70.92 -47.02 61.38 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.964 -176.077 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 62' ' ' THR . 36.3 t -66.52 -38.07 80.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 120.965 0.412 . . . . 0.0 110.669 -177.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -75.0 -22.99 58.18 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.374 -0.531 . . . . 0.0 111.571 178.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -83.11 -24.42 32.64 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 121.204 0.526 . . . . 0.0 110.199 177.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.18 151.89 30.17 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.16 179.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -84.49 -65.35 1.02 Allowed 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.158 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -118.15 136.5 53.57 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 -176.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.404 ' HB ' ' O ' ' A' ' 12' ' ' ALA . 69.8 mt -104.84 112.96 40.61 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.475 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 22.1 mt-10 -112.8 133.48 54.78 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -177.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.431 HG12 ' CD1' ' A' ' 92' ' ' ILE . 29.2 m -110.82 123.1 66.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 178.17 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -120.1 122.31 40.76 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -92.99 145.77 24.12 Favored 'General case' 0 N--CA 1.422 -1.868 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -87.04 -175.35 5.31 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.437 ' HZ2' ' HB3' ' A' ' 78' ' ' LYS . 7.1 mtpm? -78.13 14.07 1.27 Allowed 'General case' 0 C--N 1.313 -0.99 0 O-C-N 121.935 -0.478 . . . . 0.0 111.915 -176.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -95.69 -130.67 6.34 Favored Glycine 0 N--CA 1.436 -1.331 0 N-CA-C 112.247 -0.341 . . . . 0.0 112.247 -179.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -97.23 145.79 25.73 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 -177.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.422 HH11 ' HG2' ' A' ' 81' ' ' ARG . 11.8 ttt-85 -90.15 -13.71 35.11 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 119.09 -1.044 . . . . 0.0 109.472 -178.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 23.2 p . . . . . 0 N--CA 1.432 -1.331 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.523 176.303 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 . . . . . 0 C--O 1.213 -0.854 0 N-CA-C 105.755 -1.943 . . . . 0.0 105.755 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -75.72 134.64 16.64 Favored Glycine 0 C--O 1.206 -1.594 0 C-N-CA 120.539 -0.839 . . . . 0.0 113.777 -173.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 62.7 mt -112.22 110.66 21.04 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 123.26 0.624 . . . . 0.0 111.741 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.43 ' C ' ' HG ' ' A' ' 37' ' ' LEU . . . -157.58 163.44 38.33 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 171.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.447 ' OH ' ' HB3' ' A' ' 98' ' ' MET . 35.6 t80 -95.14 141.73 28.42 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.431 ' CD1' HG12 ' A' ' 74' ' ' VAL . 49.5 mm -99.69 123.57 52.54 Favored 'Isoleucine or valine' 0 C--O 1.252 1.198 0 CA-C-O 121.206 0.526 . . . . 0.0 111.096 -179.475 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.475 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 96.2 m-85 -111.05 131.35 55.13 Favored 'General case' 0 C--N 1.29 -1.999 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 172.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.29 100.42 10.01 Favored 'General case' 0 C--N 1.286 -2.177 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 177.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.6 t70 47.57 57.32 6.02 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 122.474 1.131 . . . . 0.0 110.526 -177.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 77.27 -5.15 52.13 Favored Glycine 0 CA--C 1.53 0.989 0 CA-C-N 114.605 -1.18 . . . . 0.0 114.86 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 32.7 mtmm -104.37 124.25 48.86 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 117.625 0.712 . . . . 0.0 111.144 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' MET . . . . . 0.447 ' HB3' ' OH ' ' A' ' 91' ' ' TYR . 2.1 mpt? -63.23 112.82 2.84 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 123.907 0.883 . . . . 0.0 112.059 -176.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 91.9 t -73.2 -46.16 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.23 -177.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.451 ' O ' HG22 ' A' ' 104' ' ' VAL . 46.2 t30 -63.93 -37.23 86.65 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.121 -178.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -54.94 -44.13 74.0 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.157 176.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.91 -44.22 93.6 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.504 179.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 97.2 mt -58.03 -52.22 66.45 Favored 'General case' 0 C--O 1.244 0.779 0 CA-C-O 121.389 0.614 . . . . 0.0 111.209 178.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.458 HG11 ' CG1' ' A' ' 111' ' ' VAL . 27.2 m -70.78 -38.0 71.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.496 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -176.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -65.0 -16.22 63.18 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 175.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -93.62 -5.6 48.38 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.766 174.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.29 25.1 69.27 Favored Glycine 0 CA--C 1.507 -0.438 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.68 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 90.4 mt -88.87 -15.97 33.13 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.744 0.307 . . . . 0.0 111.047 -178.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -157.26 174.3 15.66 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -178.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.487 ' HB2' ' HB3' ' A' ' 40' ' ' ASP . 18.4 mttt -119.28 170.98 8.63 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 176.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.517 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 32.8 m -108.05 107.32 22.53 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -177.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.702 0 C-N-CA 119.599 -0.84 . . . . 0.0 112.92 176.55 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 . . . . . 0 CA--C 1.539 0.522 0 N-CA-C 111.289 0.107 . . . . 0.0 111.289 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -37.76 -61.68 0.61 Allowed 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 126.731 2.012 . . . . 0.0 113.087 -178.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -47.58 -54.32 12.13 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.475 1.11 . . . . 0.0 113.883 -173.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.1 mt -60.54 -43.75 96.85 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.815 -177.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.36 -38.03 77.88 Favored 'General case' 0 N--CA 1.432 -1.355 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.477 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -57.16 -45.6 83.48 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-O 120.859 0.361 . . . . 0.0 110.39 176.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -62.48 -43.4 98.92 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.931 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 25.2 m -65.24 -41.24 94.56 Favored 'General case' 0 N--CA 1.438 -1.03 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.539 -178.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -67.06 -50.77 60.78 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.198 177.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.88 -34.78 70.13 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.819 0.699 . . . . 0.0 111.908 -177.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 144' ' ' GLN . . . . . 0.44 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 57.8 tt0 -61.94 -48.01 82.31 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -70.56 -32.66 70.16 Favored 'General case' 0 C--O 1.245 0.853 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.771 -178.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 146' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -57.9 -51.21 70.56 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 123.661 0.601 . . . . 0.0 109.645 176.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -71.07 -22.87 62.06 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.548 -176.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 22.8 mm-40 -87.24 -4.35 59.09 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 121.073 -0.251 . . . . 0.0 111.588 178.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . 0.569 ' O ' ' HB3' ' B' ' 154' ' ' SER . 10.0 mmpt? 54.71 57.36 5.78 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.076 0.95 . . . . 0.0 108.855 -176.049 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 98.2 mt -95.49 119.3 33.74 Favored 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 120.084 -0.646 . . . . 0.0 112.539 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 50.9 -84.41 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 127.633 2.373 . . . . 0.0 114.181 175.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 152' ' ' ILE . . . . . 0.549 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 58.5 mt -68.56 -34.06 63.27 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.41 0 CA-C-O 121.764 0.792 . . . . 0.0 109.784 178.118 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 60.0 m95 -81.53 -11.1 59.3 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.767 -172.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 154' ' ' SER . . . . . 0.569 ' HB3' ' O ' ' B' ' 149' ' ' LYS . 79.6 p -91.14 0.86 57.45 Favored 'General case' 0 N--CA 1.423 -1.803 0 C-N-CA 119.73 -0.788 . . . . 0.0 112.438 -178.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . 0.549 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 5.6 pt-20 -93.82 -17.76 22.74 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 174.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 13.7 t70 . . . . . 0 N--CA 1.431 -1.409 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.3 -170.984 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.6 m-70 . . . . . 0 N--CA 1.468 0.438 0 CA-C-O 119.882 -0.104 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.41 ' HZ1' ' CD ' ' A' ' 73' ' ' GLU . 21.2 pttp -110.42 141.92 42.85 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 176.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -139.34 143.75 37.36 Favored Pre-proline 0 C--N 1.276 -2.607 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.29 177.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -62.04 147.91 94.2 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.825 2.35 . . . . 0.0 113.487 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.02 166.09 25.41 Favored 'General case' 0 C--N 1.307 -1.266 0 C-N-CA 124.499 1.12 . . . . 0.0 108.965 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.428 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 57.2 m -100.76 132.03 46.36 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 178.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.2 tp -79.98 126.23 30.77 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 120.995 0.426 . . . . 0.0 110.316 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.3 mm -92.07 -54.62 7.12 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.674 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 175.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -166.42 149.08 6.88 Favored 'General case' 0 N--CA 1.425 -1.702 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.809 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -82.45 128.84 34.66 Favored 'General case' 0 N--CA 1.438 -1.075 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 171.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 47.5 mm -102.79 -51.8 8.71 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.719 0 CA-C-O 121.057 0.456 . . . . 0.0 109.961 -174.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -133.65 -176.8 4.28 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.66 50.54 4.01 Favored Glycine 0 C--O 1.222 -0.643 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 175.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.61 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 5.6 t70 -178.61 -59.91 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 -170.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.537 ' HA ' ' O ' ' A' ' 34' ' ' PHE . 21.5 m -82.32 120.14 25.03 Favored 'General case' 0 N--CA 1.409 -2.507 0 CA-C-N 113.597 -1.638 . . . . 0.0 111.246 -176.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.6 m -126.9 144.56 36.69 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.353 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 177.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -98.25 119.57 37.14 Favored 'General case' 0 C--N 1.292 -1.893 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -176.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.525 ' O ' ' HA ' ' A' ' 31' ' ' PRO . 3.1 mm? -120.42 158.27 27.54 Favored 'General case' 0 CA--C 1.5 -0.963 0 CA-C-O 121.462 0.648 . . . . 0.0 111.985 -176.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.428 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 27.0 ttt -124.07 105.98 9.99 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 174.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -113.8 116.46 29.38 Favored 'General case' 0 C--N 1.292 -1.909 0 C-N-CA 119.191 -1.004 . . . . 0.0 110.086 -178.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 94.6 mttt 57.73 38.14 27.41 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.482 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 91.77 -1.52 75.11 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-N 114.354 -1.294 . . . . 0.0 113.83 175.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -107.74 106.22 57.97 Favored Pre-proline 0 C--N 1.314 -0.963 0 CA-C-N 117.183 0.492 . . . . 0.0 110.437 -177.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.525 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 33.9 Cg_endo -90.89 125.22 1.02 Allowed 'Trans proline' 0 N--CA 1.448 -1.149 0 C-N-CA 123.007 2.471 . . . . 0.0 112.908 178.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 63.6 mtt -141.32 156.23 45.87 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.016 178.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.3 m -90.67 103.83 16.48 Favored 'General case' 0 C--N 1.294 -1.844 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 178.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.537 ' O ' ' HA ' ' A' ' 22' ' ' THR . 73.5 m-85 -95.29 125.25 39.79 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 -170.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.61 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 6.7 mmm180 -95.68 146.12 24.75 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 125.417 1.487 . . . . 0.0 108.281 175.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.452 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 93.3 mt -82.65 125.21 30.95 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 121.631 0.729 . . . . 0.0 111.484 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 69.3 mt -79.0 139.38 38.21 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.333 174.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.541 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 87.9 mt 73.77 10.99 4.66 Favored 'General case' 0 C--O 1.218 -0.598 0 C-N-CA 125.158 1.383 . . . . 0.0 111.919 178.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 66.6 t -128.85 136.32 60.08 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.242 0 CA-C-O 121.084 0.468 . . . . 0.0 110.093 -179.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -121.68 107.87 12.87 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.0 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.7 m . . . . . 0 C--N 1.31 -1.122 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.778 176.136 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.401 ' N ' ' HD2' ' A' ' 56' ' ' PRO . . . . . . . . 0 C--O 1.246 0.857 0 CA-C-O 119.31 -0.717 . . . . 0.0 112.833 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.401 ' HD2' ' N ' ' A' ' 55' ' ' GLY . 1.0 OUTLIER -46.06 -54.84 4.19 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 124.006 3.137 . . . . 0.0 113.125 177.151 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -60.3 -46.59 89.33 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.04 -44.57 96.41 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.271 0.558 . . . . 0.0 110.853 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.6 m -69.17 -44.61 71.87 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.928 -178.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.51 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -65.19 -41.63 94.39 Favored 'General case' 0 C--O 1.209 -1.044 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.924 -178.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -59.96 -43.7 94.89 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 122.588 0.355 . . . . 0.0 110.315 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.2 m -60.7 -50.99 71.25 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.624 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.76 -36.83 85.59 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.837 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.51 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 98.2 mttt -56.96 -46.83 81.89 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 174.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.1 mmt -65.65 -51.5 59.02 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 32.9 m -74.36 -31.61 28.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -174.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -81.12 -28.22 35.23 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 119.536 -0.866 . . . . 0.0 110.944 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -82.01 -25.56 34.59 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.83 177.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.74 145.86 38.82 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 123.209 0.604 . . . . 0.0 111.683 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -79.46 -37.29 37.26 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 44.2 mtmt -133.59 145.48 50.09 Favored 'General case' 0 CA--C 1.484 -1.563 0 CA-C-N 114.625 -1.171 . . . . 0.0 108.85 -178.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.429 HG22 HD13 ' A' ' 25' ' ' LEU . 4.2 mp -117.52 118.54 58.84 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.612 0 N-CA-C 105.348 -2.094 . . . . 0.0 105.348 171.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.563 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 31.5 mt-10 -112.84 141.36 46.74 Favored 'General case' 0 C--N 1.28 -2.453 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -173.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.503 HG13 ' CD1' ' A' ' 92' ' ' ILE . 30.6 m -112.71 124.57 69.5 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.277 -178.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.431 ' HB3' ' HB3' ' A' ' 91' ' ' TYR . 35.5 tt0 -109.75 115.56 30.07 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 175.53 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -87.94 127.46 35.37 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-O 121.397 0.617 . . . . 0.0 111.639 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -95.8 166.44 11.8 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.086 -0.961 . . . . 0.0 111.798 -174.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -62.31 -24.05 67.09 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 125.847 1.659 . . . . 0.0 110.904 -177.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -55.05 -84.07 0.04 OUTLIER Glycine 0 CA--C 1.493 -1.315 0 O-C-N 123.549 0.531 . . . . 0.0 114.309 -175.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.419 ' HB2' HD11 ' A' ' 89' ' ' LEU . 24.8 mt-30 -149.86 149.61 30.72 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 178.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -84.37 -34.64 23.57 Favored 'General case' 0 C--N 1.285 -2.205 0 CA-C-O 121.599 0.714 . . . . 0.0 109.092 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.403 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 6.9 p . . . . . 0 C--N 1.305 -1.348 0 CA-C-N 114.922 -1.035 . . . . 0.0 108.809 -179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 . . . . . 0 CA--C 1.509 -0.604 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.403 ' HA2' ' HA ' ' A' ' 82' ' ' THR . . . -88.55 161.18 30.89 Favored Glycine 0 N--CA 1.427 -1.922 0 N-CA-C 109.118 -1.593 . . . . 0.0 109.118 177.235 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.419 HD11 ' HB2' ' A' ' 80' ' ' GLN . 91.1 mt -130.24 118.37 21.26 Favored 'General case' 0 C--N 1.286 -2.174 0 CA-C-N 117.38 0.59 . . . . 0.0 110.318 -177.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.17 168.01 28.63 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.239 0.543 . . . . 0.0 110.716 -178.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.431 ' HB3' ' HB3' ' A' ' 75' ' ' GLU . 18.2 t80 -97.79 126.47 43.16 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 105.363 -2.088 . . . . 0.0 105.363 173.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.503 ' CD1' HG13 ' A' ' 74' ' ' VAL . 47.8 mm -99.84 129.97 49.66 Favored 'Isoleucine or valine' 0 C--O 1.246 0.874 0 C-N-CA 119.75 -0.78 . . . . 0.0 112.912 -176.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.563 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 41.1 m-85 -110.62 145.32 38.1 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.434 173.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -109.41 99.35 8.6 Favored 'General case' 0 C--N 1.29 -1.982 0 N-CA-C 106.417 -1.697 . . . . 0.0 106.417 173.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.317 3.7 p30 42.13 57.42 3.28 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 114.228 1.196 . . . . 0.0 114.228 -176.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.62 -18.49 52.48 Favored Glycine 0 N--CA 1.432 -1.594 0 CA-C-N 114.948 -1.024 . . . . 0.0 113.992 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -90.47 147.35 23.46 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-N 117.114 0.457 . . . . 0.0 110.069 -177.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 57.4 mtt -92.4 108.1 19.71 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-O 121.471 0.653 . . . . 0.0 111.853 -177.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 62.4 t -67.67 -42.32 86.34 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 CA-C-N 114.51 -1.223 . . . . 0.0 109.763 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.452 ' ND2' ' HB3' ' A' ' 36' ' ' LEU . 11.8 m120 -54.13 -49.08 70.01 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.828 177.09 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -54.08 -56.08 21.42 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.377 175.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.83 -41.08 73.71 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 89.6 mt -65.06 -46.58 80.62 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 57.8 t -73.12 -38.26 54.66 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.158 0 CA-C-O 120.588 0.232 . . . . 0.0 110.866 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.523 ' CZ ' ' HA ' ' B' ' 141' ' ' SER . 12.7 tpp180 -65.33 -34.89 79.4 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.556 0.743 . . . . 0.0 110.898 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -84.94 -3.34 58.7 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.205 177.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.521 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 70.69 38.26 67.25 Favored Glycine 0 N--CA 1.432 -1.614 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.661 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 82.8 mt -103.79 -10.9 17.91 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 121.628 0.728 . . . . 0.0 109.287 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -150.18 169.9 20.23 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 114.475 -1.238 . . . . 0.0 108.923 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.424 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 93.4 mttt -123.21 159.01 29.57 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 176.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.5 p -83.79 124.24 39.52 Favored 'Isoleucine or valine' 0 C--O 1.246 0.913 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.846 177.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.541 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . . . . . . 0 C--N 1.305 -1.331 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 . . . . . 0 N--CA 1.471 0.598 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -47.01 -49.68 20.6 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.865 0.866 . . . . 0.0 111.967 -178.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . 0.505 ' O ' ' HG3' ' B' ' 140' ' ' LYS . 9.4 pt20 -51.48 -48.77 62.74 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.738 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 85.0 mt -70.35 -44.88 67.24 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.427 -177.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.65 -34.06 77.4 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.422 -178.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 139' ' ' ARG . . . . . 0.539 ' O ' ' HD3' ' B' ' 139' ' ' ARG . 0.0 OUTLIER -76.31 -36.35 58.35 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.574 -179.905 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' B' ' 136' ' ' GLN . 29.6 mtpp -69.24 -29.69 67.67 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-O 121.066 0.46 . . . . 0.0 110.132 177.722 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 141' ' ' SER . . . . . 0.523 ' HA ' ' CZ ' ' A' ' 105' ' ' ARG . 22.6 t -61.2 -55.05 36.58 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-N 114.806 -1.088 . . . . 0.0 108.342 175.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.46 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 33.2 tt0 -59.48 -53.15 61.39 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.63 -1.168 . . . . 0.0 111.087 178.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.6 -42.58 75.06 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -176.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -71.72 -46.97 56.95 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.052 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -65.0 -31.92 73.39 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.919 -177.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 146' ' ' LYS . . . . . 0.46 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 87.7 mttt -59.62 -47.98 83.48 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.247 0.546 . . . . 0.0 110.363 175.014 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -70.52 -31.8 69.02 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.548 -176.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -76.25 -22.1 55.54 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.6 177.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' B' ' 154' ' ' SER . 51.0 mtpt 56.47 65.13 1.49 Allowed 'General case' 0 N--CA 1.441 -0.902 0 C-N-CA 124.434 1.093 . . . . 0.0 110.477 -174.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 89.5 mt -94.96 122.02 37.18 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.239 -179.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 151' ' ' ASN . . . . . 0.521 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 39.6 m-80 46.4 -89.16 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 126.25 1.82 . . . . 0.0 114.191 179.279 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 13.3 tt -70.29 -30.94 45.28 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.751 0 CA-C-O 121.3 0.571 . . . . 0.0 110.027 -177.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 153' ' ' TRP . . . . . 0.456 ' CH2' ' HG3' ' B' ' 142' ' ' GLU . 65.9 m95 -78.26 -7.22 56.92 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 121.683 0.754 . . . . 0.0 110.172 -178.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 154' ' ' SER . . . . . 0.424 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 8.2 t -102.85 19.4 19.4 Favored 'General case' 0 N--CA 1.408 -2.542 0 CA-C-N 115.394 -0.821 . . . . 0.0 108.905 179.083 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -71.34 -16.38 62.43 Favored 'General case' 0 C--N 1.351 0.673 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 174.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 15.7 t70 . . . . . 0 N--CA 1.436 -1.139 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.362 176.169 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 54.6 m80 . . . . . 0 CA--C 1.503 -0.847 0 CA-C-O 121.181 0.515 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 74' ' ' VAL . 27.7 ttpp -115.32 131.38 56.95 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.012 179.267 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.59 163.83 46.94 Favored Pre-proline 0 C--N 1.296 -1.749 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -79.72 150.36 21.36 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.192 1.928 . . . . 0.0 112.185 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.25 156.84 46.79 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.109 177.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.453 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 18.0 m -101.32 138.41 38.38 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 177.507 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 61.7 tp -76.11 126.52 31.15 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 -179.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 48.2 mm -98.41 -55.11 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 175.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 58.5 pttt -175.12 148.09 0.97 Allowed 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 122.432 0.293 . . . . 0.0 111.198 178.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -104.32 115.64 30.75 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 174.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.6 mp -86.91 -47.31 16.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.195 0 CA-C-O 121.416 0.627 . . . . 0.0 109.744 -175.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -138.95 175.71 9.32 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.279 -176.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.03 52.96 4.45 Favored Glycine 0 C--N 1.316 -0.581 0 N-CA-C 108.572 -1.811 . . . . 0.0 108.572 172.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.426 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 7.7 t70 -172.53 -58.97 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 -172.406 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 23.8 m -98.41 117.46 32.88 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 114.438 -1.255 . . . . 0.0 110.89 -176.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.4 m -133.45 156.43 41.66 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.427 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -121.24 125.08 46.21 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.467 -0.77 . . . . 0.0 109.965 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.0 mp -131.16 159.11 38.63 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.093 0.473 . . . . 0.0 110.436 -178.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.453 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 49.0 ttm -116.09 115.92 26.94 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.105 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -121.92 132.45 54.56 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 59.3 mttp 60.83 26.34 16.19 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.958 0.903 . . . . 0.0 110.586 -176.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 82.62 3.41 90.52 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 121.148 -0.548 . . . . 0.0 112.047 -177.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -105.24 113.03 64.94 Favored Pre-proline 0 C--N 1.315 -0.918 0 O-C-N 122.541 -0.388 . . . . 0.0 110.914 -178.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -85.93 120.22 1.94 Allowed 'Trans proline' 0 N--CA 1.443 -1.472 0 C-N-CA 122.389 2.059 . . . . 0.0 112.047 177.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 49.7 mtt -132.35 156.09 47.25 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.021 176.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.4 m -88.48 115.97 26.38 Favored 'General case' 0 N--CA 1.418 -2.043 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -102.14 166.88 10.36 Favored 'General case' 0 N--CA 1.414 -2.225 0 CA-C-O 122.127 0.965 . . . . 0.0 111.157 -177.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.426 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 18.4 ttp180 -139.2 136.63 35.23 Favored 'General case' 0 N--CA 1.405 -2.714 0 N-CA-C 107.124 -1.435 . . . . 0.0 107.124 172.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.0 mp -69.8 119.08 13.49 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 123.997 0.811 . . . . 0.0 110.23 -176.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.0 mt -57.66 131.47 50.36 Favored 'General case' 0 CA--C 1.499 -0.991 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.145 177.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.413 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 87.5 mt 73.19 19.92 3.46 Favored 'General case' 0 C--O 1.217 -0.648 0 O-C-N 125.205 1.565 . . . . 0.0 112.696 175.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.7 t -111.15 125.9 68.51 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 177.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -125.47 110.13 13.54 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.9 p . . . . . 0 C--N 1.306 -1.297 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 169.491 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.241 0 CA-C-O 119.772 -0.46 . . . . 0.0 112.612 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.405 ' HA ' ' OG ' ' A' ' 59' ' ' SER . 20.2 Cg_exo -69.79 -12.45 32.85 Favored 'Trans proline' 0 C--N 1.369 1.651 0 C-N-CA 122.454 2.103 . . . . 0.0 111.755 176.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -78.48 -48.71 14.79 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 177.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.41 -37.68 80.55 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.862 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.405 ' OG ' ' HA ' ' A' ' 56' ' ' PRO . 26.1 p -68.17 -36.98 80.47 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.16 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -67.8 -43.63 79.23 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 176.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.29 -48.41 81.73 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.659 -179.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.408 HG23 HD22 ' A' ' 103' ' ' LEU . 12.2 p -62.94 -48.85 77.12 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.907 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -56.77 -46.92 81.16 Favored 'General case' 0 CA--C 1.509 -0.621 0 O-C-N 123.349 0.406 . . . . 0.0 111.8 179.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -56.76 -46.17 81.59 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.423 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 49.1 ttm -68.46 -46.47 69.69 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 123.366 0.416 . . . . 0.0 111.881 -177.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.8 m -70.33 -36.65 67.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -177.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -71.95 -34.88 69.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.733 0.302 . . . . 0.0 110.834 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -71.95 -37.77 69.91 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.152 0.501 . . . . 0.0 110.79 -178.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.68 153.73 40.87 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.304 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -86.22 -18.22 32.72 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-O 121.125 0.488 . . . . 0.0 110.766 179.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -130.46 125.74 35.16 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.382 -175.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 64.0 mt -106.86 112.74 41.13 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.84 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 170.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.542 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 26.8 mt-10 -115.42 137.23 52.27 Favored 'General case' 0 C--N 1.285 -2.229 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.365 -172.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.436 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 18.9 m -110.89 121.23 63.22 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 175.199 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.458 ' HB3' ' HB2' ' A' ' 91' ' ' TYR . 40.6 tt0 -110.76 121.09 44.47 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -95.84 147.0 24.11 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 178.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.509 ' OD1' ' HG2' ' A' ' 78' ' ' LYS . 10.8 t70 -85.0 -179.36 7.04 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 -177.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.509 ' HG2' ' OD1' ' A' ' 77' ' ' ASP . 21.2 pttp -73.05 -16.15 61.49 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 123.115 0.566 . . . . 0.0 112.084 -172.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -89.99 -107.15 1.25 Allowed Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.865 -179.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -110.9 165.06 12.16 Favored 'General case' 0 C--N 1.309 -1.193 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.826 -173.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 63.2 mtp180 -109.57 -21.4 12.47 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.83 -174.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 22.9 p . . . . . 0 C--N 1.3 -1.574 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.763 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 10.4 tpp85 . . . . . 0 N--CA 1.414 -2.268 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -95.63 133.49 11.51 Favored Glycine 0 N--CA 1.432 -1.591 0 N-CA-C 108.595 -1.802 . . . . 0.0 108.595 173.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.2 pp -112.84 125.66 54.59 Favored 'General case' 0 N--CA 1.411 -2.415 0 CA-C-N 118.138 0.969 . . . . 0.0 112.91 -177.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -152.63 162.29 41.43 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.313 -179.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.458 ' HB2' ' HB3' ' A' ' 75' ' ' GLU . 83.6 m-85 -87.49 128.6 35.23 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 105.58 -2.007 . . . . 0.0 105.58 174.057 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 48.4 mm -99.32 123.9 52.29 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.663 0 C-N-CA 120.029 -0.668 . . . . 0.0 109.241 -177.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.542 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 6.1 m-85 -116.84 143.56 45.54 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.536 178.522 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -121.55 100.24 6.91 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 175.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.1 t70 46.77 58.72 4.45 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 124.802 1.241 . . . . 0.0 111.323 -175.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.96 -22.5 11.73 Favored Glycine 0 N--CA 1.444 -0.829 0 CA-C-N 114.818 -1.083 . . . . 0.0 114.475 179.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -80.32 129.55 34.58 Favored 'General case' 0 CA--C 1.501 -0.92 0 CA-C-N 117.475 0.638 . . . . 0.0 111.309 -178.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -75.68 105.84 6.93 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 52.2 t -73.19 -39.18 56.1 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.09 0 CA-C-O 121.452 0.644 . . . . 0.0 109.554 -178.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -64.61 -44.41 90.68 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.689 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -66.42 -33.78 76.48 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.995 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.42 -37.81 84.82 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.09 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.408 HD22 HG23 ' A' ' 62' ' ' THR . 84.9 mt -63.13 -44.45 95.57 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.042 177.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 44.0 t -69.7 -37.78 74.71 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.156 0 CA-C-O 121.549 0.69 . . . . 0.0 109.591 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -61.72 -44.85 96.12 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 124.953 1.301 . . . . 0.0 111.693 179.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -83.59 2.12 38.83 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.27 -177.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.441 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 66.04 35.87 91.2 Favored Glycine 0 N--CA 1.43 -1.759 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 -179.042 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.6 mt -96.69 -18.61 19.56 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -151.19 164.85 35.6 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 115.232 -0.895 . . . . 0.0 108.816 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.417 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 94.5 mttt -104.39 168.79 8.87 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 176.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.444 HG13 ' OE2' ' B' ' 142' ' ' GLU . 7.4 p -79.12 132.54 31.9 Favored 'Isoleucine or valine' 0 C--O 1.251 1.173 0 C-N-CA 118.205 -1.398 . . . . 0.0 107.937 175.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.466 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.546 -178.409 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 14.0 p80 . . . . . 0 C--O 1.266 1.925 0 CA-C-O 121.76 0.791 . . . . 0.0 112.005 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.467 ' OE1' ' HG2' ' B' ' 136' ' ' GLN . 0.2 OUTLIER -65.44 -33.52 76.13 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.855 179.334 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . 0.56 ' O ' ' HG2' ' B' ' 140' ' ' LYS . 15.2 mm100 -57.8 -34.17 69.35 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.799 177.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 64.1 mt -66.24 -42.68 88.28 Favored 'General case' 0 C--O 1.242 0.689 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 6.8 mp -69.54 -30.94 68.88 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 120.352 -0.539 . . . . 0.0 111.75 175.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -69.85 -28.19 65.47 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 176.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' B' ' 136' ' ' GLN . 3.9 mmmp? -61.63 -42.34 98.76 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 174.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 2.6 p -71.89 -41.17 68.28 Favored 'General case' 0 N--CA 1.426 -1.641 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.904 176.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.568 ' HG3' ' CZ2' ' B' ' 153' ' ' TRP . 39.4 tt0 -61.39 -58.02 9.91 Favored 'General case' 0 C--O 1.211 -0.931 0 O-C-N 123.244 0.34 . . . . 0.0 111.839 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . 0.408 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -56.34 -39.21 72.47 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 123.477 0.485 . . . . 0.0 111.435 -176.239 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 144' ' ' GLN . . . . . 0.4 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 52.0 tt0 -70.21 -45.25 66.96 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.179 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -69.48 -28.18 65.85 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.492 -178.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 146' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 92.8 mttt -58.9 -44.31 91.18 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 174.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . 0.408 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 74.7 mmtt -71.8 -35.27 69.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.898 -178.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . 0.411 ' CB ' ' HG ' ' B' ' 150' ' ' LEU . 20.4 mm-40 -66.61 -29.84 69.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.822 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' B' ' 154' ' ' SER . 46.5 mtpt 59.75 57.42 3.18 Favored 'General case' 0 CA--C 1.505 -0.757 0 C-N-CA 124.737 1.215 . . . . 0.0 109.03 -174.442 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . 0.411 ' HG ' ' CB ' ' B' ' 148' ' ' GLU . 87.9 mt -87.85 117.67 26.86 Favored 'General case' 0 CA--C 1.489 -1.392 0 CA-C-N 114.291 -1.322 . . . . 0.0 110.659 -178.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 151' ' ' ASN . . . . . 0.441 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 88.3 m-20 52.52 -89.46 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.903 0 O-C-N 124.673 1.233 . . . . 0.0 114.127 172.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 13.0 tt -72.98 -25.8 22.38 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.222 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -178.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 153' ' ' TRP . . . . . 0.568 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 55.2 m95 -79.39 -7.94 58.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.892 0.853 . . . . 0.0 109.459 178.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 154' ' ' SER . . . . . 0.423 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 35.2 t -103.79 26.73 8.25 Favored 'General case' 0 N--CA 1.419 -1.988 0 CA-C-N 114.457 -1.247 . . . . 0.0 108.426 174.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -62.23 -34.11 75.87 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 174.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 5.6 t70 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 127.71 2.404 . . . . 0.0 114.17 170.756 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 . . . . . 0 N--CA 1.426 -1.642 0 CA-C-O 121.187 0.518 . . . . 0.0 109.871 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -111.48 153.58 25.96 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 115.26 -0.882 . . . . 0.0 108.869 177.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -138.68 162.18 54.4 Favored Pre-proline 0 C--N 1.278 -2.51 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 176.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.538 ' HA ' ' O ' ' A' ' 72' ' ' ILE . 19.5 Cg_exo -74.51 155.77 45.32 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 122.294 1.996 . . . . 0.0 111.629 178.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -138.83 166.64 23.91 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.453 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 30.6 m -104.32 139.79 38.81 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 177.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.4 tp -88.69 133.52 34.19 Favored 'General case' 0 C--N 1.306 -1.301 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.234 -177.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 66.6 mt -92.55 -59.22 3.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.549 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 175.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -174.49 161.6 3.34 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.949 -1.023 . . . . 0.0 108.562 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -97.75 151.23 20.38 Favored 'General case' 0 C--N 1.29 -2.004 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 174.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.0 mm -112.89 -56.56 4.21 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -135.3 -160.59 1.07 Allowed 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 -176.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -76.45 -38.04 34.27 Favored Glycine 0 C--N 1.303 -1.298 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.134 -179.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.502 ' OD2' HG21 ' A' ' 41' ' ' THR . 4.0 p30 -106.42 -12.33 15.68 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 120.788 0.327 . . . . 0.0 111.603 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.43 111.87 24.63 Favored 'General case' 0 N--CA 1.425 -1.676 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.521 -174.674 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.9 m -136.91 147.43 27.18 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 C-N-CA 122.66 0.384 . . . . 0.0 110.48 -177.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -103.14 118.39 36.68 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 121.426 0.631 . . . . 0.0 111.188 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.9 mp -127.44 156.29 42.32 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.949 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.453 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 26.2 ttt -118.01 98.92 6.57 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 178.447 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.406 ' CD1' ' HZ ' ' A' ' 34' ' ' PHE . 7.6 p90 -98.67 111.76 24.03 Favored 'General case' 0 C--N 1.308 -1.204 0 C-N-CA 119.896 -0.722 . . . . 0.0 111.159 -174.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 37.4 mtpt 57.96 37.75 26.78 Favored 'General case' 0 C--O 1.245 0.862 0 CA-C-N 114.106 -1.406 . . . . 0.0 109.871 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 90.83 6.63 67.18 Favored Glycine 0 N--CA 1.436 -1.36 0 CA-C-N 114.001 -1.454 . . . . 0.0 113.703 177.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -112.59 106.17 55.7 Favored Pre-proline 0 C--N 1.311 -1.077 0 O-C-N 122.112 -0.64 . . . . 0.0 110.772 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -77.38 124.86 7.35 Favored 'Trans proline' 0 CA--C 1.534 0.504 0 C-N-CA 123.243 2.629 . . . . 0.0 112.648 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 53.7 mtt -145.57 156.54 43.75 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 122.948 0.499 . . . . 0.0 110.734 176.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.6 m -89.53 117.5 28.48 Favored 'General case' 0 N--CA 1.422 -1.866 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 172.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.406 ' HZ ' ' CD1' ' A' ' 27' ' ' TYR . 39.2 m-85 -95.96 145.64 25.26 Favored 'General case' 0 C--N 1.281 -2.379 0 CA-C-O 121.645 0.736 . . . . 0.0 112.488 -175.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 tpp85 -115.13 125.11 53.08 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 170.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.431 ' HA ' ' O ' ' A' ' 90' ' ' ALA . 71.3 mt -71.98 119.2 15.83 Favored 'General case' 0 C--N 1.288 -2.078 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.192 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.464 HD13 ' OD2' ' A' ' 77' ' ' ASP . 74.1 mt -60.42 139.57 57.63 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.756 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.516 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 88.2 mt 74.0 -0.38 3.37 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.924 1.29 . . . . 0.0 112.684 -178.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.5 t -115.21 133.8 60.32 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -179.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.42 ' HB2' ' HB3' ' A' ' 112' ' ' ALA . 16.4 t70 -142.28 108.39 5.22 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 175.385 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.502 HG21 ' OD2' ' A' ' 21' ' ' ASP . 14.1 t . . . . . 0 CA--C 1.6 2.868 0 N-CA-C 115.009 1.485 . . . . 0.0 115.009 -178.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.732 0 CA-C-O 119.63 -0.539 . . . . 0.0 112.566 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -52.26 -36.57 68.24 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.805 2.336 . . . . 0.0 112.506 176.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -61.48 -50.54 72.32 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.84 -50.96 66.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.71 -177.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.5 m -59.89 -38.79 83.23 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 120.919 0.39 . . . . 0.0 111.463 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.42 -36.18 76.45 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.113 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -61.92 -50.03 73.81 Favored 'General case' 0 C--O 1.241 0.605 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.454 ' O ' HG22 ' A' ' 66' ' ' VAL . 27.9 m -57.49 -49.72 75.37 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 123.972 0.795 . . . . 0.0 110.03 177.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -54.98 -52.99 61.37 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 178.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -59.23 -40.18 85.08 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 120.676 0.274 . . . . 0.0 111.601 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.6 mmt -72.45 -50.96 22.4 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.454 HG22 ' O ' ' A' ' 62' ' ' THR . 22.2 m -77.08 -28.89 16.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -174.289 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -77.86 -35.51 50.92 Favored 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 119.848 -0.741 . . . . 0.0 111.28 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -79.26 -14.7 58.87 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 121.267 0.556 . . . . 0.0 110.737 177.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.59 133.82 56.45 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.112 -178.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -80.25 -62.93 1.53 Allowed 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 176.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -106.42 118.86 37.76 Favored 'General case' 0 N--CA 1.425 -1.724 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.538 ' O ' ' HA ' ' A' ' 11' ' ' PRO . 64.9 mt -99.62 118.72 46.64 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.497 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 178.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.44 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 3.5 mm-40 -111.24 133.64 53.43 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -175.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.6 m -110.92 118.5 57.45 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.725 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 174.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -107.76 121.24 44.31 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 120.638 0.256 . . . . 0.0 110.408 -177.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -98.59 129.7 45.12 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 -177.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.464 ' OD2' HD13 ' A' ' 37' ' ' LEU . 2.2 p30 -94.8 -173.86 3.11 Favored 'General case' 0 N--CA 1.426 -1.631 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -176.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -75.76 -8.02 55.84 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.573 0.749 . . . . 0.0 112.288 -174.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -79.88 -70.88 1.3 Allowed Glycine 0 N--CA 1.428 -1.885 0 N-CA-C 111.696 -0.562 . . . . 0.0 111.696 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -145.61 150.57 36.6 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 -176.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -102.36 -39.07 7.34 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 122.033 0.921 . . . . 0.0 109.048 176.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 15.2 p . . . . . 0 N--CA 1.429 -1.478 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.407 -178.075 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 48.4 ttp180 . . . . . 0 N--CA 1.45 -0.461 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -82.17 143.66 23.12 Favored Glycine 0 C--N 1.305 -1.191 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 91.5 mt -127.36 108.46 10.86 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -179.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.431 ' O ' ' HA ' ' A' ' 36' ' ' LEU . . . -156.63 166.19 34.11 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.851 -177.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -91.61 142.38 27.69 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 170.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 14.0 tt -113.3 135.7 51.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.453 0 C-N-CA 118.316 -1.354 . . . . 0.0 111.559 -178.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.44 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 8.5 m-85 -116.46 139.03 50.9 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.675 176.735 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -109.0 100.17 9.4 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.7 t70 46.35 57.88 5.0 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 124.725 1.21 . . . . 0.0 111.431 -177.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.63 -23.55 12.68 Favored Glycine 0 CA--C 1.52 0.393 0 CA-C-N 114.846 -1.07 . . . . 0.0 114.02 177.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.2 mtmm -90.57 119.39 30.78 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -177.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' MET . . . . . 0.417 ' HA ' ' HA ' ' A' ' 93' ' ' TYR . 41.7 ttp -83.98 103.68 13.43 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 121.951 0.881 . . . . 0.0 112.991 -175.108 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 43.7 t -67.02 -29.18 45.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.653 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -53.54 -52.17 60.54 Favored 'General case' 0 C--O 1.258 1.517 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.106 -178.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.659 ' O ' ' HG2' ' A' ' 105' ' ' ARG . 6.9 pt-20 -77.31 -30.29 54.06 Favored 'General case' 0 N--CA 1.412 -2.365 0 C-N-CA 118.216 -1.394 . . . . 0.0 110.123 -179.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -56.83 -38.98 73.4 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 122.779 0.432 . . . . 0.0 110.904 -179.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 99.1 mt -60.84 -46.7 89.52 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.172 175.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 66.1 t -70.15 -37.35 71.51 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.186 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.492 178.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.659 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 33.9 mmm-85 -58.22 -41.62 84.46 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.23 0.612 . . . . 0.0 110.481 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -83.49 -4.68 58.74 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.719 -177.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.88 33.89 80.96 Favored Glycine 0 N--CA 1.439 -1.152 0 C-N-CA 120.156 -1.021 . . . . 0.0 111.092 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.3 mt -91.05 -6.24 54.11 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 122.16 0.981 . . . . 0.0 108.667 178.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -152.13 165.69 34.0 Favored 'General case' 0 N--CA 1.405 -2.701 0 CA-C-N 114.295 -1.321 . . . . 0.0 107.775 -179.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -103.82 152.09 22.31 Favored 'General case' 0 N--CA 1.409 -2.5 0 N-CA-C 105.136 -2.172 . . . . 0.0 105.136 176.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.7 p -77.28 128.99 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 118.384 -1.326 . . . . 0.0 109.601 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.516 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . . . . . . 0 C--N 1.293 -1.882 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 173.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 . . . . . 0 CA--C 1.497 -1.091 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -62.37 -45.43 93.21 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 114.23 -1.35 . . . . 0.0 113.005 -168.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -60.05 -42.94 95.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.033 0.444 . . . . 0.0 110.082 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.85 -50.17 73.32 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.623 -177.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 9.1 mp -68.86 -38.49 79.76 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 -179.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -61.77 -41.73 98.08 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.977 0.417 . . . . 0.0 109.948 176.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . 0.434 ' HE3' ' HA ' ' B' ' 140' ' ' LYS . 1.4 tpmt? -71.2 -37.77 72.09 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.704 -179.137 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.4 m -65.78 -37.17 85.6 Favored 'General case' 0 C--O 1.244 0.811 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.488 178.238 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.613 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 29.8 tt0 -65.52 -41.86 92.65 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.445 175.558 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -54.24 -46.01 72.47 Favored 'General case' 0 CA--C 1.518 -0.281 0 O-C-N 123.555 0.534 . . . . 0.0 110.399 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 144' ' ' GLN . . . . . 0.463 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 2.6 mp0 -64.78 -46.19 83.14 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.172 175.236 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -58.31 -36.22 73.02 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 123.038 0.535 . . . . 0.0 112.369 -179.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 146' ' ' LYS . . . . . 0.613 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 50.8 mttm -59.76 -47.67 84.73 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 176.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -65.32 -41.91 93.5 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.636 -178.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 20.8 mm-40 -71.89 -18.27 62.05 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.914 -178.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . 0.583 ' O ' ' HB2' ' B' ' 154' ' ' SER . 29.6 mtpp 56.77 65.57 1.37 Allowed 'General case' 0 N--CA 1.437 -1.079 0 C-N-CA 124.098 0.959 . . . . 0.0 110.698 -176.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 94.4 mt -99.76 126.81 45.89 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.146 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 46.67 -93.96 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 125.549 1.54 . . . . 0.0 114.563 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 65.1 mt -63.88 -31.33 52.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 CA-C-O 121.586 0.708 . . . . 0.0 110.708 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 153' ' ' TRP . . . . . 0.421 ' CG ' ' HA ' ' B' ' 146' ' ' LYS . 49.1 m95 -83.98 -3.68 58.17 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.778 0.799 . . . . 0.0 110.247 -179.032 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 154' ' ' SER . . . . . 0.583 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 11.8 t -115.0 28.75 8.5 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 177.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -75.06 -25.48 58.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.043 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 9.8 t70 . . . . . 0 C--N 1.298 -1.656 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 -176.836 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.2 m170 . . . . . 0 CA--C 1.505 -0.756 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.446 ' HG2' ' HB2' ' A' ' 75' ' ' GLU . 46.4 mtmt -89.64 109.68 20.63 Favored 'General case' 0 N--CA 1.432 -1.362 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 170.413 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.41 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 7.2 pt-20 -112.73 138.24 22.02 Favored Pre-proline 0 C--N 1.273 -2.759 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.651 178.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 17.3 Cg_exo -67.37 136.65 40.73 Favored 'Trans proline' 0 C--O 1.24 0.605 0 C-N-CA 122.575 2.183 . . . . 0.0 113.199 -176.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -128.31 159.46 35.21 Favored 'General case' 0 N--CA 1.425 -1.676 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.753 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 72.9 m -110.93 128.7 55.91 Favored 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 177.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 57.4 tp -69.38 128.13 35.49 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 120.631 0.253 . . . . 0.0 110.638 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.4 mm -95.05 -55.1 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 173.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -171.54 137.91 1.1 Allowed 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.437 179.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.403 ' HA ' HG13 ' A' ' 23' ' ' VAL . . . -86.67 105.75 17.13 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 175.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.4 mm -74.41 -49.16 32.85 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.594 -175.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.411 ' HB3' ' H ' ' A' ' 22' ' ' THR . 5.3 t70 -142.91 -163.71 1.69 Allowed 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 106.851 -1.537 . . . . 0.0 106.851 -173.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -110.8 44.69 1.45 Allowed Glycine 0 C--N 1.293 -1.818 0 N-CA-C 107.555 -2.218 . . . . 0.0 107.555 176.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -167.21 -52.23 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 113.144 -1.528 . . . . 0.0 107.905 -170.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.411 ' H ' ' HB3' ' A' ' 19' ' ' ASP . 31.1 m -105.88 122.34 45.91 Favored 'General case' 0 N--CA 1.428 -1.567 0 CA-C-N 114.281 -1.327 . . . . 0.0 108.931 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.403 HG13 ' HA ' ' A' ' 17' ' ' ALA . 22.9 t -133.89 145.08 33.9 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.678 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 -178.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -107.19 125.21 50.81 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 119.589 1.086 . . . . 0.0 109.804 -179.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.401 ' O ' ' HA ' ' A' ' 31' ' ' PRO . 4.7 mp -136.12 158.41 44.47 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-O 121.076 0.465 . . . . 0.0 110.74 -178.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.416 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 59.4 ttp -110.31 106.05 15.29 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 11.1 p90 -111.94 121.33 44.73 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 178.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp 58.29 27.71 15.63 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 123.627 0.771 . . . . 0.0 111.002 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.434 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 94.1 3.25 63.75 Favored Glycine 0 N--CA 1.444 -0.772 0 CA-C-N 115.796 -0.638 . . . . 0.0 113.167 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.416 ' O ' ' HA ' ' A' ' 26' ' ' MET . 14.1 mm100 -103.67 101.39 23.93 Favored Pre-proline 0 C--N 1.313 -1.007 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 179.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.434 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 2.0 Cg_endo -81.85 85.08 1.76 Allowed 'Trans proline' 0 N--CA 1.448 -1.196 0 C-N-CA 122.532 2.155 . . . . 0.0 109.783 175.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 29.5 mmt -100.29 156.27 17.32 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.757 -175.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.42 ' O ' ' HB3' ' A' ' 87' ' ' ARG . 9.1 m -84.27 113.23 20.97 Favored 'General case' 0 N--CA 1.409 -2.493 0 N-CA-C 105.916 -1.883 . . . . 0.0 105.916 174.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -95.61 148.16 22.81 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-O 121.78 0.8 . . . . 0.0 111.842 -176.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.2 tpp85 -122.2 129.77 52.57 Favored 'General case' 0 C--N 1.278 -2.541 0 N-CA-C 105.758 -1.941 . . . . 0.0 105.758 173.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 86.0 mt -72.37 119.2 16.24 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 175.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 17.9 mt -55.89 129.03 37.93 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 -177.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 11.1 mt 69.77 33.45 2.92 Favored 'General case' 0 C--N 1.356 0.873 0 O-C-N 124.787 1.304 . . . . 0.0 112.424 164.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.2 t -110.56 128.93 66.52 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.185 0 CA-C-N 114.678 -1.146 . . . . 0.0 108.09 178.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -103.84 108.27 19.51 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 36.7 p . . . . . 0 CA--C 1.561 1.385 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 176.499 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.211 -1.302 0 CA-C-O 118.805 -0.997 . . . . 0.0 113.813 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -51.07 -45.45 36.62 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 122.755 2.304 . . . . 0.0 112.406 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -63.75 -48.1 78.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.854 -179.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.33 -41.65 66.26 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.276 -177.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.3 p -63.23 -43.6 97.62 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -178.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.99 -41.05 95.76 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-O 120.937 0.398 . . . . 0.0 110.519 179.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -64.98 -50.92 64.47 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.458 177.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.527 ' O ' HG23 ' A' ' 66' ' ' VAL . 61.5 m -55.87 -46.97 78.13 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 123.9 0.75 . . . . 0.0 110.975 -179.085 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -56.54 -53.97 51.29 Favored 'General case' 0 C--O 1.214 -0.775 0 O-C-N 123.395 0.435 . . . . 0.0 111.608 178.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -64.2 -32.31 73.84 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 120.91 0.386 . . . . 0.0 111.52 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 11.4 tpt -67.74 -45.83 73.87 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.706 -178.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.527 HG23 ' O ' ' A' ' 62' ' ' THR . 28.8 m -89.61 -31.77 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 -175.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -75.96 -20.42 57.93 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.987 0.423 . . . . 0.0 111.552 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -90.38 -15.21 31.46 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.327 0.584 . . . . 0.0 110.504 175.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -77.58 149.16 34.87 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.747 -176.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -76.66 -65.62 0.91 Allowed 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.626 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.4 mtmm -109.52 135.43 50.53 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 -178.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 69.6 mt -104.74 119.93 54.44 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.091 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 175.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.42 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 32.9 mt-10 -113.32 136.56 52.62 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -177.261 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.449 HG13 HG12 ' A' ' 92' ' ' ILE . 33.1 m -110.41 126.15 67.68 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.873 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 176.011 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.446 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 40.8 tt0 -115.62 115.55 26.61 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -92.2 148.98 21.73 Favored 'General case' 0 C--N 1.287 -2.126 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -84.63 -178.78 6.98 Favored 'General case' 0 C--O 1.245 0.817 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 -176.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -8.07 54.94 Favored 'General case' 0 N--CA 1.44 -0.946 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 -172.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -93.32 -98.75 1.49 Allowed Glycine 0 N--CA 1.421 -2.364 0 C-N-CA 120.213 -0.994 . . . . 0.0 112.148 178.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.419 ' HB3' ' O ' ' A' ' 82' ' ' THR . 21.9 mp0 -98.71 127.11 44.53 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.295 0.569 . . . . 0.0 112.378 -176.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -89.2 -27.9 20.34 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 174.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.419 ' O ' ' HB3' ' A' ' 80' ' ' GLN . 11.0 p . . . . . 0 N--CA 1.422 -1.825 0 CA-C-N 114.618 -1.174 . . . . 0.0 109.952 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.42 ' HB3' ' O ' ' A' ' 33' ' ' THR . 69.8 mtt180 . . . . . 0 N--CA 1.449 -0.508 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -104.21 128.96 9.67 Favored Glycine 0 N--CA 1.431 -1.65 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 174.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 76.6 mt -110.01 108.35 18.55 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 117.154 0.477 . . . . 0.0 109.754 -179.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.11 167.33 30.76 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-O 121.654 0.74 . . . . 0.0 111.913 -178.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -96.94 127.48 42.95 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 104.332 -2.47 . . . . 0.0 104.332 170.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.449 HG12 HG13 ' A' ' 74' ' ' VAL . 55.3 mt -98.55 126.83 51.58 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.108 0 C-N-CA 117.684 -1.607 . . . . 0.0 111.578 -178.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.42 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 6.2 m-85 -105.77 127.1 52.89 Favored 'General case' 0 N--CA 1.428 -1.555 0 N-CA-C 107.478 -1.305 . . . . 0.0 107.478 176.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.34 99.93 9.64 Favored 'General case' 0 C--N 1.28 -2.451 0 N-CA-C 106.676 -1.601 . . . . 0.0 106.676 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 12.5 t70 45.39 57.73 4.67 Favored 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 125.797 1.639 . . . . 0.0 110.725 -172.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.87 -25.73 7.29 Favored Glycine 0 CA--C 1.526 0.722 0 CA-C-N 114.475 -1.239 . . . . 0.0 113.952 179.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -81.33 114.38 20.07 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -178.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 33.3 ttm -73.99 108.88 7.07 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 120.519 -0.472 . . . . 0.0 110.163 -176.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.0 t -66.12 -34.85 72.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 -178.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -57.76 -50.59 72.72 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.938 178.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.426 ' HG3' ' OG ' ' B' ' 141' ' ' SER . 22.4 tt0 -65.86 -42.74 90.03 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.647 175.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.74 -44.11 77.26 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 122.92 0.488 . . . . 0.0 112.286 -178.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 90.0 mt -62.93 -44.09 97.01 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.844 0.354 . . . . 0.0 110.865 178.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.432 ' HA ' ' O ' ' A' ' 109' ' ' ALA . 58.6 t -70.43 -37.4 70.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.25 -179.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 10.3 tpp180 -67.16 -25.78 66.33 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.803 0.841 . . . . 0.0 110.2 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.443 ' O ' ' HB3' ' B' ' 150' ' ' LEU . 25.5 mm-40 -95.42 0.1 53.04 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.501 178.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.442 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 65.09 22.99 69.35 Favored Glycine 0 C--O 1.218 -0.848 0 C-N-CA 121.245 -0.502 . . . . 0.0 112.523 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 82.2 mt -81.67 -21.07 38.35 Favored 'General case' 0 CA--C 1.495 -1.139 0 CA-C-O 121.743 0.782 . . . . 0.0 108.981 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.432 ' O ' ' HA ' ' A' ' 104' ' ' VAL . . . -154.86 159.15 40.32 Favored 'General case' 0 N--CA 1.409 -2.524 0 N-CA-C 106.673 -1.603 . . . . 0.0 106.673 -179.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 15.4 pttp -121.23 157.86 29.36 Favored 'General case' 0 N--CA 1.416 -2.126 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.7 p -92.77 120.81 42.74 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 119.725 -0.79 . . . . 0.0 112.099 -172.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.148 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.495 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 72.7 m80 . . . . . 0 N--CA 1.443 -0.78 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.548 ' O ' ' HG2' ' B' ' 139' ' ' ARG . 12.3 pt-20 -51.7 -46.33 63.87 Favored 'General case' 0 C--N 1.358 0.946 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -171.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -66.37 -38.52 87.75 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 123.091 0.244 . . . . 0.0 111.236 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 79.4 mt -60.93 -48.43 81.86 Favored 'General case' 0 C--O 1.246 0.871 0 CA-C-O 121.913 0.863 . . . . 0.0 109.616 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 44.7 mt -69.69 -37.28 76.55 Favored 'General case' 0 N--CA 1.42 -1.93 0 N-CA-C 113.888 1.069 . . . . 0.0 113.888 -178.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 139' ' ' ARG . . . . . 0.548 ' HG2' ' O ' ' B' ' 135' ' ' GLU . 16.7 ptt-85 -70.7 -28.01 64.43 Favored 'General case' 0 N--CA 1.435 -1.205 0 C-N-CA 119.333 -0.947 . . . . 0.0 112.392 177.05 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -67.57 -41.24 84.46 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 173.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 141' ' ' SER . . . . . 0.426 ' OG ' ' HG3' ' A' ' 101' ' ' GLU . 43.3 m -59.11 -44.78 92.0 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.418 177.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.63 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 40.8 tt0 -66.13 -45.43 81.1 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 115.043 -0.981 . . . . 0.0 109.994 179.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -51.46 -47.3 63.16 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.894 0.877 . . . . 0.0 112.692 -178.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -64.55 -46.68 81.78 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 123.225 0.328 . . . . 0.0 111.024 177.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -61.07 -37.3 82.2 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.101 -178.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 146' ' ' LYS . . . . . 0.63 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 86.7 mttt -57.71 -48.85 78.42 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.136 0.493 . . . . 0.0 109.819 177.482 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -72.53 -37.15 68.39 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.439 -174.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -72.64 -12.21 60.95 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.603 178.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . 0.632 ' O ' ' HB2' ' B' ' 154' ' ' SER . 29.0 mmmt 59.74 53.33 4.94 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 -178.112 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . 0.443 ' HB3' ' O ' ' A' ' 106' ' ' GLN . 79.7 mt -92.17 121.42 33.68 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.09 -177.116 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 151' ' ' ASN . . . . . 0.442 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 45.9 m-80 50.46 -90.55 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.236 1.815 . . . . 0.0 113.704 176.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 152' ' ' ILE . . . . . 0.523 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 55.1 mt -63.48 -38.0 81.04 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.945 0 CA-C-O 121.407 0.622 . . . . 0.0 109.957 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 153' ' ' TRP . . . . . 0.437 ' CG ' ' HA ' ' B' ' 146' ' ' LYS . 60.5 m95 -79.77 -4.91 54.07 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-O 121.225 0.536 . . . . 0.0 111.574 -176.22 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 154' ' ' SER . . . . . 0.632 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 32.5 t -95.62 9.54 39.88 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.724 175.405 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 9.2 pt-20 -70.19 -30.56 67.7 Favored 'General case' 0 C--N 1.35 0.59 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 173.26 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 18.0 t70 . . . . . 0 N--CA 1.447 -0.614 0 C-N-CA 126.153 1.781 . . . . 0.0 110.267 178.936 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 . . . . . 0 C--O 1.247 0.938 0 CA-C-O 120.451 0.167 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -71.39 154.91 41.21 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.65 176.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -139.41 152.52 69.3 Favored Pre-proline 0 C--N 1.277 -2.558 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.529 176.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -77.02 140.36 20.05 Favored 'Trans proline' 0 N--CA 1.447 -1.209 0 C-N-CA 121.989 1.793 . . . . 0.0 111.268 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -119.57 166.79 12.69 Favored 'General case' 0 C--N 1.288 -2.079 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.463 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 11.7 m -105.01 134.43 48.13 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 178.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 64.5 tp -72.99 133.61 44.36 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 120.931 0.396 . . . . 0.0 110.793 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 64.8 mt -106.01 -59.11 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.751 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 172.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.4 pttt -170.95 134.02 0.94 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.162 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -95.5 106.25 18.31 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 107.759 -1.201 . . . . 0.0 107.759 174.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 48.3 mm -71.3 -50.13 43.16 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-O 121.399 0.619 . . . . 0.0 109.528 -176.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.473 ' HA ' ' CB ' ' A' ' 59' ' ' SER . 7.5 t70 -139.89 -162.33 1.32 Allowed 'General case' 0 C--N 1.294 -1.83 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 -178.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -91.84 -7.59 64.35 Favored Glycine 0 C--N 1.302 -1.314 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 177.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.433 ' HB2' ' OG1' ' A' ' 41' ' ' THR . 13.8 t70 -95.18 -56.97 2.55 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 113.813 -1.193 . . . . 0.0 110.117 -179.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -111.46 130.12 55.81 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.014 -176.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.3 p -137.92 138.35 43.96 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 C-N-CA 124.461 1.105 . . . . 0.0 108.281 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.8 tttp -100.11 122.5 43.06 Favored 'General case' 0 C--N 1.293 -1.878 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 -175.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.0 mp -125.71 159.4 32.39 Favored 'General case' 0 CA--C 1.497 -1.066 0 CA-C-O 121.358 0.599 . . . . 0.0 110.477 -178.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.463 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 43.6 ttm -118.0 120.03 36.58 Favored 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 114.737 -1.119 . . . . 0.0 108.368 177.159 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.8 p90 -120.41 114.13 21.36 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 59.1 mttp 60.95 27.45 17.31 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.821 0.848 . . . . 0.0 111.856 -177.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.13 2.76 64.01 Favored Glycine 0 C--N 1.314 -0.669 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.684 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.424 ' O ' ' HA ' ' A' ' 26' ' ' MET . 42.5 mt-30 -97.97 109.27 50.78 Favored Pre-proline 0 C--N 1.313 -0.983 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 177.578 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -88.86 106.4 0.45 Allowed 'Trans proline' 0 N--CA 1.443 -1.46 0 C-N-CA 122.732 2.288 . . . . 0.0 111.949 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -119.81 145.45 46.61 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.037 178.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 10.6 m -85.47 104.5 15.31 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 175.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -95.19 142.77 27.23 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-O 121.481 0.658 . . . . 0.0 111.155 -174.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.41 ' HD3' ' OD1' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -113.12 132.85 55.28 Favored 'General case' 0 C--N 1.275 -2.635 0 N-CA-C 104.416 -2.438 . . . . 0.0 104.416 174.016 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.438 ' HB2' ' HB ' ' A' ' 39' ' ' VAL . 6.6 mp -66.57 130.33 42.82 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -175.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.2 mt -62.11 127.36 30.98 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.787 174.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 74.4 mt 75.18 8.22 4.02 Favored 'General case' 0 C--O 1.221 -0.429 0 O-C-N 124.751 1.282 . . . . 0.0 113.062 176.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.438 ' HB ' ' HB2' ' A' ' 36' ' ' LEU . 84.9 t -118.12 125.8 74.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -135.56 123.57 22.79 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 178.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.433 ' OG1' ' HB2' ' A' ' 21' ' ' ASP . 73.8 p . . . . . 0 CA--C 1.569 1.701 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 1.577 0 CA-C-O 119.664 -0.52 . . . . 0.0 112.847 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -55.9 -22.99 40.39 Favored 'Trans proline' 0 C--N 1.37 1.675 0 C-N-CA 123.073 2.516 . . . . 0.0 114.237 176.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -86.3 -36.13 19.5 Favored 'General case' 0 C--O 1.209 -1.066 0 C-N-CA 120.113 -0.635 . . . . 0.0 109.817 178.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.35 -43.3 92.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.505 0.669 . . . . 0.0 110.16 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.473 ' CB ' ' HA ' ' A' ' 19' ' ' ASP . 8.8 p -68.05 -40.4 82.83 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.22 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.07 -46.63 64.55 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.13 -177.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -56.2 -44.78 79.77 Favored 'General case' 0 CA--C 1.507 -0.702 0 C-N-CA 123.795 0.838 . . . . 0.0 110.075 -179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.441 ' O ' HG21 ' A' ' 66' ' ' VAL . 39.5 m -62.15 -45.17 94.61 Favored 'General case' 0 N--CA 1.439 -1.024 0 O-C-N 123.992 0.808 . . . . 0.0 110.591 179.091 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.518 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 49.1 mttp -58.0 -54.55 45.7 Favored 'General case' 0 C--O 1.212 -0.917 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 176.635 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -60.07 -33.86 72.65 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.509 -0.768 . . . . 0.0 112.046 -176.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.12 -51.44 21.39 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 179.741 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.441 HG21 ' O ' ' A' ' 62' ' ' THR . 32.8 m -71.5 -26.23 26.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -176.357 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.518 ' HG2' ' O ' ' A' ' 63' ' ' LYS . 79.9 mm-40 -71.9 -35.18 69.64 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.782 0.801 . . . . 0.0 109.191 174.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -73.59 -41.56 62.72 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.2 -178.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.13 146.64 54.05 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -177.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.8 mptt -78.09 -60.08 2.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.911 0.862 . . . . 0.0 108.714 179.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -107.06 128.08 54.05 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.521 -174.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 60.3 mt -100.56 124.11 53.91 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.345 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 170.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.51 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 21.5 mt-10 -112.34 133.38 54.47 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -173.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 28.9 m -111.97 129.51 67.3 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.187 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.969 179.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -128.93 142.58 50.89 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -110.13 116.29 31.28 Favored 'General case' 0 N--CA 1.423 -1.795 0 N-CA-C 110.552 -0.166 . . . . 0.0 110.552 177.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -102.29 -175.15 2.75 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 178.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.51 ' HZ3' ' HB2' ' A' ' 78' ' ' LYS . 0.1 OUTLIER -79.9 64.61 4.8 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 -172.948 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -128.27 -106.31 1.31 Allowed Glycine 0 C--N 1.292 -1.9 0 CA-C-N 114.779 -1.101 . . . . 0.0 110.477 174.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -137.91 145.94 42.71 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 -99.3 -10.06 22.81 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 120.356 -0.538 . . . . 0.0 109.736 178.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.411 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 40.1 p . . . . . 0 N--CA 1.435 -1.223 0 CA-C-O 120.857 0.36 . . . . 0.0 110.528 177.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 . . . . . 0 N--CA 1.442 -0.871 0 CA-C-O 121.163 0.506 . . . . 0.0 110.311 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.411 ' HA2' ' HA ' ' A' ' 82' ' ' THR . . . -119.01 162.5 13.47 Favored Glycine 0 N--CA 1.421 -2.351 0 N-CA-C 108.971 -1.652 . . . . 0.0 108.971 174.046 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 74.8 mt -134.16 129.51 35.93 Favored 'General case' 0 C--N 1.29 -1.993 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 176.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -153.16 157.66 40.64 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.078 0.466 . . . . 0.0 110.004 179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -90.96 112.31 24.14 Favored 'General case' 0 C--N 1.294 -1.841 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 176.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 45.6 mm -98.81 126.56 51.97 Favored 'Isoleucine or valine' 0 C--O 1.257 1.451 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -170.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.51 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 4.4 m-85 -112.98 152.75 29.03 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 106.133 -1.803 . . . . 0.0 106.133 173.227 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -130.32 100.07 5.25 Favored 'General case' 0 C--N 1.28 -2.438 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 175.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.7 t70 45.63 58.02 4.57 Favored 'General case' 0 C--O 1.244 0.793 0 C-N-CA 125.017 1.327 . . . . 0.0 113.298 -179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.86 -25.12 23.15 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.382 -0.913 . . . . 0.0 114.432 176.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -100.29 150.33 22.67 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 117.551 0.676 . . . . 0.0 109.304 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 58.6 mtm -97.13 119.87 36.43 Favored 'General case' 0 N--CA 1.414 -2.238 0 C-N-CA 120.336 -0.546 . . . . 0.0 111.429 178.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 38.4 t -63.38 -37.93 80.81 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.27 0 CA-C-N 114.621 -1.172 . . . . 0.0 108.404 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -59.24 -42.61 91.47 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 114.527 -1.215 . . . . 0.0 110.851 177.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -65.57 -56.09 14.17 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.85 -51.01 62.6 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.775 0.83 . . . . 0.0 112.636 -176.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 90.0 mt -58.15 -45.55 87.2 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 60.8 t -73.23 -36.81 50.66 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.04 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 30.0 mmt180 -65.97 -34.52 78.3 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 122.544 0.338 . . . . 0.0 111.541 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -87.14 2.16 50.73 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.645 178.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.04 33.19 86.51 Favored Glycine 0 C--O 1.226 -0.406 0 CA-C-N 116.34 -0.391 . . . . 0.0 112.995 177.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.3 mt -105.32 4.28 30.77 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 120.882 0.372 . . . . 0.0 110.559 -178.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -155.84 160.16 39.97 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.515 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -112.61 171.77 7.32 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.3 p -78.15 126.04 38.12 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.724 0 CA-C-O 121.476 0.655 . . . . 0.0 110.185 178.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.444 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.602 178.188 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 . . . . . 0 CA--C 1.504 -0.794 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.46 ' CG ' ' HE ' ' B' ' 139' ' ' ARG . 43.6 tt0 -62.28 -45.84 91.46 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.798 -177.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -57.86 -38.44 75.73 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.294 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 85.1 mt -67.02 -50.04 63.4 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.187 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.03 -26.51 65.91 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 139' ' ' ARG . . . . . 0.46 ' HE ' ' CG ' ' B' ' 135' ' ' GLU . 47.7 mtt180 -76.24 -22.25 55.4 Favored 'General case' 0 C--O 1.211 -0.971 0 C-N-CA 119.788 -0.765 . . . . 0.0 110.733 175.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -74.08 -32.0 63.06 Favored 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 172.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 13.6 m -65.85 -44.8 84.39 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.253 -0.885 . . . . 0.0 108.629 174.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.514 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 0.0 OUTLIER -64.99 -38.86 92.37 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.047 176.75 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -58.59 -39.79 81.36 Favored 'General case' 0 C--O 1.243 0.76 0 C-N-CA 122.7 0.4 . . . . 0.0 110.937 177.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 144' ' ' GLN . . . . . 0.428 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 53.8 tt0 -69.18 -48.56 61.86 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.836 179.022 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -64.25 -34.35 77.91 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.223 -175.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 146' ' ' LYS . . . . . 0.514 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 80.7 mttt -58.32 -50.22 74.4 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.065 0.459 . . . . 0.0 111.124 174.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -70.46 -22.76 62.65 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.127 -177.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 34.5 mm-40 -89.57 -7.71 54.25 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.31 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . 0.566 ' O ' ' HB2' ' B' ' 154' ' ' SER . 30.5 mmmt 52.08 52.51 14.23 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.543 1.137 . . . . 0.0 109.02 -177.024 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 95.5 mt -88.36 113.38 23.9 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.23 -177.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 54.61 -89.26 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 125.841 1.656 . . . . 0.0 114.072 172.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 22.4 mt -65.01 -36.66 78.35 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.128 0 CA-C-O 121.049 0.452 . . . . 0.0 110.444 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 64.5 m95 -77.59 -9.25 58.84 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-O 121.523 0.678 . . . . 0.0 111.286 -177.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 154' ' ' SER . . . . . 0.566 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 32.9 t -92.66 10.59 29.95 Favored 'General case' 0 N--CA 1.428 -1.575 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.574 175.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' B' ' 156' ' ' ASP . 6.6 pt-20 -55.14 -37.7 67.29 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 121.24 0.543 . . . . 0.0 110.418 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 156' ' ' ASP . . . . . 0.411 ' N ' ' HG3' ' B' ' 155' ' ' GLU . 29.4 t70 . . . . . 0 N--CA 1.423 -1.805 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -177.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.45 -0.466 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.7 tptm -108.13 131.88 54.17 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 114.712 -1.131 . . . . 0.0 108.569 -177.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -128.38 144.76 53.15 Favored Pre-proline 0 C--N 1.303 -1.43 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_exo -81.09 138.48 11.36 Favored 'Trans proline' 0 N--CA 1.447 -1.215 0 C-N-CA 121.89 1.726 . . . . 0.0 108.762 170.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -130.36 141.0 50.58 Favored 'General case' 0 C--N 1.289 -2.043 0 CA-C-O 121.152 0.501 . . . . 0.0 111.747 -177.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.46 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 38.0 m -90.23 127.24 36.08 Favored 'General case' 0 N--CA 1.416 -2.149 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 176.219 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.0 tp -78.47 129.71 35.2 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-O 120.623 0.249 . . . . 0.0 111.317 -177.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 71.7 mt -93.83 -56.94 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.625 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 175.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.403 ' HA ' ' HE3' ' A' ' 16' ' ' LYS . 1.8 tpmt? -175.2 145.22 0.77 Allowed 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 179.006 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -94.71 112.72 24.46 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 173.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.4 mp -82.75 -63.31 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.04 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 -173.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -114.47 -164.07 0.91 Allowed 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 -176.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.67 -29.58 38.82 Favored Glycine 0 C--N 1.304 -1.215 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 -178.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.602 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 2.4 p30 -104.62 -30.44 9.97 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 120.869 -0.332 . . . . 0.0 111.452 178.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.75 116.14 31.95 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-O 121.84 0.829 . . . . 0.0 112.472 -175.064 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.5 p -131.85 142.32 43.32 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 -178.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.2 tttp -104.34 118.89 37.71 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.607 -0.683 . . . . 0.0 109.561 -173.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -119.06 159.3 24.16 Favored 'General case' 0 CA--C 1.502 -0.892 0 CA-C-O 121.731 0.777 . . . . 0.0 111.6 -178.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.46 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 46.0 ttm -121.7 102.15 8.03 Favored 'General case' 0 C--N 1.285 -2.214 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 174.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -105.29 117.62 34.47 Favored 'General case' 0 C--N 1.292 -1.913 0 C-N-CA 119.23 -0.988 . . . . 0.0 109.473 -176.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.9 mttt 61.96 30.62 18.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.748 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.02 -2.55 69.14 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 115.139 -0.937 . . . . 0.0 113.488 177.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.403 ' O ' ' HA ' ' A' ' 26' ' ' MET . 34.4 tt0 -103.84 112.48 65.57 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 117.013 0.406 . . . . 0.0 111.091 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -79.64 116.09 3.47 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 122.52 2.147 . . . . 0.0 111.924 177.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 51.0 ttm -136.43 141.2 43.58 Favored 'General case' 0 N--CA 1.423 -1.82 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.9 m -82.79 122.56 28.36 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 176.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.469 ' HA ' ' O ' ' A' ' 88' ' ' GLY . 56.4 m-85 -112.2 160.78 17.26 Favored 'General case' 0 N--CA 1.423 -1.796 0 CA-C-O 121.852 0.834 . . . . 0.0 112.762 -176.059 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.602 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 37.7 mtt180 -119.54 148.31 43.45 Favored 'General case' 0 C--N 1.288 -2.086 0 CA-C-N 113.508 -1.678 . . . . 0.0 106.565 167.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.9 mp -77.49 135.96 38.3 Favored 'General case' 0 C--N 1.289 -2.057 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.982 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 22.9 mt -70.34 152.73 43.82 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.357 175.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.467 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 3.6 mt 68.28 19.86 8.9 Favored 'General case' 0 C--O 1.212 -0.919 0 C-N-CA 125.964 1.706 . . . . 0.0 110.98 177.116 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 66.0 t -110.04 125.12 67.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 CA-C-O 121.27 0.557 . . . . 0.0 109.671 -178.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.496 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 26.6 t70 -98.33 108.07 20.69 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 105.601 -2.0 . . . . 0.0 105.601 173.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.438 HG23 ' NH2' ' A' ' 35' ' ' ARG . 5.0 t . . . . . 0 C--N 1.288 -2.09 0 CA-C-N 114.697 -1.138 . . . . 0.0 111.698 -173.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.328 0 CA-C-O 119.229 -0.761 . . . . 0.0 114.545 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -55.49 -34.03 88.18 Favored 'Trans proline' 0 C--N 1.364 1.351 0 C-N-CA 123.051 2.501 . . . . 0.0 113.514 178.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -71.26 -48.43 51.02 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.071 0.462 . . . . 0.0 110.446 178.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.413 ' HA ' HD12 ' A' ' 108' ' ' LEU . . . -65.07 -40.12 94.23 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.519 -178.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.48 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 29.8 p -65.28 -43.92 89.67 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.721 -178.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.27 -37.16 86.49 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.089 0.471 . . . . 0.0 110.706 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -67.95 -47.55 68.33 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.878 179.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.556 ' O ' HG21 ' A' ' 66' ' ' VAL . 58.5 m -58.84 -41.65 87.45 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.09 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.48 ' HG3' ' O ' ' A' ' 59' ' ' SER . 48.2 mttp -54.24 -54.71 36.29 Favored 'General case' 0 C--N 1.35 0.615 0 O-C-N 123.233 0.333 . . . . 0.0 110.848 178.353 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -66.39 -32.01 73.13 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.335 -176.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 17.4 tpt -67.0 -51.08 59.44 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.972 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.556 HG21 ' O ' ' A' ' 62' ' ' THR . 29.6 m -83.51 -27.53 7.6 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -175.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -81.46 -20.29 40.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -85.18 -20.63 29.92 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.585 0.707 . . . . 0.0 110.619 178.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -77.97 160.47 28.17 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.034 178.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -84.6 -57.95 2.92 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -105.46 144.19 32.57 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.081 -174.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 4.0 mp -116.86 120.39 64.9 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.811 0 N-CA-C 105.987 -1.857 . . . . 0.0 105.987 174.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.459 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 22.5 mt-10 -112.81 133.28 54.88 Favored 'General case' 0 C--N 1.279 -2.466 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -175.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 30.2 m -110.87 122.75 65.93 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.321 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -118.26 140.36 49.93 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-O 121.326 0.584 . . . . 0.0 111.374 -176.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -104.76 126.28 51.68 Favored 'General case' 0 N--CA 1.421 -1.923 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.897 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -85.68 -173.47 4.65 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 178.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -71.78 -12.29 61.23 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.903 -0.498 . . . . 0.0 112.091 -175.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -79.79 -118.05 0.31 Allowed Glycine 0 CA--C 1.525 0.708 0 N-CA-C 114.557 0.583 . . . . 0.0 114.557 -178.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -124.36 153.34 41.98 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 -176.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -106.97 -15.63 14.65 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 121.832 0.825 . . . . 0.0 108.876 174.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 2.2 p . . . . . 0 C--N 1.299 -1.62 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.96 178.796 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 9.7 tpp180 . . . . . 0 N--CA 1.428 -1.574 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.469 ' O ' ' HA ' ' A' ' 34' ' ' PHE . . . -95.53 142.43 16.09 Favored Glycine 0 N--CA 1.432 -1.573 0 N-CA-C 109.18 -1.568 . . . . 0.0 109.18 175.446 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -134.38 135.15 42.45 Favored 'General case' 0 N--CA 1.419 -1.987 0 CA-C-N 117.9 0.85 . . . . 0.0 112.504 177.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -152.49 156.49 39.51 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -83.31 130.73 35.08 Favored 'General case' 0 N--CA 1.434 -1.259 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 178.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 60.5 mt -103.72 126.54 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.025 0 CA-C-O 121.563 0.697 . . . . 0.0 112.02 -175.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.459 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 79.1 m-85 -107.43 132.44 53.18 Favored 'General case' 0 N--CA 1.423 -1.805 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 172.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.27 99.36 8.97 Favored 'General case' 0 C--N 1.285 -2.237 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 177.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.3 t70 45.83 53.25 9.04 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 125.155 1.382 . . . . 0.0 111.355 -176.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 84.1 -5.02 81.65 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 115.617 -0.72 . . . . 0.0 114.641 179.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -96.89 141.07 30.52 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 117.927 0.863 . . . . 0.0 109.681 177.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 62.9 mtm -84.29 110.58 18.69 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-O 121.37 0.605 . . . . 0.0 110.901 179.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 54.9 t -65.94 -42.2 91.4 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 CA-C-N 114.525 -1.216 . . . . 0.0 111.49 -176.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -69.41 -30.41 68.36 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.057 0.456 . . . . 0.0 110.46 -178.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -62.12 -38.47 89.07 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 175.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -69.58 -36.72 76.52 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.237 178.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 89.2 mt -64.02 -44.16 93.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.35 177.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 66.3 t -69.74 -32.5 52.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 121.018 0.437 . . . . 0.0 110.27 178.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.93 -17.25 64.4 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.265 0.555 . . . . 0.0 111.008 179.455 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -108.86 -3.68 17.44 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 121.086 0.469 . . . . 0.0 110.033 176.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.522 ' HA3' ' O ' ' B' ' 150' ' ' LEU . . . 63.08 42.47 99.54 Favored Glycine 0 N--CA 1.437 -1.244 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.034 -177.191 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.413 HD12 ' HA ' ' A' ' 58' ' ' ALA . 75.8 mt -90.68 -20.57 22.34 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 121.006 0.432 . . . . 0.0 110.39 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -155.1 173.51 16.49 Favored 'General case' 0 N--CA 1.433 -1.275 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.523 -177.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.496 ' HB2' ' HB3' ' A' ' 40' ' ' ASP . 89.6 mttt -118.14 168.78 10.25 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 105.472 -2.048 . . . . 0.0 105.472 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 11.6 m -106.83 127.84 62.07 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 C-N-CA 117.378 -1.729 . . . . 0.0 111.937 178.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.467 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . . . . . . 0 C--N 1.306 -1.296 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 175.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 . . . . . 0 N--CA 1.449 -0.497 0 N-CA-C 110.689 -0.115 . . . . 0.0 110.689 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -67.45 -50.27 59.98 Favored 'General case' 0 CA--C 1.501 -0.904 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 -172.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . 0.495 ' O ' ' HG3' ' B' ' 140' ' ' LYS . 72.7 mt-30 -52.24 -45.33 65.3 Favored 'General case' 0 C--N 1.314 -0.939 0 O-C-N 124.07 0.856 . . . . 0.0 111.784 -175.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.9 mt -63.59 -50.3 69.98 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 120.828 0.346 . . . . 0.0 110.871 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.64 -38.9 87.84 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.688 -178.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 77.0 mtt-85 -75.24 -29.15 60.14 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -176.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' B' ' 136' ' ' GLN . 63.5 mttm -70.56 -34.42 72.2 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.546 174.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 47.4 m -67.13 -41.75 85.62 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.489 174.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.486 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 40.0 tt0 -57.47 -52.77 64.03 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.427 176.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -51.84 -49.38 62.96 Favored 'General case' 0 C--O 1.24 0.558 0 O-C-N 123.782 0.676 . . . . 0.0 111.525 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 144' ' ' GLN . . . . . 0.455 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 27.5 tt0 -61.93 -47.19 86.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.417 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -63.28 -36.77 84.79 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 123.536 0.734 . . . . 0.0 111.746 -177.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 146' ' ' LYS . . . . . 0.486 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 87.7 mttt -57.62 -48.81 78.41 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.344 0.593 . . . . 0.0 109.844 176.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -66.11 -32.33 73.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.858 -178.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 22.4 mm-40 -73.51 -20.58 60.63 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.456 178.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt 54.93 65.01 1.62 Allowed 'General case' 0 CA--C 1.506 -0.733 0 C-N-CA 124.501 1.12 . . . . 0.0 110.615 -172.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . 0.522 ' O ' ' HA3' ' A' ' 107' ' ' GLY . 95.7 mt -89.33 108.19 19.49 Favored 'General case' 0 C--N 1.301 -1.528 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.092 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 151' ' ' ASN . . . . . 0.409 ' HB3' ' O ' ' A' ' 107' ' ' GLY . 61.5 t30 48.45 -81.64 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 126.635 1.974 . . . . 0.0 114.525 175.371 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 12.6 tt -72.85 -25.15 21.83 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.499 0 CA-C-O 121.475 0.655 . . . . 0.0 109.833 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 153' ' ' TRP . . . . . 0.477 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 52.4 m95 -82.08 -4.74 57.51 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 121.783 0.802 . . . . 0.0 109.243 178.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 11.7 t -110.27 31.92 5.54 Favored 'General case' 0 N--CA 1.407 -2.606 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 175.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -69.67 -26.52 64.42 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 119.61 -0.836 . . . . 0.0 109.636 176.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 . . . . . 0 C--O 1.237 0.435 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 173.237 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 67.7 t60 . . . . . 0 N--CA 1.453 -0.302 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -106.83 153.56 22.3 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.158 0.504 . . . . 0.0 110.06 179.246 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -139.97 149.08 57.52 Favored Pre-proline 0 C--N 1.272 -2.785 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 172.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -74.3 144.16 32.61 Favored 'Trans proline' 0 C--O 1.247 0.973 0 C-N-CA 121.924 1.749 . . . . 0.0 111.505 -179.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -132.1 152.38 51.25 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.277 179.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.473 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 22.7 m -98.21 131.69 44.35 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 61.4 tp -76.27 124.21 27.13 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 120.943 0.402 . . . . 0.0 111.437 -178.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 70.0 mt -95.64 -60.21 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.224 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 176.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -154.81 160.2 41.1 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 123.756 0.822 . . . . 0.0 109.994 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.97 121.75 45.86 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 106.73 -1.582 . . . . 0.0 106.73 173.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.9 mp -92.95 -56.98 4.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.402 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.092 -175.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -141.57 -167.82 2.51 Favored 'General case' 0 C--N 1.311 -1.071 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 -177.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.514 ' HA2' ' OG1' ' A' ' 62' ' ' THR . . . -88.24 51.89 4.02 Favored Glycine 0 N--CA 1.44 -1.063 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 178.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.4 ' OD1' ' HD3' ' A' ' 35' ' ' ARG . 2.6 t70 179.06 -59.97 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.143 0 C-N-CA 125.813 1.645 . . . . 0.0 108.087 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.4 m -82.46 110.08 17.26 Favored 'General case' 0 N--CA 1.405 -2.706 0 CA-C-N 114.048 -1.433 . . . . 0.0 110.634 -175.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.1 t -125.15 152.82 31.98 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.2 tttp -111.19 117.67 33.86 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 118.793 0.724 . . . . 0.0 109.39 -175.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.468 ' HB2' ' CE1' ' A' ' 34' ' ' PHE . 3.3 mm? -123.62 153.94 40.02 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.614 0.721 . . . . 0.0 111.358 -175.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.534 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 49.1 ttm -112.29 109.1 18.56 Favored 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 174.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -115.96 116.19 27.49 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.165 -177.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.423 ' HA ' ' HE2' ' A' ' 28' ' ' LYS . 9.8 mmpt? 63.84 26.92 14.46 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.423 1.089 . . . . 0.0 109.577 -178.132 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.406 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 92.8 4.96 64.92 Favored Glycine 0 C--N 1.303 -1.263 0 CA-C-N 114.603 -1.18 . . . . 0.0 113.32 179.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.534 ' O ' ' HA ' ' A' ' 26' ' ' MET . 46.4 mt-30 -97.03 106.93 34.54 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.53 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 5.8 Cg_exo -80.42 102.49 1.42 Allowed 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 122.694 2.263 . . . . 0.0 110.354 177.424 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 89.6 mtp -133.98 150.64 51.27 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-O 121.371 0.605 . . . . 0.0 110.814 -177.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.6 m -86.47 126.74 34.63 Favored 'General case' 0 N--CA 1.415 -2.2 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 177.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.468 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 33.2 m-85 -97.15 157.95 15.68 Favored 'General case' 0 C--N 1.292 -1.903 0 C-N-CA 123.174 0.589 . . . . 0.0 111.853 -177.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.4 ' HD3' ' OD1' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -139.08 133.78 32.03 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 104.104 -2.554 . . . . 0.0 104.104 -179.187 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.6 mt -84.61 132.66 34.47 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.897 0.856 . . . . 0.0 112.265 -174.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.404 ' HB2' ' CE1' ' A' ' 91' ' ' TYR . 74.1 mt -73.31 138.34 45.37 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.115 177.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 38.8 mt 66.75 17.88 10.63 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.265 1.426 . . . . 0.0 112.964 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 59.5 t -110.64 136.92 45.16 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -126.15 106.67 9.73 Favored 'General case' 0 C--N 1.288 -2.103 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 174.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 19.6 m . . . . . 0 C--N 1.285 -2.22 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 177.975 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.365 0 CA-C-O 119.206 -0.775 . . . . 0.0 112.741 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -51.55 -29.49 32.3 Favored 'Trans proline' 0 C--N 1.363 1.315 0 C-N-CA 123.154 2.569 . . . . 0.0 113.082 177.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -72.77 -47.58 45.55 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 122.554 0.342 . . . . 0.0 110.283 178.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.33 -44.85 93.73 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.69 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.563 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 12.9 m -59.21 -46.87 87.31 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.111 178.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.11 -46.26 89.84 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -177.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -59.37 -40.86 87.86 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.742 -177.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.514 ' OG1' ' HA2' ' A' ' 20' ' ' GLY . 30.2 m -64.45 -47.15 80.15 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.217 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.563 ' HG3' ' O ' ' A' ' 59' ' ' SER . 55.2 mtpt -60.46 -44.03 96.31 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.379 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp -56.15 -54.04 49.85 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.625 177.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 53.0 ttm -66.07 -42.17 89.77 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.729 -175.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 35.1 m -71.65 -37.75 64.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.921 -0.712 . . . . 0.0 112.351 -178.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -75.36 -24.78 57.34 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -78.67 -21.63 47.99 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.508 0.671 . . . . 0.0 110.203 178.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.406 ' HB1' ' HB1' ' A' ' 94' ' ' ALA . . . -78.62 147.08 33.78 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.518 -178.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.25 -47.49 7.75 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.4 mtmp? -110.07 139.08 45.59 Favored 'General case' 0 CA--C 1.494 -1.211 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 3.8 mp -112.25 135.0 52.96 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.404 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 176.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.491 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 7.0 mm-40 -111.99 132.89 54.51 Favored 'General case' 0 N--CA 1.422 -1.826 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 -177.082 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.427 HG12 ' CD1' ' A' ' 92' ' ' ILE . 35.4 m -116.74 118.91 60.35 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 175.448 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.424 ' HA ' ' HA ' ' A' ' 9' ' ' LYS . 25.1 tt0 -116.25 136.45 53.0 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 121.395 0.617 . . . . 0.0 112.539 -173.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -108.48 140.22 42.12 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 125.222 1.409 . . . . 0.0 111.104 -176.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -122.89 -179.3 4.21 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -73.74 69.55 1.33 Allowed 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 124.766 1.226 . . . . 0.0 112.549 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -150.75 -164.03 11.7 Favored Glycine 0 C--N 1.28 -2.557 0 CA-C-N 113.297 -1.774 . . . . 0.0 109.573 174.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -89.81 142.47 27.66 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 176.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -101.51 -10.6 19.99 Favored 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.697 -176.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.3 p . . . . . 0 C--N 1.29 -2.005 0 O-C-N 122.114 -0.366 . . . . 0.0 110.157 178.122 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 . . . . . 0 N--CA 1.426 -1.633 0 CA-C-O 120.796 0.331 . . . . 0.0 110.47 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.66 115.01 3.97 Favored Glycine 0 N--CA 1.426 -1.987 0 N-CA-C 110.711 -0.956 . . . . 0.0 110.711 179.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 69.5 mt -86.41 101.55 13.23 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -157.19 167.81 29.26 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 -177.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.404 ' CE1' ' HB2' ' A' ' 37' ' ' LEU . 11.9 m-85 -90.21 127.51 36.14 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.352 175.425 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.427 ' CD1' HG12 ' A' ' 74' ' ' VAL . 51.0 mm -99.17 122.91 51.47 Favored 'Isoleucine or valine' 0 C--O 1.261 1.7 0 C-N-CA 120.193 -0.603 . . . . 0.0 109.508 177.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.491 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 14.1 m-85 -114.48 135.93 53.57 Favored 'General case' 0 N--CA 1.427 -1.623 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 174.6 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.406 ' HB1' ' HB1' ' A' ' 69' ' ' ALA . . . -105.45 109.17 21.05 Favored 'General case' 0 C--N 1.278 -2.529 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 -178.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 11.1 t70 46.95 40.45 9.28 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.614 1.566 . . . . 0.0 111.319 -177.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 96.03 -14.35 64.72 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.339 -0.846 . . . . 0.0 113.792 177.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.434 ' N ' ' HD2' ' A' ' 97' ' ' LYS . 8.4 mptt -92.29 140.84 29.2 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' MET . . . . . 0.413 ' HG3' ' CD1' ' A' ' 93' ' ' TYR . 1.9 mpt? -85.08 105.05 15.53 Favored 'General case' 0 C--N 1.297 -1.689 0 O-C-N 122.294 -0.254 . . . . 0.0 111.63 -176.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 30.0 t -66.59 -44.91 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-O 122.256 1.027 . . . . 0.0 108.456 -179.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.428 ' ND2' HD11 ' B' ' 138' ' ' LEU . 0.1 OUTLIER -56.45 -43.61 79.67 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 113.37 -1.741 . . . . 0.0 110.721 -179.259 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -66.83 -51.44 55.57 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.517 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.48 -45.24 76.98 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.111 -0.95 . . . . 0.0 112.066 -177.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.2 mt -54.65 -52.67 61.58 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 178.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 62.0 t -71.01 -37.83 69.43 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.737 -178.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 23.5 ttp85 -69.94 -21.49 63.26 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 -179.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -95.93 3.71 53.33 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.977 175.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.74 29.49 73.84 Favored Glycine 0 C--N 1.331 0.287 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.792 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.9 mt -95.08 -15.03 23.73 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.192 0.52 . . . . 0.0 110.198 -179.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -149.24 162.27 40.35 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -106.22 171.47 7.33 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 10.2 p -93.56 133.57 34.23 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 177.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.292 -1.932 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 174.537 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 5.5 p80 . . . . . 0 C--O 1.235 0.328 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -67.75 -48.34 66.68 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.212 -173.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -60.08 -33.56 72.25 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.069 -0.969 . . . . 0.0 112.937 -178.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 91.8 mt -59.54 -47.71 84.48 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.324 0.583 . . . . 0.0 109.538 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 138' ' ' LEU . . . . . 0.428 HD11 ' ND2' ' A' ' 100' ' ' ASN . 4.4 mm? -68.5 -40.61 80.81 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.404 178.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 -63.96 -36.46 84.05 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.486 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -68.63 -43.72 75.73 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.707 0.289 . . . . 0.0 110.718 175.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.0 m -61.41 -45.39 94.52 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.945 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.55 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 0.1 OUTLIER -68.78 -43.11 76.41 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.207 178.434 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -60.1 -44.36 94.9 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.803 0.335 . . . . 0.0 110.722 179.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 144' ' ' GLN . . . . . 0.464 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 35.5 tt0 -67.43 -47.85 69.01 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.774 -179.703 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.91 85.4 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -177.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 146' ' ' LYS . . . . . 0.55 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 84.6 mttt -62.25 -47.35 84.76 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.888 175.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -69.92 -31.36 69.09 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 123.447 0.467 . . . . 0.0 112.019 -175.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 11.8 mm-40 -79.95 -17.68 52.36 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.89 178.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . 0.597 ' O ' ' HB3' ' B' ' 154' ' ' SER . 13.0 mmmm 60.25 65.45 1.08 Allowed 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -174.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 97.6 mt -98.98 123.44 43.28 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 115.925 -0.579 . . . . 0.0 112.287 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 49.45 -88.51 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 126.324 1.85 . . . . 0.0 114.951 173.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 48.3 mt -66.29 -37.35 79.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.165 0.507 . . . . 0.0 110.226 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 62.7 m95 -77.25 -21.0 54.38 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.575 -175.095 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 154' ' ' SER . . . . . 0.597 ' HB3' ' O ' ' B' ' 149' ' ' LYS . 80.7 p -91.89 21.11 5.11 Favored 'General case' 0 N--CA 1.419 -1.989 0 CA-C-O 121.338 0.59 . . . . 0.0 111.049 -178.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -64.33 -31.97 73.38 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 170.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 27.0 t70 . . . . . 0 N--CA 1.42 -1.948 0 CA-C-N 113.076 -1.875 . . . . 0.0 107.832 -179.378 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.6 m80 . . . . . 0 CA--C 1.502 -0.867 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -96.6 145.45 25.73 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.68 175.332 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -139.28 149.72 61.76 Favored Pre-proline 0 C--N 1.287 -2.15 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -78.39 140.96 17.61 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 122.272 1.981 . . . . 0.0 113.172 -177.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.416 ' O ' ' HB ' ' A' ' 72' ' ' ILE . . . -132.24 154.83 49.24 Favored 'General case' 0 N--CA 1.424 -1.761 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.433 178.779 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.46 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 50.0 m -98.52 122.46 41.74 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.2 tp -66.56 118.84 10.73 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 176.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 39.0 mm -90.09 -56.9 4.69 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -165.0 153.93 12.47 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.406 ' HB2' ' HG2' ' A' ' 63' ' ' LYS . . . -111.25 123.11 49.54 Favored 'General case' 0 C--N 1.287 -2.15 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 176.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.3 mp -90.79 -64.32 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -175.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -130.65 -173.71 3.15 Favored 'General case' 0 C--N 1.31 -1.138 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 179.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.67 54.63 4.39 Favored Glycine 0 C--N 1.314 -0.654 0 N-CA-C 111.401 -0.68 . . . . 0.0 111.401 -178.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.54 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 4.2 p-10 -177.14 -36.51 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -178.115 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 p -111.33 112.06 23.55 Favored 'General case' 0 N--CA 1.422 -1.832 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.92 -178.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.8 m -131.63 143.19 41.14 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.645 0 CA-C-N 114.6 -1.182 . . . . 0.0 108.178 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -104.8 117.77 34.88 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 122.023 -0.423 . . . . 0.0 110.069 -176.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.2 mp -120.49 147.01 45.69 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.502 -179.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.632 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 44.1 ttm -108.15 108.96 20.25 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 175.128 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -115.38 130.7 56.97 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -178.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 32.4 pttt 41.77 35.74 0.54 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.849 1.26 . . . . 0.0 113.559 -174.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.44 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 95.32 -0.92 64.07 Favored Glycine 0 N--CA 1.442 -0.9 0 CA-C-N 114.929 -1.032 . . . . 0.0 114.668 177.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.632 ' O ' ' HA ' ' A' ' 26' ' ' MET . 1.8 mp0 -99.09 105.8 34.33 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 117.973 0.886 . . . . 0.0 111.458 178.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.44 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 1.7 Cg_endo -82.79 104.13 1.26 Allowed 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 122.261 1.974 . . . . 0.0 109.686 173.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 86.8 mtp -128.54 143.25 50.93 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 120.658 0.266 . . . . 0.0 110.562 -177.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.8 m -80.48 116.22 20.41 Favored 'General case' 0 N--CA 1.421 -1.92 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 174.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -98.19 154.62 17.64 Favored 'General case' 0 C--N 1.293 -1.891 0 C-N-CA 124.04 0.936 . . . . 0.0 111.551 -177.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.54 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -122.47 122.98 40.23 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 103.73 -2.693 . . . . 0.0 103.73 174.048 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.6 mp -61.77 126.0 25.81 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 123.389 0.431 . . . . 0.0 111.766 -177.184 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.7 mt -57.63 134.76 56.45 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.364 175.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.527 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 44.0 mt 70.04 16.77 7.5 Favored 'General case' 0 C--O 1.215 -0.714 0 C-N-CA 124.957 1.303 . . . . 0.0 113.002 179.354 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.49 HG21 HD21 ' A' ' 100' ' ' ASN . 55.6 t -119.49 127.5 75.86 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.755 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 177.557 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -137.15 129.52 29.78 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 123.432 0.457 . . . . 0.0 110.179 177.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.9 m . . . . . 0 N--CA 1.426 -1.657 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 174.283 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.297 0 CA-C-O 119.634 -0.537 . . . . 0.0 113.7 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -58.15 -22.57 57.12 Favored 'Trans proline' 0 C--N 1.361 1.203 0 C-N-CA 122.792 2.328 . . . . 0.0 113.154 177.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -82.69 -37.94 24.08 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.949 0.404 . . . . 0.0 109.914 178.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.63 -47.14 85.05 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.799 177.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.529 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 16.3 p -62.16 -44.7 96.04 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.367 179.454 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.59 -47.52 81.91 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 122.684 0.394 . . . . 0.0 111.499 -179.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -64.37 -40.64 96.23 Favored 'General case' 0 C--O 1.244 0.807 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.353 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 38.7 m -61.06 -45.14 95.98 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.9 178.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.538 ' O ' ' HG3' ' A' ' 67' ' ' GLU . 61.4 mtpt -59.83 -52.94 63.32 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.593 -178.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.468 ' N ' ' HE2' ' A' ' 64' ' ' LYS . 0.3 OUTLIER -62.14 -33.46 74.54 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 179.258 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 53.3 tpp -65.5 -44.53 86.75 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 120.713 0.292 . . . . 0.0 110.8 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.7 m -75.39 -25.03 17.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.972 179.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.538 ' HG3' ' O ' ' A' ' 63' ' ' LYS . 44.9 mt-10 -71.43 -31.57 67.37 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.915 0.388 . . . . 0.0 110.053 174.059 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -78.13 -9.67 59.27 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 123.858 0.863 . . . . 0.0 111.319 -177.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.03 128.36 36.26 Favored 'General case' 0 C--O 1.252 1.211 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.459 -178.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 49.1 mttp -68.16 -47.81 67.03 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 105.755 -1.942 . . . . 0.0 105.755 171.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.415 ' H ' ' HB3' ' A' ' 95' ' ' ASP . 4.2 mtpm? -132.96 133.51 43.28 Favored 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 105.25 -2.13 . . . . 0.0 105.25 -179.108 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.416 ' HB ' ' O ' ' A' ' 12' ' ' ALA . 3.8 mp -91.72 119.96 39.98 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.361 0 N-CA-C 105.803 -1.925 . . . . 0.0 105.803 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.54 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 5.5 mm-40 -112.53 133.5 54.56 Favored 'General case' 0 C--N 1.294 -1.817 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.067 -171.225 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.5 m -110.94 125.62 68.28 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 174.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -114.01 131.33 56.39 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -178.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.46 ' CE1' ' HB2' ' A' ' 81' ' ' ARG . 60.3 t80 -102.47 122.58 44.6 Favored 'General case' 0 N--CA 1.421 -1.878 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.382 178.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.462 ' CG ' ' H ' ' A' ' 78' ' ' LYS . 14.9 t70 -94.52 -173.51 3.06 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-N 114.925 -1.034 . . . . 0.0 108.442 178.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.462 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 82.1 mttt -81.58 17.03 1.52 Allowed 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 125.002 1.321 . . . . 0.0 111.184 -173.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -107.19 -121.91 4.79 Favored Glycine 0 N--CA 1.44 -1.083 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.377 -178.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -110.81 149.14 30.99 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 122.509 0.323 . . . . 0.0 110.638 -176.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.46 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . 43.2 ttp180 -110.23 -8.16 14.78 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.577 0.703 . . . . 0.0 109.172 177.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 2.1 p . . . . . 0 C--N 1.316 -0.856 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.515 -179.651 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . 0.43 ' CG ' ' HB2' ' A' ' 35' ' ' ARG . 9.8 tpp180 . . . . . 0 N--CA 1.426 -1.659 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.23 146.27 23.73 Favored Glycine 0 N--CA 1.439 -1.159 0 N-CA-C 109.821 -1.312 . . . . 0.0 109.821 177.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.403 ' O ' ' HA ' ' A' ' 81' ' ' ARG . 93.0 mt -126.64 119.91 28.2 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.05 161.65 40.39 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.43 ' CZ ' ' HB3' ' A' ' 100' ' ' ASN . 29.9 t80 -91.89 123.45 35.28 Favored 'General case' 0 N--CA 1.412 -2.369 0 N-CA-C 105.469 -2.049 . . . . 0.0 105.469 174.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 38.1 mm -99.44 130.84 47.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 CA-C-O 120.879 0.371 . . . . 0.0 110.736 -172.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.54 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 87.4 m-85 -122.09 147.59 45.93 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 174.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.13 98.95 8.59 Favored 'General case' 0 C--N 1.284 -2.241 0 N-CA-C 105.342 -2.095 . . . . 0.0 105.342 171.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.415 ' HB3' ' H ' ' A' ' 71' ' ' LYS . 4.2 p30 45.41 31.24 0.83 Allowed 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 125.045 1.338 . . . . 0.0 113.608 -175.502 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.49 -5.41 35.36 Favored Glycine 0 CA--C 1.524 0.633 0 CA-C-N 115.949 -0.568 . . . . 0.0 113.712 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -83.26 125.02 31.14 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 173.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 1.5 mpt? -67.4 102.85 1.17 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 117.868 0.303 . . . . 0.0 110.26 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 49.5 t -66.5 -38.69 82.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.49 HD21 HG21 ' A' ' 39' ' ' VAL . 6.7 t-20 -57.78 -51.68 68.59 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.438 176.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.506 ' O ' ' HG3' ' A' ' 105' ' ' ARG . 35.1 tt0 -69.96 -34.94 74.07 Favored 'General case' 0 C--O 1.204 -1.32 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.696 -174.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.49 -43.3 88.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.925 0.393 . . . . 0.0 110.293 177.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.7 mt -65.33 -42.81 92.53 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.757 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 100' ' ' ASN . 84.2 t -65.48 -41.48 91.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.346 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . 0.506 ' HG3' ' O ' ' A' ' 101' ' ' GLU . 17.1 mtm180 -70.29 -16.39 63.01 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.082 0.553 . . . . 0.0 111.701 -178.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -105.56 1.85 27.84 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.586 176.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 59.55 44.37 96.84 Favored Glycine 0 C--O 1.219 -0.795 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.525 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.3 mt -106.27 10.4 31.75 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -177.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -165.5 170.33 14.51 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 178.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.408 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 96.8 mttt -116.57 147.12 42.14 Favored 'General case' 0 CA--C 1.491 -1.296 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 175.021 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.527 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 99.1 t -73.79 133.85 30.81 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 C-N-CA 120.122 -0.631 . . . . 0.0 109.744 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.644 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 179.475 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 134' ' ' HIS . . . . . 0.5 ' O ' ' HG ' ' B' ' 138' ' ' LEU . 64.4 m-70 . . . . . 0 N--CA 1.479 0.977 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -37.44 -63.67 0.43 Allowed 'General case' 0 C--O 1.205 -1.253 0 C-N-CA 126.279 1.832 . . . . 0.0 113.907 -174.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -61.96 -33.55 74.49 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -170.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 88.0 mt -70.47 -47.25 61.48 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 122.052 0.929 . . . . 0.0 108.775 176.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 138' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' B' ' 134' ' ' HIS . 62.5 mt -67.79 -41.18 83.58 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 114.387 -1.279 . . . . 0.0 111.763 -176.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -75.44 -19.73 59.29 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.216 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 17.3 tppt? -72.6 -38.89 67.68 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 173.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 45.2 m -66.81 -35.45 80.09 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.404 174.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.569 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 24.6 tt0 -62.68 -54.08 44.81 Favored 'General case' 0 C--O 1.205 -1.24 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.245 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.56 -35.92 66.25 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 123.19 0.596 . . . . 0.0 111.226 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 144' ' ' GLN . . . . . 0.526 ' HA ' HE21 ' B' ' 144' ' ' GLN . 0.0 OUTLIER -70.97 -47.85 56.65 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.952 176.95 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -65.07 -35.41 81.07 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 122.45 0.3 . . . . 0.0 111.66 -178.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 146' ' ' LYS . . . . . 0.569 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 82.6 mttt -60.88 -46.18 91.63 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 177.009 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -62.53 -35.52 79.67 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.082 -177.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -88.86 -6.43 57.33 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-N 114.592 -1.185 . . . . 0.0 112.41 -174.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . 0.563 ' O ' ' HB2' ' B' ' 154' ' ' SER . 35.4 mmtp 53.61 54.35 10.13 Favored 'General case' 0 CA--C 1.512 -0.497 0 O-C-N 123.964 0.79 . . . . 0.0 110.927 -178.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 95.6 mt -82.92 114.76 21.43 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.783 -179.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 51.31 -93.28 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.475 1.51 . . . . 0.0 114.734 176.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 12.1 mt -64.38 -36.19 76.47 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.851 0 C-N-CA 122.605 0.362 . . . . 0.0 111.748 -179.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 153' ' ' TRP . . . . . 0.408 ' CH2' ' HG2' ' A' ' 110' ' ' LYS . 60.3 m95 -67.97 -23.14 65.01 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.043 0.449 . . . . 0.0 110.363 -179.284 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 154' ' ' SER . . . . . 0.563 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 10.1 t -85.79 42.98 1.0 Allowed 'General case' 0 N--CA 1.442 -0.871 0 CA-C-O 122.116 0.96 . . . . 0.0 108.792 179.227 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -74.22 -22.66 59.26 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 114.684 -1.143 . . . . 0.0 108.41 172.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 19.5 t70 . . . . . 0 N--CA 1.432 -1.355 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 175.305 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 23.0 m170 . . . . . 0 N--CA 1.44 -0.944 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.417 ' HA ' ' O ' ' A' ' 74' ' ' VAL . 36.6 ttmt -121.01 135.16 55.28 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 114.377 -1.283 . . . . 0.0 109.094 -179.122 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -138.95 157.35 71.71 Favored Pre-proline 0 C--N 1.296 -1.735 0 C-N-CA 122.504 0.322 . . . . 0.0 110.848 177.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -71.18 148.09 55.24 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 122.358 2.039 . . . . 0.0 112.75 -178.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.24 161.51 37.25 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.951 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.419 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 20.4 m -109.78 145.36 36.81 Favored 'General case' 0 C--N 1.293 -1.891 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 176.276 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.7 tp -83.95 134.98 34.64 Favored 'General case' 0 C--N 1.295 -1.769 0 C-N-CA 120.089 -0.645 . . . . 0.0 109.752 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 41.3 mm -91.79 -57.58 4.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 171.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -168.84 141.73 2.82 Favored 'General case' 0 N--CA 1.416 -2.171 0 CA-C-N 115.164 -0.925 . . . . 0.0 108.899 178.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -99.93 110.1 22.44 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 171.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.6 mp -89.54 -53.79 8.74 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-O 121.376 0.608 . . . . 0.0 110.034 -174.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -129.99 169.08 15.72 Favored 'General case' 0 C--N 1.291 -1.947 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -175.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.31 -29.48 73.27 Favored Glycine 0 C--N 1.306 -1.104 0 O-C-N 123.987 0.805 . . . . 0.0 111.775 178.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.552 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 2.3 m-20 -96.99 -46.99 5.98 Favored 'General case' 0 CA--C 1.492 -1.274 0 CA-C-O 120.952 0.406 . . . . 0.0 110.866 177.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.6 m -96.72 113.33 24.87 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-O 121.472 0.653 . . . . 0.0 111.84 -171.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.8 p -135.07 144.76 33.56 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.182 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.109 -177.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -106.98 123.01 47.57 Favored 'General case' 0 CA--C 1.49 -1.353 0 O-C-N 121.63 -0.669 . . . . 0.0 111.524 -179.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.9 mp -125.82 151.03 47.34 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.987 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.481 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 25.9 ttt -117.52 106.26 12.96 Favored 'General case' 0 C--N 1.289 -2.054 0 CA-C-N 114.911 -1.041 . . . . 0.0 108.871 -178.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -113.39 123.66 50.6 Favored 'General case' 0 C--N 1.287 -2.131 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 96.4 mttt 58.79 27.73 16.43 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 123.399 0.679 . . . . 0.0 111.803 177.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.432 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 93.82 6.6 61.99 Favored Glycine 0 N--CA 1.44 -1.062 0 C-N-CA 120.83 -0.7 . . . . 0.0 113.104 179.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.481 ' O ' ' HA ' ' A' ' 26' ' ' MET . 17.9 mm-40 -107.3 98.37 22.64 Favored Pre-proline 0 C--N 1.318 -0.775 0 CA-C-N 116.85 0.325 . . . . 0.0 110.562 178.581 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.432 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 6.0 Cg_exo -80.76 97.16 1.0 Allowed 'Trans proline' 0 C--O 1.243 0.742 0 C-N-CA 122.98 2.453 . . . . 0.0 110.565 174.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 49.8 ttm -112.87 145.62 40.37 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.387 -176.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 32.1 m -82.16 120.08 24.87 Favored 'General case' 0 N--CA 1.42 -1.957 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 174.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.448 ' HA ' ' O ' ' A' ' 88' ' ' GLY . 74.9 m-85 -114.38 154.2 28.51 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-O 121.399 0.619 . . . . 0.0 111.682 -177.069 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.552 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 37.8 mtp180 -118.23 148.09 42.75 Favored 'General case' 0 C--N 1.288 -2.109 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.058 164.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.414 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 5.2 mp -77.66 123.32 26.5 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.668 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 68.1 mt -63.94 142.04 58.55 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.432 176.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.63 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 67.3 mt 72.65 10.56 5.59 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.336 1.055 . . . . 0.0 112.503 177.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 97.5 t -113.49 140.85 31.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.223 0.535 . . . . 0.0 111.979 -176.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -135.1 107.52 7.31 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 172.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 82.3 p . . . . . 0 CA--C 1.571 1.772 0 N-CA-C 116.555 2.058 . . . . 0.0 116.555 179.29 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.423 0 CA-C-O 119.341 -0.7 . . . . 0.0 112.611 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -53.89 -34.98 78.33 Favored 'Trans proline' 0 C--N 1.368 1.601 0 C-N-CA 123.256 2.637 . . . . 0.0 113.764 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -66.4 -38.3 87.19 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.29 0.567 . . . . 0.0 109.628 -179.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.92 -48.44 63.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.871 177.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.453 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 19.1 m -57.71 -39.61 77.62 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.024 179.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.03 -34.88 78.51 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.142 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -69.63 -41.93 74.98 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 -177.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.461 ' O ' HG22 ' A' ' 66' ' ' VAL . 28.8 m -59.4 -47.99 83.33 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 175.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 59' ' ' SER . 60.8 mtpt -55.23 -51.89 65.14 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.682 178.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -64.22 -34.17 77.47 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -177.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 20.1 mmt -70.36 -47.93 58.7 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.659 177.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.461 HG22 ' O ' ' A' ' 62' ' ' THR . 33.9 m -75.18 -36.53 37.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -176.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -75.28 -23.94 57.49 Favored 'General case' 0 C--O 1.24 0.583 0 O-C-N 122.111 -0.368 . . . . 0.0 111.904 -179.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -78.98 -40.32 31.99 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.057 175.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -56.27 132.66 51.36 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 123.688 0.795 . . . . 0.0 112.329 -177.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -75.02 -50.33 16.87 Favored 'General case' 0 CA--C 1.501 -0.937 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 175.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -104.3 119.91 40.02 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.954 -178.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 69.4 mt -102.3 128.94 54.5 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.664 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 175.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.519 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 23.2 mt-10 -122.5 139.16 54.2 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 120.504 0.192 . . . . 0.0 110.758 -176.201 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.417 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 18.1 m -113.73 128.69 70.5 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 175.062 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -122.62 115.71 22.59 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.0 p90 -91.56 124.89 36.06 Favored 'General case' 0 N--CA 1.417 -2.12 0 CA-C-O 121.409 0.623 . . . . 0.0 111.323 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.452 ' CG ' ' H ' ' A' ' 78' ' ' LYS . 17.1 t70 -91.67 176.8 6.41 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.255 -176.025 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.452 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 18.0 pttm -82.14 -5.65 58.6 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 126.56 1.944 . . . . 0.0 112.109 -177.461 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -81.77 -138.45 2.63 Favored Glycine 0 C--O 1.246 0.87 0 C-N-CA 120.584 -0.817 . . . . 0.0 111.468 176.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -74.22 120.84 20.34 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 176.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -108.56 -8.18 15.56 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 121.82 0.819 . . . . 0.0 109.141 -176.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 10.0 p . . . . . 0 N--CA 1.438 -1.039 0 CA-C-N 114.986 -1.007 . . . . 0.0 110.331 179.317 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.1 mtm180 . . . . . 0 CA--C 1.484 -1.568 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . 0.448 ' O ' ' HA ' ' A' ' 34' ' ' PHE . . . -93.42 149.72 19.58 Favored Glycine 0 N--CA 1.42 -2.373 0 N-CA-C 109.29 -1.524 . . . . 0.0 109.29 176.182 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 89.3 mt -123.52 120.35 32.64 Favored 'General case' 0 C--N 1.287 -2.116 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 179.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -149.98 167.44 26.69 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 120.832 0.349 . . . . 0.0 110.489 -176.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.504 ' CZ ' ' HB2' ' A' ' 100' ' ' ASN . 5.4 t80 -94.25 133.02 38.22 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 105.618 -1.993 . . . . 0.0 105.618 174.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 44.4 mm -103.32 125.39 57.82 Favored 'Isoleucine or valine' 0 C--O 1.249 1.064 0 CA-C-O 120.919 0.39 . . . . 0.0 110.315 -175.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.519 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 61.8 m-85 -109.63 133.16 53.43 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 177.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.53 103.44 12.96 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -178.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.8 t70 46.98 40.46 9.38 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 125.69 1.596 . . . . 0.0 111.944 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.54 -25.0 24.38 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 115.034 -0.985 . . . . 0.0 113.584 177.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -97.09 160.46 14.33 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 117.081 0.44 . . . . 0.0 110.682 -176.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' MET . . . . . 0.478 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 3.8 mpp? -92.47 116.18 28.75 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -174.371 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 49.1 t -73.05 -46.8 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 120.817 0.342 . . . . 0.0 110.697 -178.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.504 ' HB2' ' CZ ' ' A' ' 91' ' ' TYR . 1.4 m-20 -54.43 -50.92 66.49 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.025 -0.988 . . . . 0.0 112.25 -173.474 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -75.22 -27.34 59.51 Favored 'General case' 0 N--CA 1.426 -1.646 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -179.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.87 -39.78 95.5 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.038 0.447 . . . . 0.0 110.131 176.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 82.8 mt -56.72 -45.91 81.63 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.5 175.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 46.7 t -73.14 -35.4 47.54 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.109 -178.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 13.2 mmm180 -55.92 -41.47 74.61 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.983 0.913 . . . . 0.0 111.862 176.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -87.17 1.42 53.1 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.041 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.503 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 70.22 37.33 71.66 Favored Glycine 0 C--O 1.222 -0.595 0 C-N-CA 121.536 -0.364 . . . . 0.0 112.631 179.087 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 83.6 mt -106.61 -8.85 16.78 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-O 121.01 0.433 . . . . 0.0 110.733 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -147.47 154.28 40.59 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.279 -178.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -105.3 166.23 10.56 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.406 HG13 ' OE2' ' B' ' 142' ' ' GLU . 7.3 p -86.99 122.61 39.12 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 CA-C-O 121.762 0.791 . . . . 0.0 110.914 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . 0.63 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . . . . . . 0 C--N 1.295 -1.787 0 N-CA-C 107.135 -1.431 . . . . 0.0 107.135 174.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 11.2 m-70 . . . . . 0 C--O 1.208 -1.114 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.448 ' OE2' ' HD2' ' B' ' 139' ' ' ARG . 2.3 tm-20 -57.61 -42.59 83.59 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.451 -1.25 . . . . 0.0 112.459 -172.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -69.81 -42.59 73.49 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-O 121.466 0.651 . . . . 0.0 109.449 -178.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 95.3 mt -60.95 -45.56 94.22 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.317 178.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -60.38 -47.41 86.17 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.743 176.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 139' ' ' ARG . . . . . 0.448 ' HD2' ' OE2' ' B' ' 135' ' ' GLU . 53.3 mtt180 -62.62 -41.08 98.8 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 178.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -64.48 -35.47 81.05 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.553 176.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 30.7 m -68.35 -41.9 80.04 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.228 177.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.464 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 38.5 tt0 -64.56 -50.66 66.42 Favored 'General case' 0 CA--C 1.495 -1.162 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.146 179.513 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . 0.509 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -56.64 -39.22 73.3 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.857 0.723 . . . . 0.0 110.896 -179.097 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 144' ' ' GLN . . . . . 0.469 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 35.4 tt0 -65.1 -47.67 76.39 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.689 178.239 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -63.62 -33.48 75.71 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.02 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 146' ' ' LYS . . . . . 0.516 ' HA ' ' CG ' ' B' ' 153' ' ' TRP . 79.8 mttt -62.4 -45.76 91.68 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.216 177.226 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 34.7 mmtp -66.71 -44.97 80.19 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.602 -178.418 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 22.5 mm-40 -75.43 -10.21 59.25 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.323 -176.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp 58.26 48.94 11.88 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.013 0.925 . . . . 0.0 110.588 -178.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 95.7 mt -86.02 115.39 23.59 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.277 -177.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 151' ' ' ASN . . . . . 0.503 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 40.3 m-80 53.67 -81.47 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 126.107 1.763 . . . . 0.0 113.019 178.248 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 152' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 107' ' ' GLY . 67.3 mt -56.85 -60.35 2.08 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.328 0 C-N-CA 124.183 0.993 . . . . 0.0 110.426 -178.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 153' ' ' TRP . . . . . 0.516 ' CG ' ' HA ' ' B' ' 146' ' ' LYS . 62.4 m95 -71.62 -7.83 50.26 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 114.291 -1.322 . . . . 0.0 113.414 -166.683 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 27.1 t -74.93 -0.67 19.42 Favored 'General case' 0 CA--C 1.567 1.633 0 CA-C-O 121.134 0.492 . . . . 0.0 109.808 174.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -64.39 -17.64 63.94 Favored 'General case' 0 C--O 1.25 1.1 0 C-N-CA 124.757 1.223 . . . . 0.0 111.023 173.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 N--CA 1.445 -0.689 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.146 -178.117 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . 0.538 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 46.3 m-70 . . . . . 0 C--O 1.212 -0.911 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -113.8 117.68 32.15 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 120.685 0.279 . . . . 0.0 111.239 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.41 ' CD ' ' HZ3' ' A' ' 28' ' ' LYS . 10.9 pt-20 -139.01 157.72 70.95 Favored Pre-proline 0 C--N 1.305 -1.344 0 CA-C-O 119.441 -0.314 . . . . 0.0 110.993 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -78.92 147.98 21.76 Favored 'Trans proline' 0 C--O 1.243 0.766 0 C-N-CA 121.998 1.799 . . . . 0.0 111.431 178.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -136.13 156.85 48.09 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 178.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.432 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 87.8 m -94.7 132.83 39.02 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.72 -178.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.433 ' HB2' HD12 ' A' ' 72' ' ' ILE . 60.7 tp -77.04 127.17 32.2 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 120.578 0.228 . . . . 0.0 111.026 -179.101 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 51.0 mm -98.79 -54.7 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 N-CA-C 107.375 -1.342 . . . . 0.0 107.375 172.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.448 ' HZ3' ' HB2' ' A' ' 16' ' ' LYS . 0.1 OUTLIER -170.67 157.15 5.56 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.065 179.46 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.04 120.61 42.94 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 174.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.448 ' HB ' ' O ' ' A' ' 22' ' ' THR . 67.0 mt -89.47 -64.12 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -175.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -129.14 -164.46 1.4 Allowed 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -177.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -88.64 48.33 3.53 Favored Glycine 0 CA--C 1.507 -0.452 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.468 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 1.9 t70 178.5 -61.91 0.01 OUTLIER 'General case' 0 CA--C 1.496 -1.123 0 C-N-CA 125.565 1.546 . . . . 0.0 108.534 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.448 ' O ' ' HB ' ' A' ' 18' ' ' ILE . 24.1 m -76.58 106.71 8.39 Favored 'General case' 0 N--CA 1.404 -2.752 0 CA-C-N 114.094 -1.412 . . . . 0.0 109.995 -174.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 24.6 m -131.63 164.54 34.24 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 -179.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -121.7 114.27 20.89 Favored 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 118.514 0.597 . . . . 0.0 109.812 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.443 ' HB2' ' CE1' ' A' ' 34' ' ' PHE . 7.4 mp -126.32 159.18 33.86 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-O 121.217 0.532 . . . . 0.0 111.517 177.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.432 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 57.5 ttp -114.77 117.08 29.77 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.523 179.252 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.5 p90 -122.91 131.65 53.83 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.41 ' HZ3' ' CD ' ' A' ' 10' ' ' GLU . 54.2 mttp 55.97 27.44 11.21 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.7 0.8 . . . . 0.0 112.514 -176.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 88.97 3.84 75.91 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 121.077 -0.582 . . . . 0.0 112.89 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.41 ' O ' ' HA ' ' A' ' 26' ' ' MET . 14.7 mm100 -106.29 104.96 52.52 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 116.842 0.321 . . . . 0.0 110.744 -179.058 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -78.98 107.37 2.23 Favored 'Trans proline' 0 C--O 1.247 0.962 0 C-N-CA 122.696 2.264 . . . . 0.0 110.264 175.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 65.5 mtt -127.32 154.13 45.32 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-O 121.137 0.494 . . . . 0.0 110.783 -177.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.9 m -81.2 136.62 35.87 Favored 'General case' 0 N--CA 1.42 -1.947 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 175.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.443 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 39.2 m-85 -105.05 149.05 26.13 Favored 'General case' 0 C--N 1.277 -2.568 0 CA-C-O 121.319 0.58 . . . . 0.0 112.257 -178.125 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.468 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 12.7 tpt85 -130.63 119.21 22.12 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 104.285 -2.487 . . . . 0.0 104.285 176.679 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 26.5 mt -83.98 137.76 33.46 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-O 122.142 0.972 . . . . 0.0 112.437 -169.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 98.5 mt -73.38 130.8 40.94 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 114.646 -1.161 . . . . 0.0 110.205 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.493 HD12 ' OH ' ' A' ' 91' ' ' TYR . 87.3 mt 73.78 7.41 4.95 Favored 'General case' 0 C--O 1.212 -0.869 0 C-N-CA 124.464 1.106 . . . . 0.0 113.438 176.106 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.7 t -125.01 125.66 69.9 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.716 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 175.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.46 ' HA ' HH12 ' A' ' 35' ' ' ARG . 11.0 t70 -105.58 140.68 38.29 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 179.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.446 HG22 ' HB3' ' A' ' 21' ' ' ASP . 1.0 OUTLIER . . . . . 0 N--CA 1.425 -1.693 0 O-C-N 124.254 0.971 . . . . 0.0 110.399 -171.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.853 0 CA-C-O 118.822 -0.988 . . . . 0.0 113.85 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -50.84 -50.56 13.42 Favored 'Trans proline' 0 C--N 1.37 1.676 0 C-N-CA 122.735 2.29 . . . . 0.0 112.684 176.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -63.07 -42.78 99.73 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.22 -45.59 90.93 Favored 'General case' 0 C--O 1.243 0.761 0 CA-C-O 121.066 0.46 . . . . 0.0 111.353 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.453 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 36.1 p -70.17 -41.91 73.17 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.365 -179.115 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.48 -42.1 92.59 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 122.199 0.2 . . . . 0.0 111.046 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -55.47 -43.9 75.97 Favored 'General case' 0 C--O 1.242 0.686 0 C-N-CA 122.715 0.406 . . . . 0.0 109.929 178.052 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.8 m -63.95 -46.3 85.31 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.033 177.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 59' ' ' SER . 49.7 mttp -57.39 -54.93 41.28 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.227 -179.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.98 -29.69 70.83 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -177.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.576 ' SD ' HG21 ' A' ' 99' ' ' VAL . 49.6 ttm -72.64 -46.12 55.59 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 119.621 -0.831 . . . . 0.0 111.194 179.367 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.8 m -73.39 -30.11 29.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 C-N-CA 120.338 -0.545 . . . . 0.0 112.172 -177.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -76.02 -23.55 55.18 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 120.549 0.214 . . . . 0.0 111.364 177.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -77.53 -31.84 53.61 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.492 0.663 . . . . 0.0 109.829 177.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.463 ' HB1' ' HB1' ' A' ' 94' ' ' ALA . . . -65.89 157.74 29.79 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 114.913 -1.04 . . . . 0.0 112.32 -178.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.53 ' N ' ' HD3' ' A' ' 70' ' ' LYS . 2.3 mppt? -110.42 -39.93 4.79 Favored 'General case' 0 C--N 1.291 -1.95 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 175.397 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.6 mtmt -120.75 121.81 39.02 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 114.748 -1.115 . . . . 0.0 108.506 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.433 HD12 ' HB2' ' A' ' 14' ' ' LEU . 61.0 mt -113.16 135.48 52.52 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.147 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 178.268 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.517 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 33.8 mm-40 -112.45 141.4 46.23 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -179.007 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.3 m -114.75 127.31 72.32 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.076 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 174.083 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.538 ' HA ' ' O ' ' A' ' 8' ' ' HIS . 40.2 tt0 -121.83 117.23 26.01 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.477 -179.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -95.84 143.41 27.08 Favored 'General case' 0 C--O 1.254 1.324 0 C-N-CA 123.781 0.832 . . . . 0.0 109.437 -177.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . 0.405 ' CG ' ' H ' ' A' ' 78' ' ' LYS . 8.2 t70 -87.98 -174.26 4.62 Favored 'General case' 0 C--O 1.253 1.255 0 CA-C-O 120.96 0.41 . . . . 0.0 111.117 -173.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.464 ' HE2' ' HA ' ' A' ' 78' ' ' LYS . 9.3 mmpt? -72.95 -21.06 60.93 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 124.087 0.955 . . . . 0.0 112.618 -170.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -99.22 -80.7 1.55 Allowed Glycine 0 C--N 1.314 -0.664 0 C-N-CA 119.303 -1.427 . . . . 0.0 114.882 -170.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -122.69 128.39 50.51 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 122.401 -0.47 . . . . 0.0 110.012 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.426 ' HD2' ' N ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -103.4 -4.67 23.81 Favored 'General case' 0 N--CA 1.427 -1.578 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.219 -173.185 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 21.9 p . . . . . 0 C--N 1.307 -1.257 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -179.188 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 . . . . . 0 N--CA 1.439 -1.004 0 CA-C-O 120.507 0.194 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -100.44 137.7 13.41 Favored Glycine 0 N--CA 1.434 -1.438 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 174.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 95.3 mt -100.98 107.05 18.42 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 -178.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -154.38 168.06 27.91 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.437 0.637 . . . . 0.0 112.542 -175.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.493 ' OH ' HD12 ' A' ' 38' ' ' LEU . 2.5 m-85 -94.59 134.95 36.61 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.396 -1.274 . . . . 0.0 108.571 170.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 47.8 mm -99.89 126.09 53.42 Favored 'Isoleucine or valine' 0 C--O 1.254 1.328 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 175.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.517 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 31.1 m-85 -120.48 131.75 54.88 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 174.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . 0.463 ' HB1' ' HB1' ' A' ' 69' ' ' ALA . . . -106.28 98.49 8.16 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 177.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.479 1.1 p30 31.95 57.32 0.34 Allowed 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 116.214 1.931 . . . . 0.0 116.214 -176.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 103.84 -21.95 36.83 Favored Glycine 0 N--CA 1.427 -1.925 0 CA-C-N 114.135 -1.393 . . . . 0.0 113.77 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -89.56 123.73 33.9 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -178.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' MET . . . . . 0.467 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 4.5 mpp? -84.32 101.6 12.06 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.255 178.225 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.576 HG21 ' SD ' ' A' ' 65' ' ' MET . 37.9 t -62.87 -46.06 97.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -54.86 -47.81 73.72 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 113.812 -1.54 . . . . 0.0 110.893 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -62.09 -50.64 71.13 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.734 0.814 . . . . 0.0 109.994 179.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.63 -41.14 85.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.582 -0.735 . . . . 0.0 112.192 -176.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 95.8 mt -58.4 -46.34 86.6 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-O 120.738 0.304 . . . . 0.0 111.814 178.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.8 t -73.29 -43.87 56.08 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-O 121.191 0.52 . . . . 0.0 109.99 178.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 21.8 tpt180 -60.95 -40.32 92.87 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.951 -176.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -84.0 -5.45 59.23 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.407 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 68.93 38.68 85.11 Favored Glycine 0 CA--C 1.503 -0.661 0 N-CA-C 111.575 -0.61 . . . . 0.0 111.575 -178.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.8 mt -94.27 -22.07 18.62 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -140.57 174.43 10.52 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 115.284 -0.871 . . . . 0.0 108.842 -177.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -111.54 166.08 11.45 Favored 'General case' 0 C--N 1.309 -1.166 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.467 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 73.6 t -83.89 127.07 40.12 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.237 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.076 177.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.496 -1.133 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -179.902 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 3.0 p80 . . . . . 0 C--O 1.247 0.93 0 CA-C-O 121.117 0.484 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . 0.412 ' HA ' ' CD1' ' A' ' 38' ' ' LEU . 36.3 tt0 -58.56 -44.48 89.72 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.37 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -61.47 -34.17 75.01 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.396 -176.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 82.9 mt -63.3 -50.97 68.0 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-O 121.126 0.488 . . . . 0.0 110.002 179.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 24.7 mt -69.92 -34.42 73.45 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 178.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 15.4 mtp85 -69.23 -31.49 70.09 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -77.26 -22.66 51.78 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.359 0.599 . . . . 0.0 111.138 174.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.1 m -76.4 -38.09 56.18 Favored 'General case' 0 N--CA 1.427 -1.605 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 173.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.548 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 36.4 tt0 -60.48 -42.98 97.37 Favored 'General case' 0 C--O 1.209 -1.069 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 173.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.96 -43.37 66.3 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 123.451 0.7 . . . . 0.0 111.452 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 144' ' ' GLN . . . . . 0.475 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 75.3 mt-30 -70.7 -48.36 55.07 Favored 'General case' 0 CA--C 1.497 -1.084 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.154 177.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -57.91 -38.85 76.61 Favored 'General case' 0 C--O 1.244 0.777 0 O-C-N 123.945 0.778 . . . . 0.0 112.038 -176.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 146' ' ' LYS . . . . . 0.548 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 89.4 mttt -57.62 -51.72 68.37 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 175.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -64.13 -45.15 89.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.109 -178.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 23.3 mm-40 -64.14 -14.08 52.51 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 124.093 0.957 . . . . 0.0 113.035 -178.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . 0.494 ' O ' ' HB2' ' B' ' 154' ' ' SER . 0.0 OUTLIER 62.39 40.95 10.57 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -178.932 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 90.5 mt -76.41 109.7 10.35 Favored 'General case' 0 C--N 1.315 -0.918 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.238 -175.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 151' ' ' ASN . . . . . 0.407 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 2.7 m-20 46.1 -88.3 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.415 1.886 . . . . 0.0 114.224 179.492 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 13.1 tt -68.19 -27.63 37.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 -176.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 153' ' ' TRP . . . . . 0.504 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 63.9 m95 -80.8 -7.25 59.36 Favored 'General case' 0 N--CA 1.435 -1.198 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.545 -178.143 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 154' ' ' SER . . . . . 0.494 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 22.5 t -81.6 13.38 3.14 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 120.985 0.421 . . . . 0.0 110.052 177.058 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -81.96 -20.81 37.8 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 172.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 156' ' ' ASP . . . . . 0.403 ' HB3' ' HE2' ' B' ' 149' ' ' LYS . 14.2 t70 . . . . . 0 N--CA 1.443 -0.82 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.27 -176.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 . . . . . 0 N--CA 1.428 -1.531 0 CA-C-O 120.435 0.159 . . . . 0.0 111.058 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.433 ' HA ' ' O ' ' A' ' 74' ' ' VAL . 43.1 mtmt -65.29 143.98 57.43 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 124.481 1.113 . . . . 0.0 112.562 -172.186 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -126.86 158.09 69.53 Favored Pre-proline 0 C--N 1.297 -1.71 0 N-CA-C 105.31 -2.107 . . . . 0.0 105.31 167.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -74.34 147.34 36.91 Favored 'Trans proline' 0 C--N 1.322 -0.817 0 C-N-CA 122.163 1.909 . . . . 0.0 112.096 -178.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.01 155.47 47.96 Favored 'General case' 0 N--CA 1.428 -1.566 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.414 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 37.5 m -103.19 123.07 46.02 Favored 'General case' 0 N--CA 1.415 -2.195 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.27 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 49.1 tp -69.29 124.76 24.69 Favored 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.4 mm -88.15 -52.33 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 N-CA-C 107.159 -1.422 . . . . 0.0 107.159 174.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -174.87 161.92 3.1 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 176.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -103.55 147.52 27.08 Favored 'General case' 0 C--N 1.285 -2.196 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 174.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.0 mp -107.25 -58.08 3.99 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 N-CA-C 107.359 -1.349 . . . . 0.0 107.359 176.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -140.91 173.58 11.34 Favored 'General case' 0 CA--C 1.484 -1.562 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.517 178.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -82.91 60.63 4.87 Favored Glycine 0 CA--C 1.5 -0.878 0 N-CA-C 108.449 -1.86 . . . . 0.0 108.449 174.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.413 ' HB2' ' HB ' ' A' ' 41' ' ' THR . 7.2 t70 -174.86 -56.98 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 124.691 1.196 . . . . 0.0 108.682 -172.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 34.8 m -119.04 127.78 53.74 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.966 178.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 15.9 m -135.52 167.57 24.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 C-N-CA 124.356 1.062 . . . . 0.0 109.796 -176.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -121.09 117.88 28.32 Favored 'General case' 0 C--N 1.316 -0.856 0 O-C-N 121.852 -0.53 . . . . 0.0 110.044 -177.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.0 mp -127.92 159.5 34.75 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.473 0.654 . . . . 0.0 111.667 -178.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.474 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 57.7 ttp -119.92 111.19 17.63 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 175.047 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.6 p90 -109.91 114.93 28.88 Favored 'General case' 0 C--N 1.293 -1.85 0 C-N-CA 118.709 -1.197 . . . . 0.0 109.962 -177.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt 63.28 28.44 15.73 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.736 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.445 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 94.82 2.78 62.67 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 114.868 -1.06 . . . . 0.0 113.072 -178.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.474 ' O ' ' HA ' ' A' ' 26' ' ' MET . 1.9 mp0 -99.72 101.97 15.47 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 117.022 0.411 . . . . 0.0 111.488 178.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.445 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 4.4 Cg_exo -78.09 113.7 3.46 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.351 2.034 . . . . 0.0 110.828 177.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 26.4 mmt -136.25 156.06 49.21 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.954 -178.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.0 m -95.04 112.21 23.94 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 176.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -95.85 145.07 25.65 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-O 121.526 0.679 . . . . 0.0 112.129 -174.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -123.07 117.75 26.14 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 105.464 -2.05 . . . . 0.0 105.464 176.607 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.7 mp -60.62 116.14 4.15 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 123.945 0.778 . . . . 0.0 112.219 -174.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 74.1 mt -70.19 140.35 52.51 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.571 175.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.5 mt 76.54 10.07 2.92 Favored 'General case' 0 C--O 1.217 -0.625 0 C-N-CA 125.534 1.534 . . . . 0.0 110.705 -175.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 53.8 t -126.02 138.21 55.29 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.135 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 176.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -148.13 106.58 3.77 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.413 ' HB ' ' HB2' ' A' ' 21' ' ' ASP . 3.3 m . . . . . 0 CA--C 1.598 2.821 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 175.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 2.266 0 CA-C-O 119.173 -0.793 . . . . 0.0 114.429 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -64.83 -25.85 60.16 Favored 'Trans proline' 0 C--N 1.373 1.82 0 CA-C-N 120.488 2.144 . . . . 0.0 112.379 178.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -80.06 -28.15 39.26 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.581 -177.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.19 -48.06 81.71 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 174.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.405 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 14.6 m -62.84 -34.54 77.56 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.21 177.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.4 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -64.46 -46.9 81.11 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.893 0.378 . . . . 0.0 110.056 177.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -60.82 -41.63 96.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.913 177.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.509 ' O ' HG23 ' A' ' 66' ' ' VAL . 54.2 m -58.38 -48.63 79.99 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.127 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.405 ' HG3' ' O ' ' A' ' 59' ' ' SER . 56.2 mtpt -56.37 -51.84 66.82 Favored 'General case' 0 CA--C 1.509 -0.61 0 O-C-N 123.601 0.563 . . . . 0.0 110.734 178.641 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 95.9 mttt -58.74 -39.76 81.84 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.213 -177.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 13.2 tpt -69.9 -47.73 61.37 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.663 -179.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 62' ' ' THR . 35.8 m -77.85 -34.68 19.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 -175.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -76.47 -19.49 57.97 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-O 121.027 0.442 . . . . 0.0 110.693 -179.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -89.93 -10.02 46.69 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.287 176.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -78.8 133.68 37.04 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 120.904 0.383 . . . . 0.0 111.767 -175.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -73.31 -34.13 65.55 Favored 'General case' 0 CA--C 1.502 -0.874 0 CA-C-O 121.439 0.637 . . . . 0.0 111.219 176.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -131.66 123.1 27.11 Favored 'General case' 0 C--N 1.292 -1.899 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 4.4 mp -101.71 121.54 52.79 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.314 0 N-CA-C 104.983 -2.228 . . . . 0.0 104.983 173.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.524 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 24.4 mt-10 -119.08 145.51 45.85 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-O 120.793 0.33 . . . . 0.0 110.904 -173.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.433 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 11.0 m -120.96 133.39 67.77 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.759 179.119 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -135.64 134.42 39.23 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.487 ' HB3' ' HG2' ' A' ' 81' ' ' ARG . 89.9 m-85 -95.28 148.03 22.85 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.469 -175.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -85.81 163.71 17.99 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 -179.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -73.1 -6.05 43.12 Favored 'General case' 0 C--O 1.246 0.887 0 C-N-CA 123.167 0.587 . . . . 0.0 111.955 -178.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -96.44 -99.28 1.89 Allowed Glycine 0 N--CA 1.433 -1.542 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 175.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 19.5 mp0 -93.52 134.93 35.27 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 121.041 0.448 . . . . 0.0 111.125 -176.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.487 ' HG2' ' HB3' ' A' ' 76' ' ' PHE . 55.8 mtt180 -111.67 -27.61 8.46 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.922 175.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 16.2 p . . . . . 0 CA--C 1.511 -0.528 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.568 -176.83 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 . . . . . 0 N--CA 1.442 -0.842 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -90.28 121.52 6.23 Favored Glycine 0 N--CA 1.422 -2.254 0 N-CA-C 108.172 -1.971 . . . . 0.0 108.172 173.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.4 mt -101.33 107.4 18.74 Favored 'General case' 0 C--N 1.289 -2.023 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 -177.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -153.92 167.33 30.09 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.463 -176.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -87.31 142.33 27.97 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 173.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 50.0 mm -108.31 123.32 63.83 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 178.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.524 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 17.4 m-85 -115.44 150.5 36.35 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 177.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -120.59 99.93 6.83 Favored 'General case' 0 C--N 1.291 -1.956 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 176.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.315 4.4 p-10 44.08 57.91 3.96 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 125.07 1.348 . . . . 0.0 113.638 -177.303 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.16 -23.34 27.45 Favored Glycine 0 N--CA 1.432 -1.601 0 CA-C-N 114.884 -1.053 . . . . 0.0 114.176 178.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -93.16 123.84 36.72 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -177.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' MET . . . . . 0.406 ' HB3' ' CE2' ' A' ' 93' ' ' TYR . 25.7 ptp -79.0 116.38 19.27 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-O 121.971 0.891 . . . . 0.0 111.125 -179.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 56.3 t -65.17 -31.37 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.599 -175.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 25.2 p-10 -65.11 -31.15 72.2 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.871 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -63.8 -51.47 64.62 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 173.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.46 -45.57 84.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.9 -177.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.2 mt -61.66 -41.15 97.13 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.747 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 96.7 t -70.66 -43.18 77.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.749 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 -67.29 -26.63 66.63 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 86.7 mm-40 -93.65 -4.23 51.04 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 120.829 0.347 . . . . 0.0 111.196 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.444 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 66.35 44.13 91.21 Favored Glycine 0 C--O 1.215 -1.082 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.741 -179.051 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 90.9 mt -113.16 7.85 18.05 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-O 121.511 0.672 . . . . 0.0 109.779 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -159.38 171.04 20.51 Favored 'General case' 0 N--CA 1.427 -1.588 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.56 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 95.3 mttt -120.97 161.47 21.55 Favored 'General case' 0 N--CA 1.424 -1.734 0 N-CA-C 104.921 -2.251 . . . . 0.0 104.921 177.045 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.6 p -76.56 150.73 6.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.701 0 C-N-CA 118.739 -1.184 . . . . 0.0 109.159 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.296 -1.737 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 175.43 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 6.9 p80 . . . . . 0 N--CA 1.448 -0.563 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -53.56 -50.47 65.47 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.873 175.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -48.77 -37.99 20.58 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.621 1.168 . . . . 0.0 112.977 -176.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 95.2 mt -70.41 -50.08 42.24 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.974 0.416 . . . . 0.0 110.599 -179.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 19.8 mt -69.58 -41.24 76.06 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-O 121.563 0.697 . . . . 0.0 111.361 -178.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 139' ' ' ARG . . . . . 0.457 ' O ' ' HB3' ' B' ' 142' ' ' GLU . 64.4 ttt180 -67.32 -31.91 72.51 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.431 -175.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -78.74 -24.43 44.82 Favored 'General case' 0 N--CA 1.432 -1.326 0 C-N-CA 119.654 -0.819 . . . . 0.0 111.116 176.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 51.0 m -69.03 -36.97 78.34 Favored 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 171.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 142' ' ' GLU . . . . . 0.619 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 28.1 tt0 -56.62 -49.25 75.53 Favored 'General case' 0 C--O 1.204 -1.324 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.358 174.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.81 -45.47 59.4 Favored 'General case' 0 C--O 1.255 1.379 0 CA-C-O 121.44 0.638 . . . . 0.0 111.512 -178.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 144' ' ' GLN . . . . . 0.486 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 29.0 tt0 -67.1 -47.78 70.16 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.586 178.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -60.06 -34.0 72.81 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 123.532 0.733 . . . . 0.0 112.17 -178.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 146' ' ' LYS . . . . . 0.619 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 60.2 mttm -55.15 -51.37 66.67 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 175.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -71.77 -27.42 62.95 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.252 -178.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 148' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 9.5 mm-40 -73.25 -16.19 61.4 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.931 176.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt 51.92 55.63 9.0 Favored 'General case' 0 CA--C 1.505 -0.754 0 C-N-CA 125.052 1.341 . . . . 0.0 110.838 -178.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 95.0 mt -86.37 114.06 22.85 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.211 -178.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 151' ' ' ASN . . . . . 0.444 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 44.3 m-80 48.23 -87.53 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.314 1.846 . . . . 0.0 114.257 177.4 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 10.7 tt -72.01 -24.89 23.1 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-O 120.932 0.396 . . . . 0.0 110.286 -175.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 153' ' ' TRP . . . . . 0.61 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 52.6 m95 -80.64 -10.43 59.73 Favored 'General case' 0 CA--C 1.506 -0.731 0 CA-C-O 121.771 0.796 . . . . 0.0 110.288 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 22.6 t -87.33 12.82 11.05 Favored 'General case' 0 N--CA 1.419 -1.993 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.001 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -66.62 -31.24 71.81 Favored 'General case' 0 C--N 1.356 0.871 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 172.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 20.9 t70 . . . . . 0 C--O 1.254 1.318 0 C-N-CA 125.007 1.323 . . . . 0.0 113.261 173.266 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.901 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 25.8 m 71.48 -58.67 0.57 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.297 1.039 . . . . 0.0 111.116 -178.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.3 t -88.81 157.99 18.29 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 15.2 m -79.78 -37.17 35.89 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 178.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -82.81 120.45 25.65 Favored 'General case' 0 N--CA 1.433 -1.291 0 CA-C-N 114.963 -1.017 . . . . 0.0 108.315 175.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -87.91 125.98 34.8 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 176.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 77' ' ' ASP . 96.0 mt -66.1 165.53 13.37 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 124.043 0.84 . . . . 0.0 112.972 -175.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -86.75 113.15 22.35 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-N 115.274 -0.876 . . . . 0.0 112.072 -172.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 37.0 ttmt -115.73 134.37 55.09 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 114.093 -1.412 . . . . 0.0 108.554 177.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -138.19 146.34 51.31 Favored Pre-proline 0 C--N 1.3 -1.558 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 176.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -69.22 150.59 71.67 Favored 'Trans proline' 0 C--O 1.246 0.891 0 C-N-CA 122.228 1.952 . . . . 0.0 112.388 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -141.45 165.04 28.61 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.142 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.521 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 8.4 m -100.23 133.81 44.08 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.4 tp -81.84 124.76 29.97 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 178.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 59.4 mt -95.78 -54.87 6.63 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 176.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -162.68 153.83 17.49 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.197 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.32 107.47 16.75 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 176.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.4 mt -81.04 -63.53 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.237 0 CA-C-O 121.59 0.71 . . . . 0.0 109.357 -173.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -112.77 -171.37 1.85 Allowed 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.186 -0.916 . . . . 0.0 109.856 -176.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -92.29 40.18 2.92 Favored Glycine 0 C--O 1.202 -1.884 0 N-CA-C 109.779 -1.328 . . . . 0.0 109.779 177.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.602 ' OD1' ' HG2' ' A' ' 35' ' ' ARG . 2.5 t0 -174.9 -57.46 0.01 OUTLIER 'General case' 0 CA--C 1.505 -0.761 0 N-CA-C 106.534 -1.654 . . . . 0.0 106.534 -174.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.3 111.37 18.92 Favored 'General case' 0 N--CA 1.425 -1.704 0 CA-C-N 113.826 -1.534 . . . . 0.0 109.103 -176.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 22.2 m -134.6 163.16 37.48 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.892 0 C-N-CA 123.499 0.72 . . . . 0.0 109.058 -176.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -116.26 116.26 27.44 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.619 -0.676 . . . . 0.0 110.107 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.8 mp -121.92 159.44 26.88 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 121.409 0.623 . . . . 0.0 111.001 178.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.521 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 26.9 ttt -120.08 105.93 11.48 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -178.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.424 ' CD1' ' HZ ' ' A' ' 34' ' ' PHE . 11.3 p90 -106.74 120.61 42.46 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -177.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 60.9 mttp 55.79 28.71 12.72 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.438 0.637 . . . . 0.0 111.916 -178.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 93.43 6.08 62.96 Favored Glycine 0 N--CA 1.434 -1.464 0 C-N-CA 120.513 -0.851 . . . . 0.0 113.197 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.435 ' O ' ' HA ' ' A' ' 26' ' ' MET . 84.0 mm-40 -105.62 104.01 46.29 Favored Pre-proline 0 C--N 1.311 -1.081 0 CA-C-N 117.122 0.461 . . . . 0.0 110.938 178.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -76.77 117.09 4.4 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.682 2.254 . . . . 0.0 110.703 176.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 25.8 mmt -137.42 147.58 45.5 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 90.3 m -85.59 116.73 24.05 Favored 'General case' 0 N--CA 1.425 -1.685 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 173.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.424 ' HZ ' ' CD1' ' A' ' 27' ' ' TYR . 90.5 m-85 -102.53 157.59 16.82 Favored 'General case' 0 C--N 1.291 -1.962 0 C-N-CA 123.686 0.794 . . . . 0.0 109.847 -177.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.602 ' HG2' ' OD1' ' A' ' 21' ' ' ASP . 11.9 ttt-85 -132.66 156.44 46.96 Favored 'General case' 0 C--N 1.286 -2.157 0 N-CA-C 104.127 -2.546 . . . . 0.0 104.127 172.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.463 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 84.1 mt -89.88 116.88 28.28 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -170.413 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 37.3 mt -55.71 135.82 51.21 Favored 'General case' 0 C--O 1.245 0.816 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.009 178.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 95.6 mt 72.24 13.14 5.73 Favored 'General case' 0 C--O 1.209 -1.031 0 O-C-N 124.872 1.357 . . . . 0.0 112.132 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 57.3 t -125.88 143.38 39.59 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.433 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -140.08 107.8 5.64 Favored 'General case' 0 C--O 1.249 1.052 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 175.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.431 HG23 ' O ' ' A' ' 108' ' ' LEU . 2.6 m -122.52 -60.36 0.03 OUTLIER Pre-proline 0 CA--C 1.571 1.785 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 -173.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.403 ' HD2' ' NH2' ' A' ' 35' ' ' ARG . 7.2 Cg_exo -68.57 -65.94 0.04 OUTLIER 'Trans proline' 0 C--N 1.378 2.097 0 C-N-CA 122.418 2.078 . . . . 0.0 113.826 -164.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -99.1 124.0 43.79 Favored 'General case' 0 N--CA 1.405 -2.678 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 176.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.2 m -78.53 157.7 28.75 Favored 'General case' 0 C--N 1.282 -2.355 0 CA-C-N 115.262 -0.881 . . . . 0.0 108.88 -176.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -55.62 -39.39 70.75 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 121.681 0.753 . . . . 0.0 109.098 176.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -170.63 104.2 0.42 Allowed Pre-proline 0 C--O 1.204 -1.33 0 N-CA-C 104.896 -2.261 . . . . 0.0 104.896 171.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -57.71 98.39 0.09 OUTLIER 'Trans proline' 0 C--O 1.239 0.57 0 C-N-CA 122.223 1.949 . . . . 0.0 112.274 -176.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.6 mtpp -83.11 -40.92 19.17 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.016 -175.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.414 ' HG2' ' OE2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -83.04 -12.5 57.12 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 120.21 -0.596 . . . . 0.0 109.564 176.404 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 87.55 -71.31 2.66 Favored Glycine 0 N--CA 1.443 -0.854 0 N-CA-C 108.8 -1.72 . . . . 0.0 108.8 -173.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.7 t -83.89 43.68 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.062 0 CA-C-O 123.311 1.529 . . . . 0.0 107.589 177.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.414 ' OE2' ' HG2' ' A' ' 49' ' ' LYS . 32.7 tt0 -91.46 -13.86 31.51 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 114.059 -1.428 . . . . 0.0 109.477 -175.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -89.32 -37.71 14.7 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 59.68 31.16 20.72 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-O 121.285 0.564 . . . . 0.0 112.075 -177.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -44.53 -54.76 6.36 Favored Glycine 0 CA--C 1.539 1.552 0 CA-C-N 114.185 -1.371 . . . . 0.0 116.328 -176.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo -49.06 -52.0 9.55 Favored 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 123.059 2.506 . . . . 0.0 113.774 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -70.45 -48.57 55.25 Favored 'General case' 0 C--O 1.206 -1.197 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.5 -48.1 72.28 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -177.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.512 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 46.0 p -69.08 -33.77 74.07 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-O 121.146 0.498 . . . . 0.0 111.876 -178.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.592 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -71.04 -38.62 72.56 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 175.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -61.51 -43.13 99.41 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 124.917 1.287 . . . . 0.0 111.509 -176.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.52 ' O ' HG23 ' A' ' 66' ' ' VAL . 5.0 p -64.28 -41.47 96.88 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.951 177.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.512 ' HG3' ' O ' ' A' ' 59' ' ' SER . 57.7 mttp -57.11 -39.12 74.47 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 123.541 0.526 . . . . 0.0 111.096 177.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.592 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 82.1 mttt -59.51 -54.27 48.52 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -179.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -67.35 -39.56 85.77 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -177.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 62' ' ' THR . 34.5 m -82.32 -39.02 15.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 113.634 0.975 . . . . 0.0 113.634 -176.22 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -75.55 -22.85 56.68 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -177.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -83.94 -9.44 58.69 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.766 0.793 . . . . 0.0 109.766 178.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.17 140.35 30.25 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.476 0.655 . . . . 0.0 112.436 -177.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -87.04 -38.52 16.48 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.042 -0.981 . . . . 0.0 108.977 175.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -119.11 119.78 35.21 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.522 -176.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 74.6 mt -118.23 121.37 67.04 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.452 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 22.8 mt-10 -115.9 137.95 51.63 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.199 -173.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.8 m -110.7 118.67 57.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 174.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.411 ' HA ' ' HA ' ' A' ' 9' ' ' LYS . 39.6 tt0 -111.71 133.76 53.73 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.458 ' CE1' ' HG3' ' A' ' 81' ' ' ARG . 60.8 m-85 -108.65 147.3 32.09 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -175.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.423 ' HA ' HD13 ' A' ' 7' ' ' LEU . 1.3 t70 -97.33 -174.54 2.96 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 120.939 0.4 . . . . 0.0 110.816 -176.437 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.0 mtpm? -76.82 -8.41 57.26 Favored 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 123.787 0.835 . . . . 0.0 110.79 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -69.13 -93.65 0.05 OUTLIER Glycine 0 C--N 1.335 0.508 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -145.97 158.74 43.86 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 176.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.458 ' HG3' ' CE1' ' A' ' 76' ' ' PHE . 37.0 ttm180 -88.52 -35.37 17.0 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 173.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 8.4 p -131.71 145.32 51.57 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.285 -0.87 . . . . 0.0 112.119 -175.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -109.07 157.63 18.53 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.258 177.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -56.7 -24.95 52.72 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -176.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -77.04 -1.38 28.66 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 121.458 -0.776 . . . . 0.0 111.099 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 83.34 24.2 51.95 Favored Glycine 0 CA--C 1.486 -1.737 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 177.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -116.89 141.15 48.6 Favored 'General case' 0 N--CA 1.412 -2.339 0 CA-C-N 114.531 -0.835 . . . . 0.0 109.383 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -87.9 157.47 28.49 Favored Glycine 0 N--CA 1.427 -1.966 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.412 -175.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 72.7 mt -122.39 108.55 13.34 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 -178.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.42 ' O ' ' HA ' ' A' ' 36' ' ' LEU . . . -150.66 167.61 26.82 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 119.992 -0.683 . . . . 0.0 112.543 -175.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -106.22 127.93 53.58 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 171.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 65.5 mt -103.14 126.7 57.42 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.978 0 C-N-CA 119.503 -0.879 . . . . 0.0 111.608 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.452 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 35.4 m-85 -112.45 133.94 54.26 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.278 178.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.34 105.83 16.04 Favored 'General case' 0 C--N 1.283 -2.306 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 174.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.2 p30 46.96 26.53 0.61 Allowed 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 125.201 1.4 . . . . 0.0 113.866 -172.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.46 -6.94 36.46 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.694 -0.765 . . . . 0.0 113.396 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -89.07 115.38 26.57 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 175.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 51.8 ttp -76.11 112.55 12.68 Favored 'General case' 0 C--N 1.294 -1.846 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 -178.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 57.5 t -62.41 -32.77 56.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.245 0.545 . . . . 0.0 110.138 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.463 ' ND2' ' HB3' ' A' ' 36' ' ' LEU . 1.3 m-20 -57.79 -37.95 74.63 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.073 178.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -66.3 -46.01 78.4 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.758 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.36 -39.77 88.38 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.662 -178.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 97.2 mt -62.19 -53.46 54.94 Favored 'General case' 0 C--O 1.244 0.795 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 19.3 m -69.54 -37.88 75.6 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 116.222 -0.444 . . . . 0.0 112.156 -177.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 53.2 ttp180 -68.26 -24.64 64.91 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 123.405 0.682 . . . . 0.0 111.16 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 50.7 tp60 -92.01 -5.74 52.43 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.547 0.689 . . . . 0.0 109.375 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.476 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 73.23 27.19 68.69 Favored Glycine 0 N--CA 1.441 -0.976 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.766 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.431 ' O ' HG23 ' A' ' 41' ' ' THR . 83.3 mt -97.63 -7.04 31.93 Favored 'General case' 0 CA--C 1.495 -1.138 0 O-C-N 122.864 -0.198 . . . . 0.0 111.186 -179.104 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -150.61 164.67 35.47 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 -177.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -112.66 156.92 21.91 Favored 'General case' 0 CA--C 1.488 -1.421 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 174.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.473 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 75.2 t -73.77 136.13 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.755 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 174.04 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -86.36 121.73 29.34 Favored 'General case' 0 N--CA 1.424 -1.766 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -177.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 18.6 t80 -73.7 102.33 3.93 Favored 'General case' 0 N--CA 1.417 -2.125 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.513 -171.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 48.1 t -87.39 127.01 41.07 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.702 0 N-CA-C 104.214 -2.513 . . . . 0.0 104.214 171.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.426 ' CD2' ' HA ' ' B' ' 126' ' ' TYR . 67.2 t80 -92.35 124.86 36.72 Favored 'General case' 0 C--N 1.274 -2.709 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -162.249 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -116.97 109.58 42.7 Favored Pre-proline 0 N--CA 1.428 -1.527 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 169.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -59.74 -58.75 0.52 Allowed 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.524 2.149 . . . . 0.0 111.024 -177.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . 0.518 ' HB3' ' OXT' ' A' ' 121' ' ' HIS . 25.5 t-20 -165.22 -61.15 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 105.691 -1.966 . . . . 0.0 105.691 176.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -137.6 -90.42 0.24 Allowed 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.015 173.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 26.9 m -88.96 -25.78 21.87 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . 0.518 ' OXT' ' HB3' ' A' ' 118' ' ' ASN . 20.8 t-80 . . . . . 0 N--CA 1.409 -2.499 0 N-CA-C 101.925 -3.361 . . . . 0.0 101.925 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.66 0 N-CA-C 111.34 -0.704 . . . . 0.0 111.34 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 23.8 m 66.85 -13.62 0.19 Allowed 'General case' 0 CA--C 1.554 1.104 0 N-CA-C 114.71 1.374 . . . . 0.0 114.71 175.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 47.7 t 65.31 27.1 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.216 0 CA-C-O 123.445 1.593 . . . . 0.0 108.67 -176.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -127.7 157.37 40.49 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 114.386 -1.279 . . . . 0.0 107.574 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . 0.426 ' HA ' ' CD2' ' A' ' 115' ' ' TYR . 79.3 t80 -151.04 130.66 13.06 Favored 'General case' 0 C--N 1.314 -0.968 0 C-N-CA 120.277 -0.569 . . . . 0.0 111.411 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 86.1 t -145.68 151.7 14.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 N-CA-C 103.978 -2.601 . . . . 0.0 103.978 175.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -102.32 -34.58 9.15 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 118.347 0.522 . . . . 0.0 111.241 -179.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.429 ' HA ' ' HD3' ' B' ' 130' ' ' PRO . 88.6 mttt -73.48 132.5 81.33 Favored Pre-proline 0 C--N 1.319 -0.757 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -175.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' B' ' 129' ' ' LYS . 1.1 Cg_endo -76.71 79.72 2.98 Favored 'Trans proline' 0 N--CA 1.436 -1.891 0 C-N-CA 122.301 2.001 . . . . 0.0 111.95 177.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -90.37 100.16 13.05 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 176.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -119.02 -20.4 8.1 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -178.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.6 118.15 5.76 Favored 'General case' 0 N--CA 1.382 -3.869 0 CA-C-N 114.636 -1.166 . . . . 0.0 108.569 176.234 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 65.8 m80 85.93 -14.2 0.55 Allowed 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 113.655 -1.612 . . . . 0.0 112.377 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -60.98 -41.75 97.05 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 118.889 0.768 . . . . 0.0 110.628 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -65.9 -33.6 76.21 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.319 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 95.0 mt -68.52 -49.73 57.41 Favored 'General case' 0 C--O 1.246 0.871 0 CA-C-O 121.657 0.741 . . . . 0.0 109.136 178.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -63.55 -44.56 93.81 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.288 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . 0.436 48.6 mtt180 -75.13 -18.39 60.24 Favored 'General case' 0 N--CA 1.436 -1.159 0 N-CA-C 117.62 2.452 . . . . 0.0 117.62 -175.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -72.68 -42.78 63.91 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 169.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 15.0 m -66.4 -37.12 84.51 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 114.651 -1.159 . . . . 0.0 110.275 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.575 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 39.0 tt0 -63.39 -51.17 66.92 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.694 175.143 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.61 -39.21 70.47 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.65 0.78 . . . . 0.0 111.65 -176.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -60.17 -47.54 85.53 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.432 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -74.45 -34.29 63.13 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.423 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 146' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 39.6 mtpt -59.82 -47.71 84.63 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-O 121.131 0.491 . . . . 0.0 110.208 179.402 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -67.98 -26.95 66.18 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.541 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -82.85 -8.54 59.57 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . 0.536 ' O ' ' HB2' ' B' ' 154' ' ' SER . 29.8 mmmt 58.35 42.72 21.07 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 36.3 mt -79.13 112.28 16.18 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.19 -176.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 151' ' ' ASN . . . . . 0.476 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 85.6 m-20 54.16 -92.85 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.084 1.354 . . . . 0.0 112.671 174.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 52.1 mt -67.69 -32.73 58.06 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.948 0 CA-C-O 121.206 0.527 . . . . 0.0 110.387 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 52.8 m95 -75.69 -5.43 45.56 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-O 121.765 0.793 . . . . 0.0 111.473 -177.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 154' ' ' SER . . . . . 0.536 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 23.2 t -93.72 12.66 24.81 Favored 'General case' 0 N--CA 1.423 -1.787 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.604 173.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -70.79 -24.3 62.55 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.615 0.722 . . . . 0.0 109.08 175.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 30.2 t70 . . . . . 0 N--CA 1.429 -1.488 0 CA-C-N 114.356 -1.293 . . . . 0.0 109.295 -178.351 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.303 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 56.2 m 70.96 109.02 0.06 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.084 0.953 . . . . 0.0 113.127 177.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 46.9 t -94.44 104.18 16.15 Favored 'General case' 0 N--CA 1.433 -1.282 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 175.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 33.3 p -81.65 91.53 6.44 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.945 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.403 ' HB3' ' NZ ' ' A' ' 5' ' ' LYS . 6.3 mtpm? -71.05 121.51 18.36 Favored 'General case' 0 N--CA 1.434 -1.272 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -67.34 -37.39 83.19 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 74.9 mt -82.32 103.94 12.26 Favored 'General case' 0 C--O 1.257 1.447 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 173.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 14.9 p-80 -74.87 141.67 44.18 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.549 -175.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 21.4 pttp -111.46 145.9 38.17 Favored 'General case' 0 C--N 1.291 -1.951 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 173.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -138.85 147.6 54.81 Favored Pre-proline 0 C--N 1.259 -3.34 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -74.96 149.76 37.39 Favored 'Trans proline' 0 C--O 1.244 0.804 0 C-N-CA 122.212 1.941 . . . . 0.0 113.193 -177.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -138.12 155.05 49.13 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.542 -0.753 . . . . 0.0 109.448 178.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.454 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 21.6 m -100.59 137.02 39.55 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 62.2 tp -83.36 132.97 34.97 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.979 -0.451 . . . . 0.0 111.594 -176.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 51.0 mm -95.92 -59.47 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.481 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 172.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.24 142.3 0.8 Allowed 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 -178.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -92.04 122.53 34.63 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 171.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.4 mt -90.15 -64.8 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -175.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -134.83 -178.82 5.25 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.643 -178.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.7 56.01 4.9 Favored Glycine 0 C--O 1.238 0.379 0 C-N-CA 121.732 -0.27 . . . . 0.0 112.95 -176.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.567 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 3.2 p-10 177.71 -34.06 0.01 OUTLIER 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 124.546 1.139 . . . . 0.0 108.259 179.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -110.12 109.89 20.58 Favored 'General case' 0 N--CA 1.419 -2.002 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.953 -177.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 7.3 p -129.33 139.2 52.39 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.881 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 178.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -106.0 119.48 39.31 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -175.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.445 ' O ' ' HA ' ' A' ' 31' ' ' PRO . 4.7 mp -127.24 156.28 42.13 Favored 'General case' 0 CA--C 1.496 -1.119 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.958 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.454 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 49.3 ttm -110.83 99.94 8.77 Favored 'General case' 0 C--N 1.29 -2.019 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 175.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -98.29 113.26 25.14 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.329 -0.949 . . . . 0.0 108.717 -177.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 96.8 mttt 56.71 31.62 19.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.878 0.847 . . . . 0.0 111.563 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 95.52 4.2 60.86 Favored Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 114.815 -1.084 . . . . 0.0 113.938 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.413 ' O ' ' HA ' ' A' ' 26' ' ' MET . 33.5 mm-40 -105.97 103.46 44.64 Favored Pre-proline 0 C--N 1.309 -1.173 0 CA-C-N 117.403 0.601 . . . . 0.0 111.163 175.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.445 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 1.9 Cg_endo -82.69 107.69 1.6 Allowed 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 122.798 2.332 . . . . 0.0 111.124 177.328 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 92.0 mtp -131.52 156.49 45.62 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-O 121.081 0.467 . . . . 0.0 111.463 -177.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.8 m -78.31 108.95 12.02 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 175.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -95.1 142.7 27.25 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-O 121.291 0.567 . . . . 0.0 111.572 -178.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.567 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 8.2 tpt180 -110.88 112.25 23.96 Favored 'General case' 0 N--CA 1.417 -2.105 0 N-CA-C 105.443 -2.058 . . . . 0.0 105.443 172.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.474 ' HB3' HD22 ' A' ' 100' ' ' ASN . 3.9 mp -62.93 122.08 15.11 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -177.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 78.9 mt -69.09 146.58 52.46 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.306 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 70.3 mt 75.47 4.27 4.02 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 124.935 1.294 . . . . 0.0 112.265 177.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 94.1 t -120.3 125.79 74.57 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.223 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.599 -178.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.459 ' HA ' ' NH2' ' A' ' 35' ' ' ARG . 31.9 t70 -121.89 134.9 54.87 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 173.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.548 ' OG1' ' HB3' ' A' ' 21' ' ' ASP . 1.7 m -73.21 152.48 90.35 Favored Pre-proline 0 C--N 1.307 -1.242 0 C-N-CA 123.741 0.816 . . . . 0.0 109.547 -177.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -44.94 123.72 5.23 Favored 'Trans proline' 0 C--N 1.379 2.164 0 C-N-CA 122.744 2.296 . . . . 0.0 110.093 172.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.54 136.41 56.73 Favored 'General case' 0 C--O 1.248 1.008 0 O-C-N 124.183 0.927 . . . . 0.0 113.279 -171.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.7 t -103.9 108.42 19.74 Favored 'General case' 0 N--CA 1.403 -2.825 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -65.52 -23.71 66.95 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 121.908 0.861 . . . . 0.0 110.472 -176.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -157.72 144.04 12.9 Favored Pre-proline 0 C--N 1.293 -1.865 0 N-CA-C 102.345 -3.206 . . . . 0.0 102.345 173.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_exo -40.72 136.91 1.83 Allowed 'Trans proline' 0 C--O 1.247 0.967 0 C-N-CA 123.416 2.744 . . . . 0.0 113.942 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.431 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 8.0 mmpt? 78.87 2.13 2.48 Favored 'General case' 0 C--N 1.351 0.653 0 C-N-CA 125.119 1.367 . . . . 0.0 112.901 178.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -99.24 -20.0 16.81 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 121.847 -0.533 . . . . 0.0 111.647 -179.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -77.34 -31.96 49.49 Favored Glycine 0 CA--C 1.499 -0.955 0 C-N-CA 120.05 -1.072 . . . . 0.0 110.658 178.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.478 ' HA ' ' HA3' ' A' ' 55' ' ' GLY . 14.6 p -71.14 -21.0 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.909 0 CA-C-N 114.777 -0.712 . . . . 0.0 109.472 177.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -69.89 -28.08 65.33 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.033 178.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -79.03 -68.81 0.62 Allowed 'General case' 0 N--CA 1.436 -1.175 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.773 -177.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -149.48 23.8 0.9 Allowed 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.045 0.45 . . . . 0.0 110.01 -174.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.478 ' HA3' ' HA ' ' A' ' 51' ' ' VAL . . . -58.93 -58.65 13.42 Favored Glycine 0 CA--C 1.524 0.598 0 CA-C-O 118.836 -0.98 . . . . 0.0 114.395 -176.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.432 ' HA ' ' OG ' ' A' ' 59' ' ' SER . 32.4 Cg_exo -64.12 -21.48 67.85 Favored 'Trans proline' 0 C--N 1.364 1.381 0 C-N-CA 122.842 2.362 . . . . 0.0 112.357 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -68.8 -47.38 66.25 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 177.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.88 -46.47 68.34 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.078 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.501 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 12.9 p -65.88 -45.16 83.07 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -177.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.38 -39.46 90.73 Favored 'General case' 0 CA--C 1.51 -0.58 0 C-N-CA 121.255 -0.178 . . . . 0.0 110.864 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -63.92 -45.19 90.38 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.496 ' O ' HG21 ' A' ' 66' ' ' VAL . 44.8 m -56.84 -49.86 74.17 Favored 'General case' 0 N--CA 1.445 -0.708 0 O-C-N 124.181 0.926 . . . . 0.0 109.425 177.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.501 ' HG3' ' O ' ' A' ' 59' ' ' SER . 59.7 mtpt -56.83 -54.59 44.66 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.821 179.482 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -57.48 -42.01 81.8 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.69 0.618 . . . . 0.0 111.89 -177.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.8 ttt -72.35 -44.87 61.99 Favored 'General case' 0 N--CA 1.441 -0.911 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.854 -177.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.496 HG21 ' O ' ' A' ' 62' ' ' THR . 33.2 m -74.88 -30.91 24.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -70.8 -31.56 68.36 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.338 0.589 . . . . 0.0 109.774 176.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -84.23 -13.44 52.64 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.384 -178.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.57 132.43 46.91 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.025 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -79.51 -38.27 34.75 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-O 122.004 0.906 . . . . 0.0 109.226 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 44.5 mtmt -133.18 150.44 52.0 Favored 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 106.02 -1.845 . . . . 0.0 106.02 178.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 53.3 mt -119.1 130.69 73.53 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.744 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 171.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.519 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 14.2 mm-40 -111.49 133.11 54.01 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 106.222 -1.77 . . . . 0.0 106.222 -178.364 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 m -112.64 122.81 67.54 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.916 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 174.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.427 ' HA ' ' HA ' ' A' ' 9' ' ' LYS . 33.7 tt0 -106.51 135.16 48.51 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 120.902 0.382 . . . . 0.0 110.526 -177.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -79.13 116.6 19.51 Favored 'General case' 0 N--CA 1.415 -2.215 0 CA-C-N 114.919 -1.037 . . . . 0.0 108.882 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.467 ' CG ' ' H ' ' A' ' 78' ' ' LYS . 25.9 t70 -96.8 -175.2 3.21 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 123.926 0.766 . . . . 0.0 109.924 -177.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.467 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 43.1 tptt -73.05 -9.4 58.69 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 124.443 1.097 . . . . 0.0 112.353 -173.009 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -81.05 -113.54 0.33 Allowed Glycine 0 C--N 1.314 -0.675 0 C-N-CA 120.337 -0.935 . . . . 0.0 110.927 174.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -130.21 175.01 9.27 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 176.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 40.4 ttt180 -96.15 -32.75 12.34 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 43.0 p -137.11 142.36 42.3 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.834 177.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -100.76 140.58 34.85 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.212 0.53 . . . . 0.0 110.58 176.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.7 pttp -44.36 -26.07 0.3 Allowed 'General case' 0 C--N 1.301 -1.508 0 C-N-CA 127.909 2.483 . . . . 0.0 115.773 176.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 69.4 t80 -79.71 -15.4 57.6 Favored 'General case' 0 C--O 1.237 0.445 0 O-C-N 121.34 -0.85 . . . . 0.0 110.274 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 105.13 45.81 1.32 Allowed Glycine 0 N--CA 1.439 -1.15 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 -178.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 27.8 mmt85 -129.04 144.26 51.13 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -89.19 141.58 16.34 Favored Glycine 0 C--N 1.291 -1.919 0 N-CA-C 109.105 -1.598 . . . . 0.0 109.105 175.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.6 mt -124.4 105.84 9.75 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -178.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.54 164.18 38.51 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-O 120.631 0.253 . . . . 0.0 110.434 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.407 ' CZ ' ' HB2' ' A' ' 100' ' ' ASN . 13.1 t80 -89.21 130.77 35.57 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 173.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 45.2 mm -99.99 123.94 53.13 Favored 'Isoleucine or valine' 0 C--O 1.251 1.14 0 CA-C-O 120.954 0.407 . . . . 0.0 111.623 -175.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.519 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 50.1 m-85 -113.94 145.65 41.21 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 173.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.19 100.4 9.99 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 175.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.338 4.2 p-10 43.83 42.5 4.51 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 125.46 1.504 . . . . 0.0 114.256 -176.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.25 -17.84 39.99 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-N 114.687 -1.142 . . . . 0.0 113.52 177.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.2 mtmt -97.97 132.29 43.66 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 120.937 0.398 . . . . 0.0 110.908 -177.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' MET . . . . . 0.431 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 1.9 mpt? -70.39 109.99 5.06 Favored 'General case' 0 C--N 1.305 -1.334 0 C-N-CA 123.999 0.92 . . . . 0.0 112.95 -173.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 58.7 t -73.41 -43.78 55.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 121.441 0.639 . . . . 0.0 109.941 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.474 HD22 ' HB3' ' A' ' 36' ' ' LEU . 14.3 m120 -60.65 -45.16 95.15 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.247 -176.467 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -61.91 -38.0 86.76 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.05 178.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.546 ' O ' ' HG2' ' A' ' 106' ' ' GLN . . . -65.33 -46.69 79.25 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.265 179.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 97.2 mt -53.57 -48.66 68.95 Favored 'General case' 0 C--O 1.244 0.777 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -179.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 12.7 m -70.81 -36.97 66.76 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.474 ' HB2' ' HB3' ' B' ' 141' ' ' SER . 29.2 ttp180 -72.26 -21.81 61.32 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.546 ' HG2' ' O ' ' A' ' 102' ' ' ALA . 82.0 mm-40 -87.54 -2.67 58.78 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.32 0.581 . . . . 0.0 109.508 176.326 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.417 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 69.75 28.7 71.76 Favored Glycine 0 N--CA 1.444 -0.833 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.993 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.4 mt -94.98 -13.98 24.79 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-O 121.189 0.518 . . . . 0.0 110.577 -177.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -151.22 167.41 27.9 Favored 'General case' 0 N--CA 1.428 -1.569 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.231 -176.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -112.57 153.11 28.04 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 175.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.477 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 11.7 p -76.9 125.55 36.8 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-O 121.516 0.674 . . . . 0.0 110.475 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.439 ' CB ' ' HB2' ' A' ' 40' ' ' ASP . . . -134.74 120.81 19.9 Favored 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.867 176.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.423 ' HB3' ' CD2' ' A' ' 38' ' ' LEU . 1.6 p90 -118.34 98.61 6.37 Favored 'General case' 0 C--N 1.292 -1.892 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.123 176.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 21.7 t -126.71 105.05 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.923 0 CA-C-O 121.902 0.858 . . . . 0.0 111.946 -176.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.451 ' O ' ' HD3' ' A' ' 117' ' ' PRO . 65.0 t80 -165.27 65.37 0.12 Allowed 'General case' 0 C--N 1.286 -2.157 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 166.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.427 ' HD2' ' HD2' ' A' ' 117' ' ' PRO . 46.1 tptt -89.19 113.26 55.59 Favored Pre-proline 0 N--CA 1.393 -3.294 0 CA-C-N 113.123 -1.853 . . . . 0.0 110.015 -175.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.451 ' HD3' ' O ' ' A' ' 115' ' ' TYR . 91.1 Cg_endo -88.53 20.36 1.15 Allowed 'Trans proline' 0 C--N 1.314 -1.239 0 C-N-CA 123.96 3.107 . . . . 0.0 110.664 178.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 49.8 t30 65.33 -85.49 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 126.19 1.796 . . . . 0.0 112.039 177.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -98.45 -2.55 38.72 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-O 121.226 0.536 . . . . 0.0 109.91 -177.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 21.5 m 76.16 -65.65 0.3 Allowed 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.347 1.059 . . . . 0.0 109.538 -178.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 49.5 t60 . . . . . 0 N--CA 1.425 -1.7 0 N-CA-C 106.884 -1.525 . . . . 0.0 106.884 175.109 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.58 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 15.1 m -108.05 -44.46 4.17 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.893 0.347 . . . . 0.0 110.189 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 61.7 t -72.13 -44.89 64.41 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 178.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -115.49 93.71 4.4 Favored 'General case' 0 N--CA 1.427 -1.598 0 CA-C-N 114.72 -1.127 . . . . 0.0 108.082 173.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -88.53 110.42 20.87 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 179.239 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 45.4 t -110.3 126.96 67.57 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.576 0 CA-C-O 121.266 0.555 . . . . 0.0 112.285 -172.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 128' ' ' TYR . . . . . 0.491 ' C ' ' HD3' ' B' ' 130' ' ' PRO . 56.2 m-85 -117.29 101.21 8.24 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.985 171.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -124.63 68.12 51.35 Favored Pre-proline 0 C--N 1.311 -1.093 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 172.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . 0.491 ' HD3' ' C ' ' B' ' 128' ' ' TYR . 6.0 Cg_endo -94.32 -74.9 0.0 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.117 0 C-N-CA 122.949 2.432 . . . . 0.0 110.964 178.364 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -88.73 47.63 1.53 Allowed 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 176.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.424 ' HA ' ' HB2' ' B' ' 135' ' ' GLU . 28.2 p-10 -83.0 4.2 26.98 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.36 -175.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.64 -33.52 66.41 Favored 'General case' 0 C--N 1.311 -1.089 0 C-N-CA 125.011 1.324 . . . . 0.0 113.281 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -127.32 21.74 6.63 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.994 0.426 . . . . 0.0 110.49 178.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.424 ' HB2' ' HA ' ' B' ' 132' ' ' ASN . 37.2 tt0 -54.82 -55.35 31.22 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.926 -1.033 . . . . 0.0 112.892 -175.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 56.9 mm-40 -56.74 -45.92 81.69 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.043 -171.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.0 mt -62.9 -51.1 68.25 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 123.78 0.675 . . . . 0.0 111.019 -176.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 7.6 mp -70.04 -32.95 71.33 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 139' ' ' ARG . . . . . 0.428 ' HG2' HG13 ' A' ' 111' ' ' VAL . 34.1 mtp180 -68.25 -34.26 75.89 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.378 176.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 19.4 mmmt -70.46 -32.04 69.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.875 0.369 . . . . 0.0 110.941 173.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 141' ' ' SER . . . . . 0.474 ' HB3' ' HB2' ' A' ' 105' ' ' ARG . 43.3 m -65.82 -41.96 91.2 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.807 177.106 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.553 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 48.0 mt-10 -63.65 -46.96 83.27 Favored 'General case' 0 C--O 1.198 -1.612 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.455 172.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . 0.537 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -51.04 -44.41 61.08 Favored 'General case' 0 CA--C 1.509 -0.617 0 O-C-N 123.899 0.749 . . . . 0.0 111.608 -176.178 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -61.31 -47.41 86.09 Favored 'General case' 0 N--CA 1.441 -0.876 0 O-C-N 123.864 0.728 . . . . 0.0 109.503 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.1 -40.79 91.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.055 -178.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 146' ' ' LYS . . . . . 0.553 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 56.0 mttm -54.55 -45.09 73.4 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.102 0.477 . . . . 0.0 110.52 177.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . 0.537 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 31.1 mmtp -79.9 -24.01 41.43 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.772 -174.161 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -87.23 -9.86 54.01 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.584 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . 0.562 ' O ' ' HB2' ' B' ' 154' ' ' SER . 27.4 mmmt 61.97 55.91 2.45 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.387 1.075 . . . . 0.0 108.428 -178.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 88.7 mt -95.06 123.25 38.44 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.038 -177.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 151' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 54.2 m-80 46.26 -97.11 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.766 1.626 . . . . 0.0 113.574 -179.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 152' ' ' ILE . . . . . 0.557 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 64.4 mt -60.98 -36.01 69.22 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.632 0 CA-C-O 121.767 0.794 . . . . 0.0 110.401 -178.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -80.61 1.0 31.63 Favored 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.6 -175.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 154' ' ' SER . . . . . 0.562 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 25.0 t -99.72 -6.73 26.59 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.49 177.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . 0.557 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 12.5 pt-20 -79.94 -19.67 47.46 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 119.939 -0.704 . . . . 0.0 109.24 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 18.4 t70 . . . . . 0 CA--C 1.487 -1.473 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -178.027 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.37 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.4 p -80.56 98.54 7.66 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 121.475 0.655 . . . . 0.0 112.121 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.4 m -75.06 -46.93 31.48 Favored 'General case' 0 N--CA 1.428 -1.562 0 N-CA-C 106.46 -1.681 . . . . 0.0 106.46 174.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.6 m -89.57 78.09 7.1 Favored 'General case' 0 N--CA 1.413 -2.288 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.154 178.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -80.42 -29.37 37.67 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 178.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -136.7 -73.37 0.44 Allowed 'General case' 0 N--CA 1.413 -2.289 0 CA-C-N 113.552 -1.658 . . . . 0.0 108.656 -175.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 87.2 mt -153.85 -173.5 4.6 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 124.643 1.177 . . . . 0.0 108.178 -177.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 28.9 t-80 -95.09 105.81 17.76 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -96.33 125.02 40.54 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 115.32 -0.854 . . . . 0.0 108.926 179.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -135.38 143.4 45.2 Favored Pre-proline 0 C--N 1.303 -1.454 0 CA-C-N 116.78 -0.191 . . . . 0.0 110.489 -179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -79.97 147.36 18.91 Favored 'Trans proline' 0 C--O 1.249 1.046 0 C-N-CA 122.472 2.115 . . . . 0.0 113.903 -176.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -129.86 171.26 12.91 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.208 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.405 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 28.1 m -117.13 145.6 43.7 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 107.081 -1.452 . . . . 0.0 107.081 178.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.1 tp -88.28 127.93 35.47 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 118.721 0.691 . . . . 0.0 110.381 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.6 mm -93.13 -51.47 11.2 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 176.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -169.48 134.12 1.41 Allowed 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.347 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -84.79 131.51 34.53 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 172.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.429 ' HB ' ' O ' ' A' ' 22' ' ' THR . 59.7 mt -105.89 -64.45 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 C-N-CA 120.544 -0.463 . . . . 0.0 111.016 -175.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.463 ' HB2' ' OG1' ' A' ' 22' ' ' THR . 36.9 m-20 -122.71 -152.71 0.52 Allowed 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.051 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -101.69 44.43 1.54 Allowed Glycine 0 CA--C 1.498 -0.971 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 -178.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.461 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 33.0 t0 -179.73 -56.12 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 -178.177 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.463 ' OG1' ' HB2' ' A' ' 19' ' ' ASP . 1.0 OUTLIER -76.4 106.34 7.98 Favored 'General case' 0 N--CA 1.411 -2.377 0 CA-C-N 114.627 -1.169 . . . . 0.0 110.059 -178.296 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.5 m -130.68 151.04 35.27 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.451 -178.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 45.7 tttp -108.49 114.48 28.35 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 -176.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.7 mp -121.5 159.69 25.77 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 121.382 0.611 . . . . 0.0 111.416 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.517 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 64.0 ttp -119.46 116.24 25.71 Favored 'General case' 0 C--N 1.294 -1.83 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 177.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.2 p90 -119.66 119.53 33.98 Favored 'General case' 0 C--N 1.286 -2.154 0 C-N-CA 119.368 -0.933 . . . . 0.0 109.272 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 98.0 mttt 60.85 27.52 17.33 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.266 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.43 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 94.31 3.67 63.11 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-N 115.232 -0.895 . . . . 0.0 113.034 -179.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.517 ' O ' ' HA ' ' A' ' 26' ' ' MET . 1.7 mp0 -100.47 102.39 18.59 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.95 0.375 . . . . 0.0 110.446 177.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.43 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 1.5 Cg_endo -83.34 101.96 1.01 Allowed 'Trans proline' 0 N--CA 1.443 -1.45 0 C-N-CA 122.31 2.007 . . . . 0.0 109.856 176.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 66.7 mtt -124.98 147.47 48.91 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.492 -176.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.53 ' O ' ' HD3' ' A' ' 87' ' ' ARG . 23.7 m -85.91 121.37 28.45 Favored 'General case' 0 N--CA 1.422 -1.839 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 177.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -99.57 161.58 13.53 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-O 122.256 1.026 . . . . 0.0 113.532 -174.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.461 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 9.0 tpt180 -134.51 131.02 37.52 Favored 'General case' 0 N--CA 1.412 -2.327 0 N-CA-C 105.037 -2.208 . . . . 0.0 105.037 173.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.1 mp -69.94 129.3 39.13 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 119.658 -0.817 . . . . 0.0 111.859 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 50.2 mt -57.42 126.07 25.67 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 115.047 -0.979 . . . . 0.0 112.629 177.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 40.2 mt 72.03 23.4 3.47 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-N 113.485 -1.688 . . . . 0.0 112.562 173.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 51.1 t -111.41 135.57 50.2 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.033 0 CA-C-O 121.113 0.482 . . . . 0.0 110.596 177.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.464 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 35.8 t70 -122.36 106.79 11.39 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 174.364 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.8 p -97.35 160.66 28.34 Favored Pre-proline 0 N--CA 1.421 -1.925 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.774 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -68.96 67.22 1.29 Allowed 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 122.639 2.226 . . . . 0.0 114.063 -178.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.416 ' C ' ' H ' ' A' ' 45' ' ' LYS . 33.7 mt-10 -77.95 170.76 16.05 Favored 'General case' 0 N--CA 1.436 -1.143 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 173.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 28.2 m 74.58 -42.57 0.5 Allowed 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 -173.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.416 ' H ' ' C ' ' A' ' 43' ' ' GLU . 34.4 mmtp -68.26 -35.62 78.18 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 170.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 73.9 m80 73.41 97.99 0.04 OUTLIER Pre-proline 0 C--O 1.251 1.152 0 CA-C-N 114.042 -1.436 . . . . 0.0 111.123 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.93 133.33 57.3 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 123.293 2.662 . . . . 0.0 111.27 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.4 mtpt 72.29 -42.34 0.53 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.826 1.25 . . . . 0.0 113.854 -178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -61.45 -37.71 84.56 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 123.256 0.622 . . . . 0.0 109.674 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -153.23 28.02 0.79 Allowed Glycine 0 N--CA 1.44 -1.081 0 C-N-CA 119.991 -1.1 . . . . 0.0 112.254 178.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 47.6 t -137.6 98.33 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -91.91 -29.45 16.67 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' A' ' 53' ' ' LYS . 11.2 mmpt? -69.01 -42.26 76.65 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 120.429 -0.508 . . . . 0.0 112.325 -174.258 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -124.16 -9.34 7.62 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 120.122 -0.631 . . . . 0.0 111.22 -176.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -69.04 -59.19 6.06 Favored Glycine 0 CA--C 1.524 0.616 0 CA-C-O 118.803 -0.998 . . . . 0.0 114.758 -173.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.47 -25.2 70.46 Favored 'Trans proline' 0 C--N 1.366 1.47 0 C-N-CA 122.409 2.073 . . . . 0.0 112.899 -178.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -70.3 -50.46 39.07 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 178.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.3 -43.06 98.91 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.296 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.7 p -64.91 -49.41 70.54 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.444 -178.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.33 -39.12 93.27 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 120.52 0.2 . . . . 0.0 110.853 -178.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -59.74 -52.73 64.21 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 123.435 0.694 . . . . 0.0 109.562 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 25.6 m -61.72 -47.15 86.56 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.313 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -58.36 -48.05 81.85 Favored 'General case' 0 CA--C 1.503 -0.839 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.191 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -60.7 -39.86 90.11 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.426 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 84.9 mtp -66.8 -47.71 71.22 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 120.141 -0.624 . . . . 0.0 111.633 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.9 m -75.09 -29.9 22.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -176.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -85.62 -29.52 24.01 Favored 'General case' 0 C--N 1.315 -0.933 0 O-C-N 121.83 -0.543 . . . . 0.0 112.182 -179.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -84.99 -11.71 54.87 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.296 0.57 . . . . 0.0 109.92 178.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.31 123.26 11.41 Favored 'General case' 0 C--O 1.244 0.791 0 C-N-CA 123.7 0.8 . . . . 0.0 112.069 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -74.54 -40.82 61.48 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 177.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -126.57 122.59 35.52 Favored 'General case' 0 N--CA 1.416 -2.169 0 CA-C-N 113.513 -1.676 . . . . 0.0 107.915 -179.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 63.5 mt -97.44 112.5 29.62 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.251 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 177.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.515 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 30.2 mt-10 -113.07 133.8 54.83 Favored 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 120.525 -0.47 . . . . 0.0 109.925 -175.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.0 m -110.93 127.01 68.33 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.693 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 171.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -115.33 128.85 56.37 Favored 'General case' 0 C--N 1.279 -2.495 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -175.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.448 ' CE1' ' HB2' ' A' ' 81' ' ' ARG . 32.2 t80 -97.41 131.86 43.67 Favored 'General case' 0 N--CA 1.414 -2.228 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.458 -175.149 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -85.66 -174.95 5.42 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -75.79 -14.95 60.32 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -175.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.458 ' HA3' ' OD1' ' B' ' 131' ' ' ASN . . . -97.93 -116.52 3.57 Favored Glycine 0 C--N 1.313 -0.742 0 C-N-CA 120.19 -1.005 . . . . 0.0 115.586 -172.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -96.07 141.22 29.72 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -175.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.448 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . 19.3 ttm180 -96.82 -22.4 16.95 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 124.145 0.903 . . . . 0.0 108.859 176.668 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.4 p -142.22 143.43 32.9 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.985 -177.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -93.96 148.22 22.36 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 172.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -58.8 -16.77 18.58 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 -177.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -68.93 -20.09 64.21 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.311 0.577 . . . . 0.0 109.732 175.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 103.03 24.76 7.84 Favored Glycine 0 C--O 1.219 -0.828 0 N-CA-C 110.594 -1.002 . . . . 0.0 110.594 -178.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.53 ' HD3' ' O ' ' A' ' 33' ' ' THR . 10.8 tpp85 -110.52 126.93 54.91 Favored 'General case' 0 C--N 1.299 -1.587 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -176.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -76.62 141.17 26.18 Favored Glycine 0 N--CA 1.441 -0.967 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 88.2 mt -122.95 102.04 7.78 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -178.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -153.13 167.75 28.24 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 -178.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -88.28 141.99 28.11 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 174.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 46.5 mm -111.62 123.42 67.42 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.515 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 13.4 m-85 -118.91 139.0 52.37 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 176.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.63 98.85 8.49 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 174.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.276 4.3 p-10 42.91 43.34 3.48 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.749 1.22 . . . . 0.0 113.714 -175.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.3 -19.48 37.08 Favored Glycine 0 N--CA 1.443 -0.878 0 C-N-CA 120.858 -0.686 . . . . 0.0 113.412 178.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.3 mttp -82.85 113.15 20.28 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 179.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' MET . . . . . 0.461 ' CE ' ' HB2' ' A' ' 101' ' ' GLU . 44.7 ttp -77.48 106.85 9.52 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 45.4 t -59.73 -44.32 93.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.424 -173.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -65.62 -30.05 70.72 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.461 ' HB2' ' CE ' ' A' ' 98' ' ' MET . 7.9 tp10 -62.24 -53.82 49.76 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 173.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.76 -44.5 96.65 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.047 -0.979 . . . . 0.0 112.061 -177.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 90.3 mt -56.64 -51.7 67.7 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.1 t -73.17 -38.02 53.81 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.204 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.586 -177.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.428 ' HB2' ' O ' ' A' ' 101' ' ' GLU . 3.9 tpt180 -69.46 -25.95 64.34 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.164 0.586 . . . . 0.0 111.415 -176.287 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.2 tp60 -95.67 -1.84 49.29 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.265 0.555 . . . . 0.0 109.565 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.426 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 73.23 39.71 51.63 Favored Glycine 0 N--CA 1.442 -0.953 0 CA-C-N 115.316 -0.856 . . . . 0.0 113.597 177.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 78.8 mt -104.24 -10.09 18.14 Favored 'General case' 0 C--N 1.296 -1.756 0 O-C-N 122.431 -0.452 . . . . 0.0 110.337 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -153.17 168.21 26.72 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.824 -177.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.557 ' HG3' ' CZ3' ' B' ' 153' ' ' TRP . 0.9 OUTLIER -99.87 168.07 10.12 Favored 'General case' 0 CA--C 1.492 -1.268 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 176.024 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 12.7 p -93.08 138.12 20.89 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.475 0 N-CA-C 106.576 -1.638 . . . . 0.0 106.576 173.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.9 122.48 32.32 Favored 'General case' 0 C--N 1.282 -2.353 0 N-CA-C 104.458 -2.423 . . . . 0.0 104.458 174.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -70.24 145.02 51.65 Favored 'General case' 0 N--CA 1.419 -2.017 0 CA-C-O 121.686 0.755 . . . . 0.0 111.474 -170.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 23.5 t -86.96 137.16 21.42 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.902 0 CA-C-N 114.277 -1.329 . . . . 0.0 109.052 -172.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -73.52 -47.81 38.08 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 114.649 -1.16 . . . . 0.0 111.794 -172.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? 69.97 146.09 0.11 Allowed Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 123.713 0.805 . . . . 0.0 110.526 -172.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_endo -46.02 -36.94 16.8 Favored 'Trans proline' 0 N--CA 1.493 1.457 0 C-N-CA 124.376 3.384 . . . . 0.0 115.937 -170.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 20.9 p-10 -133.7 32.58 3.56 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 120.775 0.321 . . . . 0.0 111.442 -177.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 16.2 m120 68.51 21.49 8.1 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 175.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 25.0 m -75.84 98.41 4.17 Favored 'General case' 0 C--N 1.304 -1.372 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.261 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 6.5 p80 . . . . . 0 C--N 1.309 -1.195 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.196 175.249 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.338 0 N-CA-C 110.363 -1.095 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 7.3 p -77.41 79.47 3.92 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-O 121.575 0.702 . . . . 0.0 112.766 -177.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 46.3 t -119.07 87.58 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 176.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -120.11 126.63 51.21 Favored 'General case' 0 N--CA 1.427 -1.625 0 CA-C-N 115.127 -0.942 . . . . 0.0 108.995 -177.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 6.1 p90 -162.58 -179.38 6.86 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 178.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 127' ' ' VAL . . . . . 0.545 ' C ' ' H ' ' B' ' 129' ' ' LYS . 59.2 t -67.02 122.18 17.55 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 177.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -82.02 36.01 0.44 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 122.557 1.17 . . . . 0.0 110.776 -173.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.545 ' H ' ' C ' ' B' ' 127' ' ' VAL . 64.4 mttm 71.4 130.38 0.04 OUTLIER Pre-proline 0 C--N 1.291 -1.972 0 C-N-CA 128.128 2.571 . . . . 0.0 115.307 179.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -76.84 -151.91 0.04 OUTLIER 'Trans proline' 0 CA--C 1.558 1.681 0 C-N-CA 123.506 2.804 . . . . 0.0 109.583 167.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 131' ' ' ASN . . . . . 0.458 ' OD1' ' HA3' ' A' ' 79' ' ' GLY . 1.4 m120 -85.44 98.46 10.6 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -175.22 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -142.73 10.24 1.8 Allowed 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -172.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 75.0 m -69.17 -46.2 68.1 Favored 'General case' 0 N--CA 1.427 -1.58 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -174.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -99.01 23.9 8.43 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.487 -0.758 . . . . 0.0 111.277 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -51.07 -65.72 0.51 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.789 1.236 . . . . 0.0 109.523 -178.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . 0.556 ' O ' ' HG3' ' B' ' 140' ' ' LYS . 14.6 mm100 -60.86 -47.55 85.88 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.038 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 84.4 mt -58.65 -49.4 77.65 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -175.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 28.6 mt -70.03 -26.61 64.13 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 178.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -71.48 -25.39 62.26 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 119.831 -0.747 . . . . 0.0 110.532 173.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . 0.556 ' HG3' ' O ' ' B' ' 136' ' ' GLN . 29.5 mtpp -72.89 -38.07 67.09 Favored 'General case' 0 C--O 1.243 0.745 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 175.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 15.7 m -60.88 -45.53 94.19 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.322 -0.854 . . . . 0.0 108.805 175.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.468 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 5.0 tt0 -57.9 -58.54 7.92 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.828 176.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -51.58 -50.73 59.57 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.614 0.766 . . . . 0.0 112.537 -176.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 144' ' ' GLN . . . . . 0.427 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 50.5 tt0 -61.37 -47.11 87.35 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.945 -178.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -71.69 -33.04 68.47 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.713 -176.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 146' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 77.3 mttt -64.0 -43.33 96.0 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 175.031 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -60.11 -38.46 83.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.146 178.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 13.3 mm-40 -81.58 -17.93 46.61 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.592 -179.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . 0.468 ' HZ3' ' CG ' ' B' ' 156' ' ' ASP . 31.2 mtpt 54.48 60.99 3.21 Favored 'General case' 0 C--O 1.244 0.78 0 C-N-CA 124.987 1.315 . . . . 0.0 109.342 -174.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 53.4 mt -82.78 116.86 22.31 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 113.591 -1.64 . . . . 0.0 110.841 -176.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 151' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 93.6 m-20 47.44 -89.97 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 125.371 1.469 . . . . 0.0 114.616 174.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 152' ' ' ILE . . . . . 0.405 HG12 ' HE3' ' A' ' 110' ' ' LYS . 6.8 tt -70.46 -27.24 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -175.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 153' ' ' TRP . . . . . 0.557 ' CZ3' ' HG3' ' A' ' 110' ' ' LYS . 56.2 m95 -74.18 -18.41 60.77 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-O 121.646 0.736 . . . . 0.0 110.612 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 8.4 t -87.19 61.66 6.84 Favored 'General case' 0 N--CA 1.426 -1.646 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 176.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -97.3 -4.64 38.33 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 114.795 -1.093 . . . . 0.0 111.688 -179.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 156' ' ' ASP . . . . . 0.468 ' CG ' ' HZ3' ' B' ' 149' ' ' LYS . 6.3 p-10 . . . . . 0 C--N 1.295 -1.774 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.243 0 N-CA-C 111.431 0.16 . . . . 0.0 111.431 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 18.3 m -75.71 -4.38 40.03 Favored 'General case' 0 CA--C 1.558 1.278 0 CA-C-O 121.623 0.725 . . . . 0.0 111.644 -178.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.3 m -77.77 -13.81 59.78 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 172.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.7 p 49.01 87.18 0.02 OUTLIER 'General case' 0 C--N 1.352 0.684 0 C-N-CA 125.422 1.489 . . . . 0.0 113.359 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -89.57 59.07 4.59 Favored 'General case' 0 N--CA 1.422 -1.862 0 CA-C-O 123.565 1.65 . . . . 0.0 110.915 -178.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -159.95 119.16 2.81 Favored 'General case' 0 N--CA 1.424 -1.767 0 N-CA-C 100.776 -3.787 . . . . 0.0 100.776 178.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . 0.289 5.5 mp -107.63 -105.08 0.34 Allowed 'General case' 0 C--N 1.287 -2.121 0 C-N-CA 117.879 -1.528 . . . . 0.0 114.988 -173.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.557 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 17.2 m-70 -112.53 103.75 11.83 Favored 'General case' 0 CA--C 1.493 -1.24 0 C-N-CA 120.278 -0.569 . . . . 0.0 111.936 -173.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.426 ' HG3' ' OE1' ' A' ' 75' ' ' GLU . 18.2 mtmm -93.9 117.92 30.76 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 172.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.482 ' CD ' HH22 ' A' ' 81' ' ' ARG . 9.3 pt-20 -127.85 139.14 34.5 Favored Pre-proline 0 C--N 1.28 -2.44 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 17.0 Cg_exo -67.76 142.98 59.8 Favored 'Trans proline' 0 C--O 1.25 1.096 0 C-N-CA 122.443 2.095 . . . . 0.0 113.309 -178.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -134.43 159.27 41.61 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.421 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 7.0 m -96.91 138.62 34.17 Favored 'General case' 0 N--CA 1.423 -1.818 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 179.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 49.8 tp -84.97 124.01 31.19 Favored 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 120.164 -0.614 . . . . 0.0 109.5 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 75.1 mt -84.72 -52.69 12.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.532 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 174.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -179.02 163.6 1.35 Allowed 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 115.177 -0.919 . . . . 0.0 108.993 175.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.451 ' HB1' ' HG2' ' A' ' 63' ' ' LYS . . . -107.28 126.08 51.98 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 174.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.411 ' HB ' ' HB ' ' A' ' 22' ' ' THR . 44.8 mm -78.44 -64.13 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -175.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -113.25 -161.62 0.77 Allowed 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 178.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -97.47 27.27 19.44 Favored Glycine 0 C--N 1.296 -1.649 0 N-CA-C 108.863 -1.695 . . . . 0.0 108.863 169.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.715 ' OD2' ' HD2' ' A' ' 35' ' ' ARG . 4.9 t70 -143.78 -62.19 0.39 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 -171.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.411 ' HB ' ' HB ' ' A' ' 18' ' ' ILE . 1.8 m -83.77 128.22 34.38 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 114.631 -1.168 . . . . 0.0 108.75 178.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.4 m -133.23 155.65 41.07 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 C-N-CA 122.78 0.432 . . . . 0.0 110.656 -177.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -119.61 112.11 18.91 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 -176.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.1 mp -126.0 159.5 32.54 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.519 0.676 . . . . 0.0 112.532 -176.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.421 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 25.3 ttt -127.62 102.78 6.99 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.464 -1.244 . . . . 0.0 108.741 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -105.1 119.1 38.21 Favored 'General case' 0 C--N 1.287 -2.127 0 C-N-CA 118.931 -1.108 . . . . 0.0 109.867 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 88.2 mttt 59.43 27.92 17.17 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 122.092 0.948 . . . . 0.0 110.754 175.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.436 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 93.07 7.04 62.75 Favored Glycine 0 N--CA 1.439 -1.114 0 CA-C-N 114.619 -1.173 . . . . 0.0 113.245 179.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -105.57 101.42 32.02 Favored Pre-proline 0 C--N 1.31 -1.127 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.436 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 5.5 Cg_exo -79.67 118.3 3.82 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 122.628 2.219 . . . . 0.0 110.47 177.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 63.7 mtt -136.1 149.0 48.52 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.092 0.472 . . . . 0.0 110.819 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.6 m -83.87 107.48 16.28 Favored 'General case' 0 N--CA 1.427 -1.579 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 176.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -101.99 163.78 12.06 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-O 121.602 0.715 . . . . 0.0 110.246 -177.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.715 ' HD2' ' OD2' ' A' ' 21' ' ' ASP . 25.3 ttp85 -137.46 141.79 41.58 Favored 'General case' 0 C--N 1.27 -2.88 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 169.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.492 ' HB2' ' HB ' ' A' ' 39' ' ' VAL . 28.6 mt -60.94 109.43 1.07 Allowed 'General case' 0 C--N 1.307 -1.261 0 O-C-N 124.115 0.884 . . . . 0.0 109.213 -177.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.4 tt -63.71 126.29 27.1 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 -179.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 91.0 mt 85.99 8.48 0.31 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.16 1.784 . . . . 0.0 113.85 -178.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.492 ' HB ' ' HB2' ' A' ' 36' ' ' LEU . 99.7 t -118.33 130.93 72.48 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.15 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 176.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -133.53 107.86 8.27 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 177.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.406 ' HB ' ' HD3' ' A' ' 42' ' ' PRO . 3.8 m -106.87 -56.3 0.06 OUTLIER Pre-proline 0 CA--C 1.569 1.68 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -177.002 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.406 ' HD3' ' HB ' ' A' ' 41' ' ' THR . 9.8 Cg_endo -92.29 13.11 1.95 Allowed 'Trans proline' 0 C--N 1.382 2.292 0 C-N-CA 122.273 1.982 . . . . 0.0 111.788 -175.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -138.26 152.27 48.41 Favored 'General case' 0 N--CA 1.419 -1.975 0 N-CA-C 103.799 -2.667 . . . . 0.0 103.799 178.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.8 m 63.81 20.98 12.48 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-O 121.975 0.893 . . . . 0.0 108.961 -175.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.672 ' O ' ' HD2' ' A' ' 47' ' ' PRO . 22.5 tptp -69.63 -37.91 77.0 Favored 'General case' 0 N--CA 1.436 -1.161 0 O-C-N 121.721 -0.612 . . . . 0.0 111.693 -174.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . 0.38 86.3 t60 87.84 -77.65 0.0 OUTLIER Pre-proline 0 N--CA 1.485 1.308 0 C-N-CA 124.702 1.201 . . . . 0.0 113.221 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.672 ' HD2' ' O ' ' A' ' 45' ' ' LYS . 37.0 Cg_endo -72.07 119.18 6.01 Favored 'Trans proline' 0 C--N 1.375 1.933 0 CA-C-N 122.731 2.011 . . . . 0.0 109.448 169.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -20.35 61.49 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-O 120.92 0.391 . . . . 0.0 111.704 -175.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.533 ' NZ ' ' HA ' ' A' ' 49' ' ' LYS . 1.3 mmpm? -90.96 3.73 53.86 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 121.503 0.668 . . . . 0.0 110.585 175.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -95.93 1.06 62.95 Favored Glycine 0 N--CA 1.425 -2.048 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.876 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 12.7 p -84.78 -35.58 10.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 117.485 0.642 . . . . 0.0 110.526 -178.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -77.87 -26.82 49.49 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 178.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -78.38 -48.36 15.69 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 114.873 -1.058 . . . . 0.0 112.149 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.576 ' OH ' ' HA ' ' A' ' 108' ' ' LEU . 3.0 t80 -88.78 -28.79 20.24 Favored 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.886 -174.008 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -43.77 -58.0 4.38 Favored Glycine 0 CA--C 1.536 1.365 0 N-CA-C 115.186 0.834 . . . . 0.0 115.186 -175.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -56.49 -32.08 88.24 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 123.035 2.49 . . . . 0.0 113.984 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -68.21 -57.1 6.55 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.918 0.39 . . . . 0.0 111.616 -176.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.3 -41.41 98.95 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.559 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 37.0 m -63.96 -35.69 81.5 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.137 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.94 -37.86 88.71 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.023 0.44 . . . . 0.0 110.333 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -68.91 -53.09 22.98 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.774 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 28.5 m -57.11 -48.11 79.45 Favored 'General case' 0 C--N 1.318 -0.79 0 O-C-N 124.101 0.876 . . . . 0.0 112.306 -178.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.465 ' O ' ' HG3' ' A' ' 67' ' ' GLU . 51.8 mttp -60.61 -54.54 44.16 Favored 'General case' 0 C--N 1.344 0.359 0 C-N-CA 120.962 -0.295 . . . . 0.0 110.963 -178.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.518 ' HZ2' ' HB2' ' A' ' 64' ' ' LYS . 10.6 mtmp? -67.5 -23.24 65.45 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 15.5 tpt -67.05 -45.11 78.4 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.21 0.529 . . . . 0.0 109.629 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.0 m -86.93 -26.13 6.06 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.438 -178.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' A' ' 63' ' ' LYS . 51.0 mt-10 -73.9 -34.15 64.29 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.368 177.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -83.96 -16.34 44.47 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 121.01 0.433 . . . . 0.0 110.415 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.74 143.12 48.03 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.018 -178.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 44.2 mttp -74.44 -44.31 52.34 Favored 'General case' 0 CA--C 1.493 -1.236 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt -133.78 147.35 51.26 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-N 113.846 -1.524 . . . . 0.0 107.047 -179.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.408 ' O ' ' HA ' ' A' ' 11' ' ' PRO . 4.0 mp -105.9 120.99 57.67 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.719 0 N-CA-C 105.106 -2.183 . . . . 0.0 105.106 173.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.532 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 23.9 mm-40 -111.83 132.95 54.36 Favored 'General case' 0 C--N 1.292 -1.908 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 -175.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.6 m -112.3 129.72 67.32 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.989 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 175.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.557 ' HA ' ' O ' ' A' ' 8' ' ' HIS . 28.4 tt0 -106.52 118.97 38.04 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 119.525 -0.87 . . . . 0.0 111.229 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -87.24 124.24 33.1 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-N 113.395 -1.729 . . . . 0.0 109.232 177.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -88.31 -175.58 5.06 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 177.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.55 -3.81 56.08 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -173.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -93.2 -87.67 1.59 Allowed Glycine 0 N--CA 1.435 -1.421 0 C-N-CA 119.913 -1.137 . . . . 0.0 112.473 -177.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -125.59 139.24 53.75 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -175.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.482 HH22 ' CD ' ' A' ' 10' ' ' GLU . 25.6 ttt180 -98.96 -13.35 19.99 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.648 0.737 . . . . 0.0 109.129 178.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 13.6 p -141.93 159.1 42.92 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.333 177.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.29 -168.9 1.94 Allowed 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -71.77 -31.42 66.62 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-O 120.632 0.253 . . . . 0.0 111.561 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -79.86 -22.23 43.14 Favored 'General case' 0 C--O 1.244 0.785 0 CA-C-O 121.227 0.537 . . . . 0.0 110.814 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 105.55 28.5 5.39 Favored Glycine 0 N--CA 1.437 -1.25 0 C-N-CA 120.808 -0.711 . . . . 0.0 111.895 176.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 12.2 mmt85 -94.74 139.19 31.58 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 174.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -74.78 121.22 6.62 Favored Glycine 0 N--CA 1.425 -2.033 0 O-C-N 123.712 0.632 . . . . 0.0 111.575 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.3 mt -103.58 93.05 4.72 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 178.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -145.13 155.08 43.1 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -179.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -85.25 132.04 34.33 Favored 'General case' 0 C--N 1.29 -2.02 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 48.3 mm -99.5 126.38 52.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 C-N-CA 119.247 -0.981 . . . . 0.0 110.073 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.584 ' CE2' ' HG3' ' A' ' 98' ' ' MET . 27.0 m-85 -120.3 144.07 48.01 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 114.682 -1.145 . . . . 0.0 109.125 179.078 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -106.67 99.54 9.11 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 176.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.5 p30 42.79 38.31 1.32 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 125.146 1.378 . . . . 0.0 113.907 -176.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.78 -11.4 38.35 Favored Glycine 0 N--CA 1.444 -0.785 0 CA-C-N 115.449 -0.796 . . . . 0.0 114.131 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -87.63 135.27 33.43 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 176.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' MET . . . . . 0.584 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 3.6 mpp? -80.4 111.69 17.04 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 177.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 82.8 t -70.14 -45.63 75.28 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 19.1 m-20 -55.35 -50.13 70.46 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.421 -179.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.439 ' O ' ' HB2' ' A' ' 105' ' ' ARG . 9.3 tp10 -55.8 -51.01 68.94 Favored 'General case' 0 C--O 1.211 -0.96 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.226 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.93 -43.29 95.04 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.829 -176.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 79.0 mt -60.29 -48.98 79.42 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 179.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 52.1 t -73.06 -31.5 35.47 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.47 -178.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.439 ' HB2' ' O ' ' A' ' 101' ' ' GLU . 1.8 tpt180 -72.57 -28.02 62.55 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.997 -178.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -87.51 -8.7 56.06 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.239 0.543 . . . . 0.0 109.76 175.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.97 41.52 87.48 Favored Glycine 0 N--CA 1.431 -1.695 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.186 -176.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.576 ' HA ' ' OH ' ' A' ' 54' ' ' TYR . 90.7 mt -96.89 -18.21 19.66 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.063 0.459 . . . . 0.0 110.768 179.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -149.7 171.32 16.88 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -176.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -110.2 171.55 7.38 Favored 'General case' 0 N--CA 1.425 -1.678 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 8.0 p -84.01 133.35 29.39 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.782 0 CA-C-O 121.066 0.46 . . . . 0.0 110.359 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.46 121.63 31.06 Favored 'General case' 0 CA--C 1.486 -1.503 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 176.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -77.66 133.8 38.3 Favored 'General case' 0 C--N 1.28 -2.431 0 CA-C-N 114.841 -1.072 . . . . 0.0 111.769 -171.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 44.5 t -88.3 127.75 41.08 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.876 0 N-CA-C 103.857 -2.646 . . . . 0.0 103.857 169.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -81.46 -17.89 47.18 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -165.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 9.6 mptt 69.45 121.99 0.03 OUTLIER Pre-proline 0 N--CA 1.474 0.761 0 C-N-CA 123.998 0.919 . . . . 0.0 111.958 -175.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -97.45 -166.43 0.1 OUTLIER 'Trans proline' 0 N--CA 1.435 -1.935 0 C-N-CA 122.249 1.966 . . . . 0.0 109.151 173.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . 0.417 ' C ' HD21 ' A' ' 118' ' ' ASN . 0.2 OUTLIER -102.75 -65.3 1.0 Allowed 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 176.044 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -164.18 99.17 0.84 Allowed 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -178.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 13.0 p -79.0 -34.39 44.08 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-O 120.826 0.346 . . . . 0.0 110.75 -179.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 . . . . . 0 N--CA 1.435 -1.185 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 178.737 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.442 0 N-CA-C 110.901 -0.88 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 50.6 m -89.78 18.05 5.99 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.91 0.355 . . . . 0.0 111.083 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 7.7 p -63.91 111.57 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.83 0 CA-C-O 121.243 0.544 . . . . 0.0 110.936 177.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . 54.78 -100.65 0.11 Allowed 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 124.668 1.187 . . . . 0.0 112.884 -178.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -170.26 99.81 0.27 Allowed 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 106.19 -1.782 . . . . 0.0 106.19 -177.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 60.6 t -97.82 121.49 48.41 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.862 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.667 -177.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -72.2 101.76 2.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.629 0.728 . . . . 0.0 110.391 172.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.417 ' HB3' ' CD ' ' B' ' 130' ' ' PRO . 59.1 mtpt -91.13 174.16 4.73 Favored Pre-proline 0 C--N 1.304 -1.382 0 CA-C-N 114.363 -1.289 . . . . 0.0 110.035 -179.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . 0.417 ' CD ' ' HB3' ' B' ' 129' ' ' LYS . 2.0 Cg_endo -74.58 172.59 15.88 Favored 'Trans proline' 0 C--N 1.37 1.675 0 C-N-CA 121.719 1.613 . . . . 0.0 112.456 -179.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -89.15 41.97 1.06 Allowed 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 26.9 p-10 -97.69 9.14 43.32 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.995 -174.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.57 -37.61 73.44 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-O 122.036 0.922 . . . . 0.0 110.88 -179.358 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 63.0 m80 -103.83 -0.45 29.19 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.498 -0.773 . . . . 0.0 109.852 -177.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -66.66 -38.03 86.01 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.902 -176.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -58.52 -37.93 76.65 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.153 -178.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.1 mt -64.83 -51.09 64.01 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.811 -178.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 8.2 mp -70.25 -23.26 62.87 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 178.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 84.9 mtt-85 -66.03 -31.24 72.02 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.278 -0.569 . . . . 0.0 110.537 174.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . 0.482 ' HE2' ' HA ' ' B' ' 140' ' ' LYS . 10.8 mmpt? -71.35 -39.7 71.15 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 176.022 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 3.5 m -59.99 -49.73 76.52 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.672 177.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.555 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 0.8 OUTLIER -64.22 -43.17 95.79 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.838 179.04 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -61.66 -40.93 96.68 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.995 0.426 . . . . 0.0 110.888 179.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -69.21 -48.02 63.19 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.453 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.55 -32.49 73.87 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.564 -0.743 . . . . 0.0 112.081 -175.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 146' ' ' LYS . . . . . 0.555 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 84.0 mttt -65.33 -40.38 93.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.498 0.19 . . . . 0.0 110.648 174.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm -64.79 -37.88 89.11 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.501 0.667 . . . . 0.0 109.582 178.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 49.3 mm-40 -79.24 -13.87 59.41 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 114.709 -1.132 . . . . 0.0 113.043 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm 54.32 47.49 22.86 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.54 0.736 . . . . 0.0 109.834 -178.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 96.3 mt -74.98 95.59 3.02 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 114.943 -1.026 . . . . 0.0 112.0 -174.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 51.9 t30 53.92 -69.84 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 127.775 2.43 . . . . 0.0 114.154 173.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 12.0 tt -75.84 -28.74 19.48 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.075 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -78.13 -15.58 58.73 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.365 0.602 . . . . 0.0 111.407 -178.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 22.9 t -88.8 11.09 18.77 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.548 177.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -66.79 -28.73 68.62 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.147 0.579 . . . . 0.0 112.41 -178.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.1 t70 . . . . . 0 C--N 1.299 -1.592 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 -170.577 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.514 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 86.0 m -77.08 100.44 5.7 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 121.597 0.713 . . . . 0.0 110.179 177.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.5 p -90.53 -15.19 31.14 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.669 -177.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.427 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 10.5 m -66.15 -39.34 89.74 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 176.51 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 4' ' ' THR . 92.0 mttt 73.1 -178.19 0.19 Allowed 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 114.515 -1.221 . . . . 0.0 111.456 -173.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -135.68 -150.99 0.4 Allowed 'General case' 0 C--N 1.291 -1.943 0 N-CA-C 105.69 -1.967 . . . . 0.0 105.69 175.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.42 ' HB3' ' O ' ' A' ' 76' ' ' PHE . 64.0 mt 64.75 -158.86 0.29 Allowed 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 179.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.415 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 7.7 m-70 -117.11 102.91 9.71 Favored 'General case' 0 C--N 1.292 -1.914 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 174.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.52 107.48 15.21 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 105.022 -2.214 . . . . 0.0 105.022 175.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -138.99 159.0 68.73 Favored Pre-proline 0 C--N 1.3 -1.582 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.454 -173.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -78.94 147.17 21.06 Favored 'Trans proline' 0 C--O 1.25 1.075 0 C-N-CA 122.729 2.286 . . . . 0.0 114.123 -174.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -144.14 155.59 43.99 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.343 177.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.424 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 9.1 m -104.35 142.67 34.16 Favored 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 179.108 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -84.22 142.9 29.95 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 118.109 -1.437 . . . . 0.0 109.538 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 70.4 mt -103.0 -57.59 4.4 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.055 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 171.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 51.1 mttm -152.57 154.14 34.81 Favored 'General case' 0 N--CA 1.428 -1.536 0 C-N-CA 124.013 0.925 . . . . 0.0 110.552 -178.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.403 ' HB2' ' HG2' ' A' ' 63' ' ' LYS . . . -108.8 95.97 6.01 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 105.824 -1.917 . . . . 0.0 105.824 169.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 60.5 mt -68.4 -37.67 78.21 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.923 -171.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.417 ' CG ' ' H ' ' A' ' 20' ' ' GLY . 20.6 t70 -152.44 -165.03 2.09 Favored 'General case' 0 C--N 1.291 -1.97 0 N-CA-C 106.366 -1.716 . . . . 0.0 106.366 -176.12 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.417 ' H ' ' CG ' ' A' ' 19' ' ' ASP . . . -90.96 -25.76 23.82 Favored Glycine 0 C--N 1.286 -2.206 0 N-CA-C 109.029 -1.628 . . . . 0.0 109.029 176.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.709 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 10.5 t70 -92.87 -36.32 12.88 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 122.035 0.922 . . . . 0.0 109.504 -177.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.8 m -114.13 127.29 55.85 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 114.902 -1.045 . . . . 0.0 111.294 -173.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.9 p -132.79 153.75 38.54 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.629 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -178.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -112.85 112.96 24.82 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 -175.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -115.75 159.1 21.86 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.764 0.792 . . . . 0.0 111.737 -178.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.424 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 46.7 ttm -123.01 104.85 9.49 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 175.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -109.87 118.13 35.67 Favored 'General case' 0 C--N 1.286 -2.158 0 C-N-CA 118.147 -1.421 . . . . 0.0 109.626 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 78.9 mttt 62.41 27.69 16.46 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.222 1.009 . . . . 0.0 110.199 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.08 1.86 64.74 Favored Glycine 0 CA--C 1.524 0.598 0 CA-C-N 115.365 -0.834 . . . . 0.0 113.164 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -104.11 107.55 57.5 Favored Pre-proline 0 C--N 1.32 -0.68 0 O-C-N 122.462 -0.434 . . . . 0.0 110.48 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -83.23 120.31 2.9 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.119 2.546 . . . . 0.0 111.992 178.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' MET . . . . . 0.475 ' HB2' ' CE2' ' A' ' 34' ' ' PHE . 90.4 mtp -134.82 156.35 49.04 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 120.892 0.377 . . . . 0.0 110.273 178.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.2 m -92.98 119.5 32.31 Favored 'General case' 0 C--N 1.295 -1.786 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.475 ' CE2' ' HB2' ' A' ' 32' ' ' MET . 86.0 m-85 -116.78 142.57 46.75 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -176.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.709 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 31.6 mtm105 -106.3 153.89 21.54 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 166.119 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.521 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 73.9 mt -83.82 129.4 34.94 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-O 121.651 0.738 . . . . 0.0 112.464 -175.027 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.5 mt -57.04 130.29 45.45 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.452 176.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.593 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 78.5 mt 73.55 11.27 4.79 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 124.551 1.157 . . . . 0.0 112.481 177.603 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 86.3 t -110.84 131.05 63.08 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 CA-C-O 121.252 0.548 . . . . 0.0 110.646 -179.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -128.31 107.17 9.54 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 174.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.524 ' HB ' ' HB2' ' A' ' 21' ' ' ASP . 1.3 m -114.52 -27.22 0.11 Allowed Pre-proline 0 C--N 1.287 -2.11 0 CA-C-O 118.139 -0.934 . . . . 0.0 112.357 175.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -55.32 109.55 0.43 Allowed 'Trans proline' 1 C--N 1.426 4.629 0 CA-C-N 121.873 1.705 . . . . 0.0 110.689 177.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.407 ' OE1' ' HA ' ' A' ' 46' ' ' HIS . 2.3 tm-20 -83.2 123.23 29.37 Favored 'General case' 0 N--CA 1.414 -2.269 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 -177.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.1 t -124.8 0.74 8.08 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -174.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.562 ' NZ ' ' HB2' ' B' ' 155' ' ' GLU . 35.5 ttpt -82.78 -44.31 15.7 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.407 ' HA ' ' OE1' ' A' ' 43' ' ' GLU . 35.2 m170 72.77 104.58 0.03 OUTLIER Pre-proline 0 CA--C 1.505 -0.786 0 CA-C-N 113.574 -1.648 . . . . 0.0 111.403 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.406 ' C ' ' H ' ' A' ' 49' ' ' LYS . 30.5 Cg_endo -64.56 -35.33 48.7 Favored 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 123.015 2.477 . . . . 0.0 112.152 -175.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt 72.93 -41.62 0.51 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.172 1.389 . . . . 0.0 111.597 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.413 ' HB2' ' HZ3' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -64.08 -36.13 83.02 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 124.867 1.267 . . . . 0.0 113.889 -179.137 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 172.29 -163.25 35.4 Favored Glycine 0 CA--C 1.502 -0.732 0 C-N-CA 120.361 -0.923 . . . . 0.0 111.417 -177.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.7 p -81.57 79.14 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 CA-C-O 122.877 1.322 . . . . 0.0 112.539 -176.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -90.81 -12.65 35.74 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.235 -1.348 . . . . 0.0 108.289 176.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 43.6 mtpt -66.63 -37.41 84.77 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-N 114.484 -1.234 . . . . 0.0 112.12 -175.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 75.1 m-85 59.37 27.34 16.42 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.77 0.828 . . . . 0.0 113.101 -178.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -51.14 -55.78 17.43 Favored Glycine 0 CA--C 1.54 1.643 0 CA-C-N 115.287 -0.87 . . . . 0.0 113.451 177.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo -56.26 -36.34 96.73 Favored 'Trans proline' 0 C--N 1.373 1.837 0 C-N-CA 122.911 2.407 . . . . 0.0 112.517 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.8 mp0 -62.36 -51.77 66.3 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 122.973 0.509 . . . . 0.0 110.406 178.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.29 -41.64 85.07 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.841 -178.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.0 m -67.83 -33.97 75.81 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.395 0.617 . . . . 0.0 111.357 -177.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.478 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -70.95 -39.07 72.8 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.042 175.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -62.8 -41.95 99.5 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.318 -176.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.534 ' O ' HG22 ' A' ' 66' ' ' VAL . 7.5 p -63.47 -44.61 93.92 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.85 178.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.494 ' NZ ' ' HB3' ' A' ' 63' ' ' LYS . 9.1 mtpm? -57.67 -49.03 77.84 Favored 'General case' 0 CA--C 1.513 -0.475 0 O-C-N 123.385 0.428 . . . . 0.0 110.472 176.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.478 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 97.1 mttt -57.36 -39.89 76.92 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.139 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.407 ' HE2' ' HA ' ' A' ' 65' ' ' MET . 1.6 mmt -72.19 -51.38 21.44 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 179.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.534 HG22 ' O ' ' A' ' 62' ' ' THR . 34.6 m -74.33 -27.21 21.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 -174.018 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -86.19 -20.15 28.98 Favored 'General case' 0 C--N 1.314 -0.953 0 O-C-N 121.847 -0.533 . . . . 0.0 110.577 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -83.59 -24.66 31.4 Favored 'General case' 0 C--O 1.245 0.856 0 CA-C-O 121.158 0.504 . . . . 0.0 109.822 174.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.57 131.25 38.32 Favored 'General case' 0 C--O 1.248 1.013 0 CA-C-N 114.819 -1.082 . . . . 0.0 112.027 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -82.99 -37.49 23.94 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 115.117 -0.947 . . . . 0.0 108.69 177.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -133.09 119.8 20.46 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.781 -1.1 . . . . 0.0 108.182 -178.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 63.4 mt -99.51 112.56 32.17 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.658 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -114.31 142.14 46.7 Favored 'General case' 0 C--N 1.289 -2.023 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.083 -177.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -110.34 124.95 67.53 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.756 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.415 ' HA ' ' O ' ' A' ' 8' ' ' HIS . 34.2 tt0 -115.28 125.62 53.51 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.42 ' O ' ' HB3' ' A' ' 7' ' ' LEU . 29.8 t80 -96.55 129.18 43.98 Favored 'General case' 0 N--CA 1.406 -2.627 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.851 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -85.51 -174.37 5.14 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 125.117 1.367 . . . . 0.0 110.031 -176.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.642 ' NZ ' ' HA ' ' A' ' 78' ' ' LYS . 1.1 mmpm? -94.78 7.85 44.52 Favored 'General case' 0 C--N 1.313 -0.993 0 O-C-N 121.458 -0.776 . . . . 0.0 112.144 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.561 ' HA3' ' CG1' ' A' ' 114' ' ' VAL . . . -84.15 -137.2 3.43 Favored Glycine 0 N--CA 1.428 -1.867 0 C-N-CA 120.775 -0.726 . . . . 0.0 111.899 175.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -95.23 144.22 26.01 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.6 ttm180 -87.07 -29.18 22.09 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.162 0.506 . . . . 0.0 110.528 178.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.0 p -101.97 142.94 32.47 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-O 121.353 0.597 . . . . 0.0 111.561 -178.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -91.63 149.66 21.54 Favored 'General case' 0 C--N 1.287 -2.14 0 CA-C-N 115.052 -0.976 . . . . 0.0 111.125 179.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -17.3 63.98 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 124.555 1.142 . . . . 0.0 113.531 -178.307 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -97.15 -2.36 43.19 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.623 0.725 . . . . 0.0 109.65 179.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 101.87 24.85 8.34 Favored Glycine 0 N--CA 1.438 -1.176 0 C-N-CA 120.553 -0.832 . . . . 0.0 113.037 177.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.413 ' HG2' ' HG3' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -106.71 -178.71 3.73 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 122.048 -0.678 . . . . 0.0 110.176 174.656 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -103.76 152.28 17.79 Favored Glycine 0 N--CA 1.42 -2.374 0 N-CA-C 106.859 -2.496 . . . . 0.0 106.859 168.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 93.6 mt -109.03 122.5 47.39 Favored 'General case' 0 C--N 1.282 -2.333 0 CA-C-N 117.972 0.886 . . . . 0.0 110.442 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -144.16 157.85 44.06 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.116 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.482 ' CZ ' ' HB2' ' A' ' 100' ' ' ASN . 4.3 t80 -103.83 129.73 51.32 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 105.546 -2.02 . . . . 0.0 105.546 174.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 41.6 mm -99.32 125.73 52.8 Favored 'Isoleucine or valine' 0 C--O 1.249 1.042 0 C-N-CA 119.731 -0.788 . . . . 0.0 111.892 -178.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -110.79 131.6 54.91 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.983 173.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.67 98.26 8.03 Favored 'General case' 0 C--N 1.289 -2.052 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 175.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.251 4.1 p30 44.92 32.12 0.79 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.209 1.404 . . . . 0.0 114.137 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.21 2.16 35.77 Favored Glycine 0 CA--C 1.521 0.442 0 CA-C-N 115.676 -0.693 . . . . 0.0 113.445 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.7 mttp -99.78 126.88 45.92 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 175.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -78.13 105.5 9.39 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 122.815 0.446 . . . . 0.0 110.401 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 57.6 t -71.51 -43.05 72.46 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.332 -178.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.521 ' ND2' ' HB3' ' A' ' 36' ' ' LEU . 1.7 m-20 -58.76 -49.82 76.2 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.957 -178.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -63.84 -37.16 86.34 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.542 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.55 -44.6 93.19 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.898 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.13 -52.75 64.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.747 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.1 t -65.05 -41.45 92.02 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.276 -177.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 34.4 ttp85 -64.23 -31.98 73.39 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.922 0.391 . . . . 0.0 111.291 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -87.99 -1.05 57.75 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.954 0.354 . . . . 0.0 111.954 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.411 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 74.44 22.14 77.85 Favored Glycine 0 N--CA 1.441 -0.997 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.428 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.3 mt -91.67 -6.24 52.44 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -151.85 162.95 40.22 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.005 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt -120.34 154.74 34.62 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 178.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.6 p -76.98 127.97 37.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 C-N-CA 118.656 -1.218 . . . . 0.0 112.28 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.593 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . -97.58 121.05 39.03 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 105.225 -2.139 . . . . 0.0 105.225 171.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.538 ' OH ' ' HA ' ' B' ' 130' ' ' PRO . 31.5 t80 -78.12 129.13 34.81 Favored 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 118.783 -1.167 . . . . 0.0 112.386 -173.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.561 ' CG1' ' HA3' ' A' ' 79' ' ' GLY . 95.4 t -99.56 120.01 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.952 0 CA-C-N 114.649 -1.16 . . . . 0.0 108.905 178.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -97.34 140.29 32.03 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -77.31 115.65 50.97 Favored Pre-proline 0 N--CA 1.42 -1.961 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 173.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.406 ' C ' ' H ' ' A' ' 119' ' ' ASN . 67.9 Cg_endo -89.0 9.51 3.56 Favored 'Trans proline' 0 C--N 1.309 -1.552 0 C-N-CA 122.505 2.137 . . . . 0.0 113.064 -171.037 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 76.62 -24.65 0.22 Allowed 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 124.118 0.967 . . . . 0.0 111.909 -178.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . 0.406 ' H ' ' C ' ' A' ' 117' ' ' PRO . 3.1 m-20 79.12 -36.54 0.17 Allowed 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.49 1.516 . . . . 0.0 112.396 174.489 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 28.6 m -82.17 -42.97 18.31 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 176.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 16.0 t-80 . . . . . 0 C--N 1.317 -0.83 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.383 178.659 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.477 0 N-CA-C 110.859 -0.897 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 19.0 m -126.86 111.1 13.77 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 7.6 p -165.27 144.25 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -71.3 116.46 11.65 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -176.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . 0.57 ' CE1' ' HB2' ' B' ' 128' ' ' TYR . 0.2 OUTLIER -154.56 172.78 17.27 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.194 173.398 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 27.7 m -88.43 -33.78 6.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 C-N-CA 121.039 -0.264 . . . . 0.0 111.574 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 128' ' ' TYR . . . . . 0.57 ' HB2' ' CE1' ' B' ' 126' ' ' TYR . 24.5 t80 51.11 74.74 0.22 Allowed 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 124.721 1.208 . . . . 0.0 110.983 -175.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -103.54 103.34 35.4 Favored Pre-proline 0 C--N 1.295 -1.764 0 N-CA-C 105.468 -2.049 . . . . 0.0 105.468 173.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . 0.538 ' HA ' ' OH ' ' A' ' 113' ' ' TYR . 9.3 Cg_exo -67.02 116.33 4.1 Favored 'Trans proline' 0 N--CA 1.446 -1.301 0 C-N-CA 122.093 1.862 . . . . 0.0 113.146 -174.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 131' ' ' ASN . . . . . 0.442 ' C ' ' H ' ' B' ' 133' ' ' THR . 26.6 p-10 -60.38 -50.44 73.58 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 170.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.464 ' HA ' ' CB ' ' B' ' 135' ' ' GLU . 16.7 t-20 73.15 -10.91 0.95 Allowed 'General case' 0 CA--C 1.508 -0.663 0 C-N-CA 127.982 2.513 . . . . 0.0 112.523 168.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 133' ' ' THR . . . . . 0.442 ' H ' ' C ' ' B' ' 131' ' ' ASN . 0.7 OUTLIER -62.15 -32.29 72.88 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-N 113.87 -1.514 . . . . 0.0 112.263 -176.447 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 69.9 m80 -139.24 10.83 2.56 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 176.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.464 ' CB ' ' HA ' ' B' ' 132' ' ' ASN . 45.0 tt0 -60.64 -59.84 4.75 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.467 -174.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . 0.446 ' O ' ' HG2' ' B' ' 140' ' ' LYS . 13.7 mm100 -54.99 -44.57 74.6 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 123.946 0.779 . . . . 0.0 111.885 -176.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 91.2 mt -60.24 -47.4 86.14 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.652 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.58 -35.5 75.4 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 178.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -60.62 -45.21 94.89 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 120.759 0.314 . . . . 0.0 110.296 176.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . 0.446 ' HG2' ' O ' ' B' ' 136' ' ' GLN . 2.8 mmmp? -63.43 -44.91 93.21 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.436 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 8.1 p -70.2 -41.07 74.17 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.327 -178.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.518 ' HG3' ' CZ2' ' B' ' 153' ' ' TRP . 39.3 tt0 -65.94 -44.84 83.86 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.516 177.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -54.29 -43.4 71.03 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 120.999 0.428 . . . . 0.0 110.591 -179.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -64.73 -46.85 80.47 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.526 178.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.13 -35.73 80.36 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.915 -178.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 146' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 88.8 mttt -62.33 -38.77 90.76 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.971 0.415 . . . . 0.0 110.334 176.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . 0.458 ' HB3' ' HZ2' ' B' ' 147' ' ' LYS . 9.9 mtpm? -63.99 -40.63 96.79 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.226 179.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -86.35 -8.12 57.94 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.337 -175.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . 0.517 ' O ' ' HB2' ' B' ' 154' ' ' SER . 51.0 mtpt 49.7 58.83 5.0 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 124.092 0.957 . . . . 0.0 111.119 -177.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 90.8 mt -88.52 119.51 29.04 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.299 -178.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 151' ' ' ASN . . . . . 0.411 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 90.9 m-20 52.5 -93.46 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.163 1.385 . . . . 0.0 113.885 176.021 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 35.3 mt -65.64 -31.4 53.61 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.593 0 CA-C-O 121.087 0.47 . . . . 0.0 110.569 178.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 153' ' ' TRP . . . . . 0.518 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 58.8 m95 -77.94 -6.49 54.54 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-O 122.101 0.953 . . . . 0.0 111.117 -178.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 154' ' ' SER . . . . . 0.517 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 19.9 t -99.87 18.62 17.87 Favored 'General case' 0 N--CA 1.411 -2.4 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.14 175.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . 0.562 ' HB2' ' NZ ' ' A' ' 45' ' ' LYS . 10.0 pt-20 -71.25 -17.62 62.48 Favored 'General case' 0 C--N 1.356 0.86 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 173.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.1 t70 . . . . . 0 CA--C 1.5 -0.966 0 CA-C-N 113.339 -1.755 . . . . 0.0 112.1 175.08 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.273 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.6 m -63.56 -52.86 59.24 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 177.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.8 m 57.55 76.04 0.34 Allowed 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.271 -1.332 . . . . 0.0 114.504 176.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 15.2 p -122.97 -39.26 2.52 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.624 176.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -91.79 -29.21 16.89 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.22 178.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.01 168.8 16.77 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.3 mt -91.4 -175.39 4.22 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -173.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 25.5 p80 -123.61 102.17 7.71 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.491 ' H ' ' HD3' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -94.49 132.23 39.37 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 174.7 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -117.38 144.37 33.85 Favored Pre-proline 0 C--N 1.262 -3.217 0 CA-C-N 114.423 -1.262 . . . . 0.0 110.847 -175.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -63.92 138.91 65.34 Favored 'Trans proline' 0 C--N 1.359 1.098 0 C-N-CA 123.07 2.514 . . . . 0.0 114.301 -174.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.572 ' O ' ' HB ' ' A' ' 72' ' ' ILE . . . -136.08 151.68 50.08 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.488 178.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 86.7 m -98.94 133.2 43.55 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 178.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -80.93 141.31 34.64 Favored 'General case' 0 C--N 1.306 -1.292 0 C-N-CA 118.498 -1.281 . . . . 0.0 109.255 177.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 74.1 mt -101.36 -53.56 7.51 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 175.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -161.67 156.99 23.82 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.489 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -112.54 119.11 37.06 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 174.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 59.8 mt -85.71 -64.03 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 CA-C-O 121.192 0.52 . . . . 0.0 109.747 -175.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -135.93 -168.79 2.28 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.172 -0.922 . . . . 0.0 108.526 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -74.11 -22.54 77.69 Favored Glycine 0 C--N 1.314 -0.661 0 C-N-CA 120.657 -0.783 . . . . 0.0 112.615 -177.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.421 ' HB2' ' NE ' ' A' ' 35' ' ' ARG . 9.6 p-10 -100.63 -20.36 15.69 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 122.304 0.242 . . . . 0.0 110.756 -176.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 p -127.73 118.8 24.46 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.3 m -128.11 157.45 40.33 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.916 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 176.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -119.89 119.22 32.87 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -178.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.9 mp -125.25 159.57 31.33 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.501 0.667 . . . . 0.0 112.2 -175.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.447 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 48.0 ttm -122.8 107.09 11.51 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 124.177 0.991 . . . . 0.0 108.497 177.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -113.18 126.89 55.93 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.9 mttt 59.0 27.66 16.66 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 121.613 0.721 . . . . 0.0 111.0 178.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 88.03 7.05 74.49 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.749 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.447 ' O ' ' HA ' ' A' ' 26' ' ' MET . 17.6 mm-40 -103.88 104.11 41.11 Favored Pre-proline 0 C--N 1.319 -0.74 0 O-C-N 122.422 -0.457 . . . . 0.0 110.511 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -81.07 113.83 2.77 Favored 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.623 2.215 . . . . 0.0 110.685 176.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 65.6 mtt -135.14 149.85 50.07 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.6 m -87.75 129.68 35.09 Favored 'General case' 0 C--N 1.295 -1.804 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 175.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -113.51 138.9 49.47 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -173.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.421 ' NE ' ' HB2' ' A' ' 21' ' ' ASP . 10.6 tpp85 -107.99 129.46 55.12 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 106.324 -1.732 . . . . 0.0 106.324 168.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.9 mp -64.94 122.02 16.02 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.5 0.667 . . . . 0.0 111.066 178.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.4 tt -66.35 130.18 42.33 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.98 -1.009 . . . . 0.0 108.699 -177.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.447 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 70.3 mt 79.5 8.16 1.76 Allowed 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 124.938 1.295 . . . . 0.0 111.611 -177.281 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 54.2 t -115.41 126.44 72.97 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 CA-C-O 121.175 0.512 . . . . 0.0 110.543 179.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -141.68 108.01 5.27 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.325 175.121 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.3 m -82.34 -40.46 0.91 Allowed Pre-proline 0 C--N 1.282 -2.351 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.143 173.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.568 ' HG3' ' O ' ' A' ' 47' ' ' PRO . 87.5 Cg_exo -50.6 110.09 0.36 Allowed 'Trans proline' 0 C--N 1.398 3.169 0 C-N-CA 123.015 2.476 . . . . 0.0 116.155 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.466 ' O ' ' HB ' ' A' ' 44' ' ' THR . 32.3 tt0 -149.83 147.65 28.22 Favored 'General case' 0 C--N 1.287 -2.151 0 N-CA-C 101.952 -3.351 . . . . 0.0 101.952 167.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.466 ' HB ' ' O ' ' A' ' 43' ' ' GLU . 46.2 m 76.48 161.89 0.23 Allowed 'General case' 0 CA--C 1.563 1.454 0 N-CA-C 106.006 -1.85 . . . . 0.0 106.006 -165.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -69.87 -0.26 6.97 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -176.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -102.6 98.94 11.95 Favored Pre-proline 0 C--N 1.318 -0.797 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.568 ' O ' ' HG3' ' A' ' 42' ' ' PRO . 46.1 Cg_endo -89.16 9.88 3.41 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.781 2.32 . . . . 0.0 115.897 -169.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -109.71 -37.93 5.53 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 118.616 -1.233 . . . . 0.0 111.813 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm -101.9 -23.0 14.21 Favored 'General case' 0 C--N 1.295 -1.762 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.336 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 67.6 -103.62 1.0 Allowed Glycine 0 C--N 1.337 0.618 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 -177.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 29.8 t -87.49 95.26 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.32 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 173.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -52.7 -29.03 24.55 Favored 'General case' 0 C--N 1.31 -1.15 0 C-N-CA 124.907 1.283 . . . . 0.0 114.393 -170.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -69.51 -20.5 63.71 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.791 0.329 . . . . 0.0 111.721 178.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -117.64 4.8 12.34 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.907 0.861 . . . . 0.0 108.931 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -57.94 -49.06 78.18 Favored Glycine 0 N--CA 1.443 -0.863 0 CA-C-N 114.322 -1.308 . . . . 0.0 113.157 178.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -54.44 -38.74 89.66 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 122.776 2.317 . . . . 0.0 111.852 176.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -63.25 -56.82 13.35 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.737 178.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.48 -51.07 69.85 Favored 'General case' 0 CA--C 1.516 -0.351 0 O-C-N 124.018 0.824 . . . . 0.0 111.943 -176.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.511 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 13.9 p -64.8 -44.46 89.87 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.846 -0.616 . . . . 0.0 112.661 -177.099 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.404 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -69.98 -34.81 73.84 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -59.66 -49.22 78.58 Favored 'General case' 0 C--O 1.244 0.767 0 C-N-CA 123.116 0.566 . . . . 0.0 110.758 -177.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.9 m -61.6 -42.02 98.27 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.138 178.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.511 ' HG3' ' O ' ' A' ' 59' ' ' SER . 29.7 mtpp -57.28 -46.79 82.79 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.646 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.404 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 97.6 mttt -65.89 -42.43 90.29 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.641 -0.708 . . . . 0.0 111.331 -178.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.1 mmt -64.05 -44.71 91.66 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 123.557 0.536 . . . . 0.0 112.373 -179.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.5 m -72.38 -29.23 30.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -176.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -82.65 -26.97 31.66 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 119.915 -0.714 . . . . 0.0 110.979 178.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -73.08 -27.87 61.97 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.51 ' HA ' ' OD1' ' A' ' 95' ' ' ASP . . . -55.09 121.02 7.85 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 114.63 -1.168 . . . . 0.0 112.481 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.449 ' HD2' ' N ' ' A' ' 70' ' ' LYS . 9.3 mptt -82.88 -31.09 28.07 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 174.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.6 mtpp -127.21 126.97 43.71 Favored 'General case' 0 N--CA 1.426 -1.64 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.572 ' HB ' ' O ' ' A' ' 12' ' ' ALA . 3.7 mp -113.64 113.15 43.1 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.194 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 178.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.472 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 24.8 mt-10 -113.01 137.46 51.37 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 -177.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.1 m -110.29 127.04 67.53 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 177.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -114.11 140.45 48.48 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.717 -175.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -109.92 116.82 32.31 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 124.204 1.002 . . . . 0.0 110.963 -177.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.427 ' OD2' ' HB ' ' B' ' 133' ' ' THR . 9.1 t70 -88.36 -174.28 4.55 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 176.478 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -60.1 -13.08 10.12 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -175.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.494 ' N ' HD22 ' B' ' 131' ' ' ASN . . . -76.6 -151.08 3.73 Favored Glycine 0 C--N 1.313 -0.706 0 CA-C-O 121.497 0.499 . . . . 0.0 114.155 -173.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -89.81 155.86 18.88 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 42.4 ttt180 -91.75 -3.51 56.12 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 122.357 1.075 . . . . 0.0 108.615 178.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.8 p -115.81 142.86 46.2 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.566 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -102.2 157.71 16.69 Favored 'General case' 0 C--N 1.311 -1.094 0 C-N-CA 123.022 0.529 . . . . 0.0 111.801 -178.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -61.27 -25.6 67.21 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 126.784 2.034 . . . . 0.0 113.591 -176.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.421 ' HE2' ' NH2' ' A' ' 35' ' ' ARG . 46.4 m-85 -84.33 -3.49 58.29 Favored 'General case' 0 N--CA 1.469 0.494 0 O-C-N 121.734 -0.604 . . . . 0.0 110.788 177.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 93.86 24.33 20.6 Favored Glycine 0 N--CA 1.436 -1.328 0 N-CA-C 109.118 -1.593 . . . . 0.0 109.118 -174.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.33 -171.32 2.05 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 114.474 -0.863 . . . . 0.0 109.119 177.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -112.79 144.64 18.02 Favored Glycine 0 N--CA 1.42 -2.403 0 N-CA-C 108.789 -1.724 . . . . 0.0 108.789 171.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 59.4 mt -101.64 110.48 22.48 Favored 'General case' 0 CA--C 1.491 -1.307 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 178.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.12 155.47 32.6 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 177.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . 0.302 54.2 p90 -110.06 140.84 43.68 Favored 'General case' 0 N--CA 1.424 -1.746 0 C-N-CA 119.241 -0.983 . . . . 0.0 112.456 176.205 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 34.4 mm -98.92 131.0 46.96 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 CA-C-N 115.551 -0.749 . . . . 0.0 112.695 -166.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.472 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 82.8 m-85 -107.66 127.67 53.87 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 168.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.15 99.4 9.02 Favored 'General case' 0 C--N 1.289 -2.05 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 176.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.51 ' OD1' ' HA ' ' A' ' 69' ' ' ALA . 6.2 p-10 45.01 41.72 5.68 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.09 1.356 . . . . 0.0 113.191 -178.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.95 -23.39 27.74 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.293 -0.867 . . . . 0.0 113.337 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -87.52 113.65 23.4 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' MET . . . . . 0.429 ' CE ' ' HB2' ' A' ' 101' ' ' GLU . 52.2 ttp -74.99 105.42 6.0 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 45.2 t -64.12 -29.82 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-O 121.679 0.752 . . . . 0.0 109.665 -175.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -61.08 -40.07 92.32 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.067 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.495 ' OE2' ' HD3' ' A' ' 105' ' ' ARG . 11.4 tp10 -64.94 -54.05 36.75 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 114.883 -1.053 . . . . 0.0 108.338 176.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -53.1 -48.38 67.84 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.112 -0.949 . . . . 0.0 113.129 -176.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 85.1 mt -59.87 -48.14 82.89 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 78.7 t -73.01 -35.06 47.57 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 CA-C-O 120.981 0.42 . . . . 0.0 110.292 -178.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.495 ' HD3' ' OE2' ' A' ' 101' ' ' GLU . 4.0 tpt180 -65.5 -41.05 93.65 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 123.388 0.675 . . . . 0.0 110.174 -178.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -83.99 -3.1 57.75 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.887 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.98 39.05 85.31 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 121.077 -0.582 . . . . 0.0 112.744 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 92.3 mt -102.17 4.4 39.43 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-O 121.938 0.875 . . . . 0.0 109.586 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -165.18 165.36 19.8 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 114.513 -1.221 . . . . 0.0 107.862 178.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.449 ' HZ3' ' CD ' ' A' ' 43' ' ' GLU . 83.1 mttt -111.53 165.75 11.73 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 174.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.447 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 78.1 t -76.76 136.46 24.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.631 177.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.65 149.47 23.51 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.976 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 55.5 t80 -71.75 146.99 47.77 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.046 -178.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 27.0 m -88.16 128.32 40.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-O 121.556 0.694 . . . . 0.0 110.918 -178.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -97.18 85.65 3.75 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -174.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.453 ' HB2' ' HB3' ' B' ' 130' ' ' PRO . 64.4 mmtt -127.61 109.15 20.74 Favored Pre-proline 0 C--N 1.299 -1.601 0 CA-C-N 113.698 -1.592 . . . . 0.0 109.093 173.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.443 ' C ' ' H ' ' A' ' 119' ' ' ASN . 74.4 Cg_endo -78.41 -149.07 0.03 OUTLIER 'Trans proline' 0 C--O 1.244 0.822 0 C-N-CA 122.74 2.293 . . . . 0.0 109.364 179.427 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -79.68 46.12 0.74 Allowed 'General case' 0 CA--C 1.559 1.318 0 CA-C-O 122.334 1.064 . . . . 0.0 109.73 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . 0.443 ' H ' ' C ' ' A' ' 117' ' ' PRO . 22.7 t-20 -84.56 -17.91 37.33 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 174.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.1 p -83.94 19.52 1.73 Allowed 'General case' 0 N--CA 1.431 -1.409 0 CA-C-N 113.352 -1.749 . . . . 0.0 109.901 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . 0.403 ' H ' ' C ' ' A' ' 119' ' ' ASN . 47.0 t-80 . . . . . 0 N--CA 1.44 -0.931 0 C-N-CA 124.895 1.278 . . . . 0.0 109.944 -176.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.497 -1.05 0 N-CA-C 110.382 -1.087 . . . . 0.0 110.382 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 27.0 m -72.45 -48.74 38.63 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 117.132 0.466 . . . . 0.0 110.648 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 27.4 m -89.92 153.47 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.707 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 177.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -76.44 139.6 40.94 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 176.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 24.1 p90 -70.56 -41.56 72.27 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 119.957 -0.697 . . . . 0.0 109.814 -177.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 46.4 t 61.6 118.17 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.346 0.454 0 C-N-CA 125.077 1.351 . . . . 0.0 111.438 -179.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -85.78 110.81 19.62 Favored 'General case' 0 N--CA 1.422 -1.83 0 C-N-CA 118.652 -1.219 . . . . 0.0 108.459 176.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -100.57 161.47 23.84 Favored Pre-proline 0 C--N 1.287 -2.109 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.356 -178.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . 0.453 ' HB3' ' HB2' ' A' ' 116' ' ' LYS . 79.0 Cg_exo -55.21 -159.65 0.01 OUTLIER 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 124.473 3.449 . . . . 0.0 115.309 178.476 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 131' ' ' ASN . . . . . 0.494 HD22 ' N ' ' A' ' 79' ' ' GLY . 2.1 m-20 -63.51 99.45 0.21 Allowed 'General case' 0 C--O 1.213 -0.836 0 CA-C-N 115.198 -0.91 . . . . 0.0 108.684 175.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.45 ' HA ' ' HB3' ' B' ' 135' ' ' GLU . 15.4 m120 -110.08 -8.61 14.78 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 173.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 133' ' ' THR . . . . . 0.427 ' HB ' ' OD2' ' A' ' 77' ' ' ASP . 0.2 OUTLIER -43.91 -61.34 1.48 Allowed 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 127.306 2.242 . . . . 0.0 112.092 -173.591 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -116.91 3.74 12.86 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-O 120.973 0.416 . . . . 0.0 111.359 176.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.537 ' OE2' ' HD2' ' B' ' 139' ' ' ARG . 2.4 tm-20 -69.15 -47.92 63.72 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.373 -178.527 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -63.84 -33.32 75.43 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.354 0.597 . . . . 0.0 110.516 176.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 78.8 mt -70.41 -50.57 37.19 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.729 -177.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.21 -33.6 75.71 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.713 0.292 . . . . 0.0 111.586 177.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 139' ' ' ARG . . . . . 0.537 ' HD2' ' OE2' ' B' ' 135' ' ' GLU . 84.2 mtt180 -66.81 -27.92 67.95 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 177.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 28.5 ttpp -71.37 -39.88 70.96 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 177.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 15.2 m -62.39 -45.66 92.15 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 114.832 -1.076 . . . . 0.0 109.249 175.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.502 ' HG3' ' CZ2' ' B' ' 153' ' ' TRP . 40.2 tt0 -59.44 -48.08 83.01 Favored 'General case' 0 C--O 1.204 -1.291 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.652 177.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -56.65 -40.97 76.42 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 122.693 0.397 . . . . 0.0 110.993 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -67.78 -47.37 69.34 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.04 178.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -64.15 -34.06 77.21 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.707 -178.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 146' ' ' LYS . . . . . 0.5 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 89.8 mttt -61.87 -46.88 87.48 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 177.248 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -69.85 -35.41 74.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.222 -177.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 59.7 mm-40 -74.36 -17.25 60.85 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.195 177.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt 57.03 56.51 5.25 Favored 'General case' 0 CA--C 1.514 -0.424 0 C-N-CA 124.785 1.234 . . . . 0.0 110.49 -178.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 91.8 mt -91.55 121.37 33.18 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.76 -176.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 51.24 -92.51 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 125.481 1.513 . . . . 0.0 113.898 178.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 24.5 mt -65.2 -33.98 67.37 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.899 0 CA-C-O 121.058 0.456 . . . . 0.0 110.979 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 153' ' ' TRP . . . . . 0.502 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 63.7 m95 -75.96 -6.09 49.31 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.573 0.701 . . . . 0.0 111.465 -177.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 42.3 t -92.72 16.31 12.57 Favored 'General case' 0 N--CA 1.425 -1.704 0 CA-C-N 115.433 -0.803 . . . . 0.0 108.916 174.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -63.03 -21.79 66.41 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.494 0.664 . . . . 0.0 110.11 174.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 . . . . . 0 N--CA 1.427 -1.592 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 176.989 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.295 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 33.2 m -143.51 110.04 5.48 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 29.4 m -147.25 138.17 23.69 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 177.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.1 m -149.58 -84.22 0.09 Allowed 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -145.77 20.61 1.47 Allowed 'General case' 0 CA--C 1.55 0.976 0 CA-C-O 121.662 0.744 . . . . 0.0 110.449 -174.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -150.47 163.34 38.67 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 178.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.417 ' CD1' HG21 ' B' ' 133' ' ' THR . 4.9 mp -117.59 -160.19 0.77 Allowed 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 177.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -91.95 139.53 30.56 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.277 0.56 . . . . 0.0 112.035 -176.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -116.13 159.62 21.5 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.042 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -134.71 159.8 70.81 Favored Pre-proline 0 C--N 1.3 -1.551 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 178.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -81.68 140.51 11.75 Favored 'Trans proline' 0 C--O 1.244 0.824 0 C-N-CA 123.007 2.472 . . . . 0.0 111.138 175.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -127.64 162.87 25.51 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.805 178.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.481 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 36.5 m -98.16 131.47 44.51 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.6 tp -84.28 122.19 28.55 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 -179.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 72.4 mt -93.0 -59.74 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.501 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -161.22 143.58 12.24 Favored 'General case' 0 N--CA 1.416 -2.128 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.055 -178.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -96.25 108.31 20.77 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 105.966 -1.864 . . . . 0.0 105.966 171.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 70.6 mt -81.85 -53.87 11.08 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.417 0 CA-C-O 121.345 0.593 . . . . 0.0 110.795 -173.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -128.55 -175.35 3.5 Favored 'General case' 0 C--N 1.295 -1.803 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 -179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -94.98 46.43 2.06 Favored Glycine 0 C--N 1.304 -1.218 0 N-CA-C 108.571 -1.812 . . . . 0.0 108.571 173.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.572 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 9.6 t70 -171.48 -52.74 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 105.926 -1.879 . . . . 0.0 105.926 -172.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 m -91.54 118.49 30.64 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 113.868 -1.514 . . . . 0.0 110.56 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.4 m -133.16 151.04 33.27 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.931 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 177.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -116.03 116.04 27.18 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 -177.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.9 mp -123.93 159.06 30.55 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.274 0.559 . . . . 0.0 111.028 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.481 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 57.2 ttp -120.67 111.83 18.12 Favored 'General case' 0 C--N 1.293 -1.862 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 175.127 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 44.1 p90 -106.93 110.34 22.46 Favored 'General case' 0 CA--C 1.485 -1.523 0 C-N-CA 119.163 -1.015 . . . . 0.0 110.748 -178.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 97.2 mttt 53.43 38.99 29.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.716 -178.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.495 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 95.26 2.18 62.25 Favored Glycine 0 N--CA 1.448 -0.535 0 CA-C-N 113.796 -1.547 . . . . 0.0 113.766 177.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.446 ' O ' ' HA ' ' A' ' 26' ' ' MET . 2.4 mp0 -100.48 97.56 6.69 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 117.0 0.4 . . . . 0.0 110.545 177.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.495 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 1.8 Cg_endo -83.39 105.51 1.27 Allowed 'Trans proline' 0 C--O 1.243 0.743 0 C-N-CA 122.964 2.443 . . . . 0.0 111.192 179.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 66.3 mtt -129.32 153.18 48.1 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.082 0.467 . . . . 0.0 110.385 -177.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.8 m -89.67 119.72 30.32 Favored 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 107.646 -1.242 . . . . 0.0 107.646 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -101.52 150.18 23.33 Favored 'General case' 0 C--N 1.282 -2.357 0 CA-C-O 121.654 0.74 . . . . 0.0 111.629 -176.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.603 ' HB2' ' NH1' ' A' ' 87' ' ' ARG . 9.7 mmt85 -127.43 127.07 43.51 Favored 'General case' 0 C--N 1.283 -2.295 0 N-CA-C 103.541 -2.763 . . . . 0.0 103.541 171.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 9.3 mt -68.72 133.08 47.89 Favored 'General case' 0 C--N 1.289 -2.038 0 O-C-N 123.709 0.631 . . . . 0.0 109.995 -173.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.4 mt -61.4 137.03 58.23 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.891 176.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 67.5 mt 73.92 14.35 4.02 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 124.391 1.057 . . . . 0.0 113.056 175.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 85.3 t -110.74 126.46 68.08 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.569 0 CA-C-O 121.109 0.48 . . . . 0.0 110.662 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -125.01 108.24 11.63 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 115.421 -0.808 . . . . 0.0 109.549 175.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 p -88.31 126.54 60.17 Favored Pre-proline 0 C--N 1.29 -1.985 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.935 176.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -78.53 -24.85 7.21 Favored 'Trans proline' 0 C--O 1.236 0.402 0 C-N-CA 121.988 1.792 . . . . 0.0 110.373 178.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -130.14 151.96 50.1 Favored 'General case' 0 N--CA 1.407 -2.582 0 CA-C-N 114.363 -1.29 . . . . 0.0 107.549 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.417 ' O ' HG13 ' A' ' 51' ' ' VAL . 6.9 t -145.92 164.49 31.84 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 -174.641 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -8.68 37.64 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -176.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -59.52 117.84 26.01 Favored Pre-proline 0 C--N 1.315 -0.916 0 C-N-CA 123.618 0.767 . . . . 0.0 110.478 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -62.68 156.33 53.61 Favored 'Trans proline' 0 C--O 1.247 0.954 0 C-N-CA 122.974 2.449 . . . . 0.0 112.467 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.479 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 5.5 mmpt? 82.26 2.16 1.3 Allowed 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 125.41 1.484 . . . . 0.0 113.102 179.155 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.438 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 8.7 mmpt? -95.15 -7.6 38.77 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.207 178.211 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 59.0 47.72 89.41 Favored Glycine 0 N--CA 1.469 0.836 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.287 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.417 HG13 ' O ' ' A' ' 44' ' ' THR . 27.0 m -80.77 65.48 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 CA-C-O 122.933 1.349 . . . . 0.0 112.214 -174.41 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -92.57 -15.68 26.64 Favored 'General case' 0 C--N 1.29 -2.011 0 CA-C-N 114.462 -1.244 . . . . 0.0 112.528 -176.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.475 ' HE2' ' HA ' ' A' ' 53' ' ' LYS . 7.2 mmpt? -87.72 -66.49 0.91 Allowed 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 113.475 0.916 . . . . 0.0 113.475 -169.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -121.05 -18.03 7.62 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.326 -171.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -48.8 -58.6 7.46 Favored Glycine 0 CA--C 1.538 1.492 0 CA-C-O 119.077 -0.846 . . . . 0.0 114.844 -178.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -60.09 -38.99 73.65 Favored 'Trans proline' 0 C--N 1.366 1.462 0 C-N-CA 122.65 2.233 . . . . 0.0 112.663 -179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -62.43 -47.9 82.03 Favored 'General case' 0 C--O 1.245 0.868 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.624 -177.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.93 -43.79 87.05 Favored 'General case' 0 C--O 1.242 0.709 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.772 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.7 p -64.8 -46.07 83.6 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -67.86 -36.04 79.6 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 120.589 0.233 . . . . 0.0 111.421 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -61.49 -47.37 85.93 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.076 178.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.45 ' O ' HG22 ' A' ' 66' ' ' VAL . 40.8 m -60.47 -44.93 95.39 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.688 -178.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -59.22 -49.79 76.51 Favored 'General case' 0 C--N 1.345 0.402 0 O-C-N 123.23 0.331 . . . . 0.0 110.468 178.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -55.42 -44.48 76.29 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.986 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.9 mmt -71.02 -38.38 72.6 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -177.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.45 HG22 ' O ' ' A' ' 62' ' ' THR . 35.3 m -80.67 -31.83 12.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 -178.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -76.09 -27.71 57.28 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 121.4 0.619 . . . . 0.0 110.36 177.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -67.42 -31.39 71.56 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.905 176.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.512 ' HA ' ' OD2' ' A' ' 95' ' ' ASP . . . -69.89 131.31 44.25 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.737 -177.031 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -78.95 -41.34 29.56 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 171.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.3 mtmt -113.96 131.42 56.33 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 114.832 -1.076 . . . . 0.0 108.664 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 3.9 mp -111.43 117.92 56.24 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.364 0 N-CA-C 105.221 -2.14 . . . . 0.0 105.221 174.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.502 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 23.2 mt-10 -112.75 140.01 47.89 Favored 'General case' 0 C--N 1.295 -1.776 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.875 -172.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.467 HG11 ' CD1' ' A' ' 92' ' ' ILE . 10.1 m -116.38 117.66 56.23 Favored 'Isoleucine or valine' 0 C--O 1.25 1.092 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.398 178.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -109.14 143.5 38.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.842 0.353 . . . . 0.0 111.188 -176.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.405 ' O ' ' HB2' ' A' ' 7' ' ' LEU . 47.0 t80 -94.14 147.81 22.79 Favored 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 124.7 1.2 . . . . 0.0 110.31 -176.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.73 ' OD1' ' HA ' ' B' ' 131' ' ' ASN . 11.8 t70 -116.29 -175.81 2.82 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 176.441 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.52 -26.73 68.03 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.409 0.684 . . . . 0.0 112.16 -175.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -72.64 -115.43 0.06 OUTLIER Glycine 0 N--CA 1.445 -0.719 0 CA-C-N 115.888 -0.596 . . . . 0.0 113.436 -177.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -124.64 165.09 18.51 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 122.28 -0.541 . . . . 0.0 109.761 -178.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 44.2 ttt85 -104.65 -13.18 16.04 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-O 121.783 0.801 . . . . 0.0 108.987 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.8 p -133.07 133.29 42.8 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.176 178.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 48.4 t0 -87.85 144.87 26.35 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 179.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -68.33 -16.71 64.04 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 121.395 0.617 . . . . 0.0 109.946 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -65.36 -30.31 71.12 Favored 'General case' 0 C--O 1.221 -0.429 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 173.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 105.21 49.65 0.98 Allowed Glycine 0 N--CA 1.437 -1.252 0 CA-C-N 115.718 -0.673 . . . . 0.0 111.506 -178.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.603 ' NH1' ' HB2' ' A' ' 35' ' ' ARG . 0.8 OUTLIER -151.25 160.37 43.86 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.521 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -80.82 144.89 25.54 Favored Glycine 0 C--N 1.305 -1.185 0 C-N-CA 121.031 -0.604 . . . . 0.0 113.281 -177.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.0 mt -117.48 97.9 6.12 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.172 -1.048 . . . . 0.0 108.172 177.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.63 161.64 39.89 Favored 'General case' 0 C--N 1.313 -0.999 0 C-N-CA 120.223 -0.591 . . . . 0.0 111.414 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -88.86 127.4 35.63 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 105.951 -1.87 . . . . 0.0 105.951 170.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.467 ' CD1' HG11 ' A' ' 74' ' ' VAL . 45.7 mm -99.55 123.75 52.48 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.072 -179.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.502 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 77.5 m-85 -109.18 132.51 54.05 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 175.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.461 ' HB3' ' HB2' ' A' ' 69' ' ' ALA . . . -105.35 100.54 10.11 Favored 'General case' 0 C--N 1.285 -2.234 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 176.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.512 ' OD2' ' HA ' ' A' ' 69' ' ' ALA . 3.0 p30 46.32 29.97 0.95 Allowed 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 124.928 1.291 . . . . 0.0 113.472 -174.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.44 -9.8 38.67 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.852 -0.613 . . . . 0.0 113.435 -179.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -83.53 121.87 27.79 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 175.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 34.2 ttp -80.68 99.47 8.2 Favored 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 179.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 48.7 t -58.36 -43.62 86.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 114.781 -1.1 . . . . 0.0 112.795 -169.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -66.5 -31.4 72.1 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.499 -176.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -77.61 -40.64 41.35 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.94 -39.25 77.58 Favored 'General case' 0 C--O 1.222 -0.351 0 O-C-N 123.741 0.651 . . . . 0.0 110.737 179.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.17 -44.66 94.83 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.915 177.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 95.0 t -70.26 -47.57 66.19 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.302 -178.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 11.5 ttp85 -60.45 -37.82 82.2 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 177.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -82.3 0.93 39.31 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-O 120.678 0.275 . . . . 0.0 111.575 177.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.85 38.06 93.95 Favored Glycine 0 C--O 1.221 -0.712 0 CA-C-N 116.276 -0.42 . . . . 0.0 113.688 177.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.4 mt -100.62 -13.66 18.48 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.377 0.608 . . . . 0.0 110.22 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -152.13 160.19 43.47 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -105.56 164.15 12.11 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 106.759 -1.571 . . . . 0.0 106.759 177.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.46 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 82.5 t -71.38 128.39 34.44 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.507 177.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.48 146.38 25.22 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 176.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -80.14 149.37 30.59 Favored 'General case' 0 C--N 1.289 -2.039 0 CA-C-O 121.383 0.611 . . . . 0.0 111.692 -172.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 71.6 t -87.61 119.03 34.55 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.611 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.906 -173.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -80.27 137.74 36.67 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 115.356 -0.838 . . . . 0.0 108.859 176.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -84.07 126.38 70.21 Favored Pre-proline 0 C--N 1.292 -1.899 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -172.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -87.02 -163.76 0.18 Allowed 'Trans proline' 0 N--CA 1.444 -1.403 0 C-N-CA 122.572 2.181 . . . . 0.0 106.903 167.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -108.22 -57.36 2.13 Favored 'General case' 0 C--N 1.288 -2.068 0 C-N-CA 118.839 -1.144 . . . . 0.0 110.201 177.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 61.85 76.95 0.35 Allowed 'General case' 0 C--O 1.25 1.105 0 CA-C-O 122.818 1.294 . . . . 0.0 110.166 -176.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.1 m -69.29 95.64 0.79 Allowed 'General case' 0 N--CA 1.422 -1.871 0 CA-C-N 112.737 -2.029 . . . . 0.0 111.599 -174.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 9.7 t-80 . . . . . 0 C--O 1.246 0.874 0 C-N-CA 125.37 1.468 . . . . 0.0 107.37 174.716 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.686 0 N-CA-C 111.17 -0.772 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 61.8 p 51.88 -89.1 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.136 1.774 . . . . 0.0 114.178 179.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 22.3 m -82.53 -32.24 10.18 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.679 0 CA-C-O 120.777 0.322 . . . . 0.0 111.112 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -106.38 94.87 5.38 Favored 'General case' 0 N--CA 1.428 -1.53 0 CA-C-O 121.205 0.526 . . . . 0.0 109.969 -177.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.6 p90 -143.65 15.54 1.79 Allowed 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 177.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 18.9 m -64.82 122.16 15.2 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.089 0 N-CA-C 115.019 1.488 . . . . 0.0 115.019 -169.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.27 99.07 8.42 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.134 170.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -65.34 -35.62 12.67 Favored Pre-proline 0 C--N 1.296 -1.759 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -58.53 -176.04 0.08 OUTLIER 'Trans proline' 0 C--N 1.384 2.398 0 C-N-CA 122.028 1.819 . . . . 0.0 114.898 176.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 131' ' ' ASN . . . . . 0.73 ' HA ' ' OD1' ' A' ' 77' ' ' ASP . 15.6 m120 -64.45 118.16 8.35 Favored 'General case' 0 CA--C 1.5 -0.979 0 CA-C-N 114.958 -1.019 . . . . 0.0 110.612 -178.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.445 ' HA ' ' CB ' ' B' ' 135' ' ' GLU . 2.3 p-10 -152.01 -2.84 0.28 Allowed 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -179.03 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 133' ' ' THR . . . . . 0.417 HG21 ' CD1' ' A' ' 7' ' ' LEU . 69.3 p -60.63 -48.75 80.38 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -170.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -112.01 5.03 18.49 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.445 ' CB ' ' HA ' ' B' ' 132' ' ' ASN . 0.9 OUTLIER -65.3 -38.7 91.02 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.988 -1.005 . . . . 0.0 109.689 -175.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -61.79 -33.92 74.96 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.981 178.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 88.4 mt -66.12 -46.43 77.57 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.618 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 7.8 mp -65.98 -29.13 69.46 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.367 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -61.85 -41.41 97.79 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.334 0.587 . . . . 0.0 109.866 175.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -70.65 -39.73 73.46 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.32 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 50.3 m -63.88 -46.18 86.05 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.487 177.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.549 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 41.7 tt0 -61.73 -50.75 71.18 Favored 'General case' 0 C--O 1.204 -1.326 0 O-C-N 123.469 0.481 . . . . 0.0 109.825 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.15 -38.15 73.12 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 123.48 0.488 . . . . 0.0 111.243 -179.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 144' ' ' GLN . . . . . 0.49 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 14.6 tt0 -66.47 -48.81 68.72 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -65.34 -33.61 76.39 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.483 -176.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 146' ' ' LYS . . . . . 0.549 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 88.1 mttt -59.33 -51.33 70.38 Favored 'General case' 0 C--N 1.345 0.409 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 176.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -69.7 -34.41 73.88 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.375 -0.83 . . . . 0.0 112.052 -177.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 57.6 mm-40 -74.08 -18.63 60.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.644 177.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 23.4 mtpp 59.28 48.17 10.55 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 125.234 1.414 . . . . 0.0 110.437 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 99.4 mt -84.45 119.99 25.78 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.233 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 53.9 -93.43 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.229 0 O-C-N 124.781 1.3 . . . . 0.0 112.6 176.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 152' ' ' ILE . . . . . 0.512 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 29.5 mt -60.34 -43.8 94.5 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.654 0 C-N-CA 122.121 0.168 . . . . 0.0 111.331 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -71.48 -4.03 24.36 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.987 0.899 . . . . 0.0 112.774 -172.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 27.9 t -80.35 -5.23 56.05 Favored 'General case' 0 C--N 1.291 -1.942 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.45 171.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 21.4 pt-20 -69.93 -25.08 63.49 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 121.543 0.687 . . . . 0.0 109.704 175.36 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.5 t70 . . . . . 0 C--N 1.309 -1.166 0 CA-C-N 114.843 -1.072 . . . . 0.0 109.654 -178.175 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.453 0 CA-C-O 121.052 0.453 . . . . 0.0 110.235 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.407 HG21 HG22 ' A' ' 4' ' ' THR . 14.2 m -80.63 104.24 11.02 Favored 'General case' 0 N--CA 1.432 -1.338 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.7 m -84.5 76.29 10.18 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-O 121.944 0.878 . . . . 0.0 113.037 -174.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.407 HG22 HG21 ' A' ' 2' ' ' THR . 5.7 t -158.26 71.46 0.58 Allowed 'General case' 0 N--CA 1.415 -2.187 0 CA-C-O 122.785 1.279 . . . . 0.0 110.429 174.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.477 ' HE2' ' HA ' ' A' ' 5' ' ' LYS . 7.0 mmpt? -107.02 19.08 20.95 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 172.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -155.0 159.56 40.42 Favored 'General case' 0 N--CA 1.413 -2.322 0 N-CA-C 102.408 -3.182 . . . . 0.0 102.408 177.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 91.0 mt -95.62 173.48 7.46 Favored 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 119.967 -0.693 . . . . 0.0 112.214 -176.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 45.3 m80 -79.3 104.01 9.63 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.87 -178.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.7 ttmt -105.14 127.1 52.75 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 172.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -114.0 149.35 41.76 Favored Pre-proline 0 C--N 1.296 -1.749 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 173.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -80.16 141.1 14.41 Favored 'Trans proline' 0 C--N 1.311 -1.408 0 C-N-CA 121.928 1.752 . . . . 0.0 110.399 174.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.406 ' HB1' ' HB3' ' A' ' 25' ' ' LEU . . . -136.19 155.98 49.35 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 121.103 0.477 . . . . 0.0 112.156 -178.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 72.7 m -111.86 140.76 46.25 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 176.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.431 ' HB2' ' CD1' ' A' ' 72' ' ' ILE . 52.3 tp -83.14 125.48 31.56 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 118.312 0.505 . . . . 0.0 110.424 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 44.5 mm -89.18 -53.18 9.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 174.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -164.36 145.83 8.44 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -105.99 119.44 39.19 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 49.5 mm -90.56 -55.77 5.88 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -177.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.416 ' HB2' ' H ' ' A' ' 22' ' ' THR . 32.4 m-20 -125.83 -166.56 1.58 Allowed 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -85.2 -13.61 70.88 Favored Glycine 0 C--O 1.21 -1.397 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 173.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.542 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 0.4 OUTLIER -101.29 -54.03 2.87 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 122.485 1.136 . . . . 0.0 108.099 -178.864 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.416 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 6.8 m -82.49 105.81 13.85 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 114.268 -1.333 . . . . 0.0 111.334 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.3 m -129.27 137.27 57.46 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.609 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 177.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.469 ' HA ' ' HA ' ' A' ' 33' ' ' THR . 46.6 tttp -101.19 119.1 38.24 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.61 -0.682 . . . . 0.0 110.144 -176.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.406 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 3.3 mm? -116.25 146.73 42.13 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 121.453 0.644 . . . . 0.0 110.765 -177.464 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.485 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 26.5 ttt -107.01 108.59 20.17 Favored 'General case' 0 C--N 1.286 -2.17 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 175.019 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 10.8 p90 -115.55 116.88 28.91 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 -177.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 99.3 mttt 57.51 32.59 22.04 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 124.131 0.895 . . . . 0.0 110.921 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.96 3.76 61.87 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 114.738 -1.119 . . . . 0.0 114.142 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.485 ' O ' ' HA ' ' A' ' 26' ' ' MET . 20.3 mt-30 -107.53 103.86 50.53 Favored Pre-proline 0 C--N 1.311 -1.08 0 O-C-N 122.401 -0.47 . . . . 0.0 111.224 -179.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -80.85 95.26 0.97 Allowed 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 122.757 2.304 . . . . 0.0 111.268 177.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 26.5 mmt -119.78 145.49 46.53 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.745 -176.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.469 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 11.4 m -86.52 118.76 26.15 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -109.21 162.07 14.64 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 123.551 0.74 . . . . 0.0 111.071 -176.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.542 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 20.7 mtp180 -133.23 142.6 48.65 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 169.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.6 mp -61.48 119.55 8.8 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -175.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.1 mt -55.36 128.08 32.52 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.767 176.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.0 mt 68.17 23.2 8.0 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 124.829 1.331 . . . . 0.0 112.211 174.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.523 ' O ' ' HB ' ' A' ' 44' ' ' THR . 90.6 t -128.75 131.53 68.42 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.155 0 O-C-N 122.101 -0.374 . . . . 0.0 110.301 -179.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -107.33 106.87 17.51 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 105.634 -1.987 . . . . 0.0 105.634 168.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.601 ' HB ' ' CD ' ' A' ' 42' ' ' PRO . 11.5 m -83.23 -77.82 0.04 OUTLIER Pre-proline 0 CA--C 1.567 1.612 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 175.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.601 ' CD ' ' HB ' ' A' ' 41' ' ' THR . 38.0 Cg_endo -80.26 -27.65 3.46 Favored 'Trans proline' 0 C--N 1.39 2.711 0 N-CA-C 107.588 -1.735 . . . . 0.0 107.588 164.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.404 ' OE2' ' HG2' ' A' ' 42' ' ' PRO . 0.1 OUTLIER 174.15 173.79 0.18 Allowed 'General case' 0 N--CA 1.423 -1.781 0 C-N-CA 128.262 2.625 . . . . 0.0 104.033 177.486 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.523 ' HB ' ' O ' ' A' ' 39' ' ' VAL . 12.0 t -110.14 -51.97 2.82 Favored 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 119.579 -0.848 . . . . 0.0 108.785 167.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -98.52 -51.82 3.82 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 175.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -148.19 135.38 10.49 Favored Pre-proline 0 C--N 1.314 -0.942 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 -178.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -61.79 119.9 7.25 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.382 2.054 . . . . 0.0 111.543 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -88.53 -50.32 6.36 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.025 -176.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.493 ' NZ ' ' HA ' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -113.81 -28.51 7.39 Favored 'General case' 0 CA--C 1.49 -1.352 0 C-N-CA 120.315 -0.554 . . . . 0.0 111.978 174.804 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 97.21 108.12 2.56 Favored Glycine 0 N--CA 1.414 -2.797 0 N-CA-C 109.921 -1.272 . . . . 0.0 109.921 -175.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.429 ' HB ' ' HA ' ' A' ' 42' ' ' PRO . 27.3 t -97.84 30.53 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.175 0 CA-C-O 123.655 1.693 . . . . 0.0 106.638 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -40.9 -43.62 2.12 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 128.686 2.794 . . . . 0.0 113.296 -178.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.5 mtmm -86.88 -22.87 25.47 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -175.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -104.16 -24.66 13.14 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.769 -0.372 . . . . 0.0 111.952 -173.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.448 ' N ' ' HD2' ' A' ' 56' ' ' PRO . . . -47.97 -51.78 18.26 Favored Glycine 0 CA--C 1.534 1.254 0 O-C-N 123.9 0.75 . . . . 0.0 113.322 177.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.448 ' HD2' ' N ' ' A' ' 55' ' ' GLY . 4.7 Cg_endo -49.64 -34.31 34.3 Favored 'Trans proline' 0 CA--C 1.553 1.427 0 C-N-CA 123.44 2.76 . . . . 0.0 114.016 175.628 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -83.39 -39.4 20.7 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 121.864 -0.523 . . . . 0.0 110.921 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.95 -40.25 94.74 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.929 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.425 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 9.0 p -65.33 -43.53 90.65 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.461 179.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.408 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -58.92 -47.38 85.24 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 123.614 0.571 . . . . 0.0 109.885 177.57 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -57.26 -49.83 74.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.14 178.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 36.8 m -59.94 -50.83 72.2 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.827 -177.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.486 ' HE3' ' OE1' ' A' ' 67' ' ' GLU 0.339 0.1 OUTLIER -64.38 -38.23 90.3 Favored 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -179.482 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.418 ' N ' ' HD3' ' A' ' 63' ' ' LYS . 28.9 mtpp -66.45 -40.67 89.55 Favored 'General case' 0 N--CA 1.436 -1.169 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 177.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 14.7 tpt -62.68 -45.85 90.87 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.266 -178.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.8 m -80.71 -31.44 12.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -176.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.486 ' OE1' ' HE3' ' A' ' 63' ' ' LYS . 45.1 mt-10 -77.66 -33.42 53.41 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.146 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -78.1 -20.81 51.46 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.22 147.74 51.68 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.793 179.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -71.12 -61.34 1.8 Allowed 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.853 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.0 mtmm -125.55 150.91 47.04 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 178.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.431 ' CD1' ' HB2' ' A' ' 14' ' ' LEU . 69.2 mt -105.58 134.26 47.6 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.231 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 175.009 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.491 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 1.5 mm-40 -111.92 133.24 54.24 Favored 'General case' 0 N--CA 1.424 -1.771 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -178.177 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 31.4 m -111.52 118.19 56.91 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 174.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -114.22 137.33 51.91 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.153 0.501 . . . . 0.0 109.756 -178.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -106.86 138.99 41.99 Favored 'General case' 0 C--N 1.282 -2.338 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.176 -178.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.555 ' HB3' ' OD1' ' B' ' 131' ' ' ASN . 6.0 t70 -86.51 -174.27 4.92 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -179.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -76.31 -2.5 31.9 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -176.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.59 -119.25 1.15 Allowed Glycine 0 N--CA 1.442 -0.927 0 C-N-CA 121.576 -0.345 . . . . 0.0 112.857 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 70.6 mm-40 -99.75 164.04 12.21 Favored 'General case' 0 C--N 1.293 -1.869 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -175.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -108.89 -37.96 5.72 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.6 p -141.14 150.18 42.47 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.363 -0.835 . . . . 0.0 108.827 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -100.89 155.88 17.7 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -57.83 -28.51 64.16 Favored 'General case' 0 C--O 1.247 0.946 0 C-N-CA 125.496 1.519 . . . . 0.0 111.722 -178.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -66.5 -19.41 65.78 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.495 -177.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 92.01 64.33 1.14 Allowed Glycine 0 CA--C 1.487 -1.684 0 N-CA-C 108.434 -1.866 . . . . 0.0 108.434 -176.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.409 ' HD3' ' O ' ' A' ' 33' ' ' THR . 3.3 tpp180 -161.46 127.55 3.77 Favored 'General case' 0 N--CA 1.415 -2.176 0 N-CA-C 106.759 -1.571 . . . . 0.0 106.759 -175.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -78.66 151.58 36.11 Favored Glycine 0 N--CA 1.428 -1.867 0 N-CA-C 111.209 -0.757 . . . . 0.0 111.209 -179.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 85.6 mt -119.94 105.04 10.68 Favored 'General case' 0 C--N 1.288 -2.093 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -138.76 152.48 47.98 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-O 121.279 0.561 . . . . 0.0 111.689 -176.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -95.21 123.57 38.79 Favored 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 105.078 -2.193 . . . . 0.0 105.078 175.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 47.4 mm -99.27 129.06 50.29 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-O 121.452 0.644 . . . . 0.0 112.131 -171.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.491 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 26.1 m-85 -114.83 142.94 45.87 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 172.292 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.38 98.85 8.49 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 175.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.4 t70 45.71 40.04 5.79 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.179 1.392 . . . . 0.0 110.544 -173.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.69 -22.07 31.02 Favored Glycine 0 N--CA 1.444 -0.811 0 CA-C-N 115.182 -0.917 . . . . 0.0 114.509 178.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -80.83 132.98 35.52 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 117.975 0.888 . . . . 0.0 110.772 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 51.9 mtm -77.78 100.86 6.45 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -175.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 57.9 t -66.83 -48.02 81.02 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.618 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -56.63 -44.75 81.54 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.659 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -68.2 -42.53 79.74 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.3 -179.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.74 -45.13 86.26 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.066 0.546 . . . . 0.0 111.407 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 89.3 mt -57.82 -50.25 73.91 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.95 0.405 . . . . 0.0 111.297 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.6 t -69.89 -36.55 69.77 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.778 -178.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 14.3 tpp85 -62.69 -37.93 88.4 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.96 0.904 . . . . 0.0 111.18 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -91.07 3.9 53.54 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.976 -177.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.1 36.21 92.69 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 121.278 -0.487 . . . . 0.0 112.16 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 97.8 mt -102.28 -11.36 18.77 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 120.896 0.379 . . . . 0.0 110.031 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -153.19 161.13 42.77 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -107.15 152.4 24.11 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 177.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.3 p -82.88 130.17 36.19 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.439 0 CA-C-O 121.106 0.479 . . . . 0.0 109.932 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -89.78 120.97 31.49 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.551 ' HB2' ' CE2' ' A' ' 115' ' ' TYR . 35.2 p90 -86.95 127.21 35.08 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.349 0.595 . . . . 0.0 112.178 -177.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 83.2 t -134.67 120.06 30.71 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 N-CA-C 105.596 -2.001 . . . . 0.0 105.596 175.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.551 ' CE2' ' HB2' ' A' ' 113' ' ' TYR . 92.4 m-85 -122.26 -70.87 0.76 Allowed 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 120.162 -0.615 . . . . 0.0 112.398 -177.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.72 149.4 36.37 Favored Pre-proline 0 N--CA 1.415 -2.208 0 O-C-N 123.923 0.764 . . . . 0.0 111.812 -173.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.423 ' HB3' ' HA ' ' B' ' 129' ' ' LYS . 42.5 Cg_endo -84.77 22.32 0.96 Allowed 'Trans proline' 0 N--CA 1.483 0.907 0 C-N-CA 124.223 3.282 . . . . 0.0 113.294 -171.092 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 5.6 t30 66.97 -73.46 0.08 Allowed 'General case' 0 C--N 1.297 -1.694 0 C-N-CA 126.578 1.951 . . . . 0.0 112.125 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -103.95 -20.85 13.74 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -176.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.4 m -78.97 35.55 0.26 Allowed 'General case' 0 CA--C 1.568 1.636 0 CA-C-O 121.624 0.726 . . . . 0.0 112.172 -174.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 . . . . . 0 C--N 1.31 -1.11 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 178.54 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.318 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 18.9 m -68.51 148.76 50.11 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 48.5 t -79.88 101.11 4.78 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.035 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -149.88 150.52 32.04 Favored 'General case' 0 C--N 1.289 -2.059 0 CA-C-N 115.147 -0.933 . . . . 0.0 108.536 -177.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -137.43 139.69 40.82 Favored 'General case' 0 C--N 1.293 -1.852 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 18.9 m -76.66 84.15 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.159 0 CA-C-O 121.981 0.896 . . . . 0.0 112.093 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -66.9 -33.37 75.44 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.573 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.423 ' HA ' ' HB3' ' A' ' 117' ' ' PRO . 57.9 mtmt 71.31 156.05 0.16 Allowed Pre-proline 0 N--CA 1.473 0.698 0 C-N-CA 124.712 1.205 . . . . 0.0 110.736 -174.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -55.57 102.9 0.1 OUTLIER 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.159 1.906 . . . . 0.0 111.596 175.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 131' ' ' ASN . . . . . 0.555 ' OD1' ' HB3' ' A' ' 77' ' ' ASP . 5.0 t30 -113.97 80.35 1.37 Allowed 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 106.268 -1.753 . . . . 0.0 106.268 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.439 HD22 ' HA ' ' A' ' 115' ' ' TYR . 6.8 m120 -129.82 0.63 4.85 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 120.126 -0.63 . . . . 0.0 112.045 -169.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 1.5 m -70.34 -9.65 56.77 Favored 'General case' 0 CA--C 1.56 1.361 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -168.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 72.9 m80 -126.84 4.79 6.62 Favored 'General case' 0 C--N 1.315 -0.912 0 O-C-N 121.47 -0.769 . . . . 0.0 110.042 175.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' B' ' 139' ' ' ARG . 13.0 tm-20 -67.27 -47.48 70.54 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.411 -172.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 2.9 tm0? -72.51 -33.6 67.03 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -176.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 72.4 mt -57.6 -49.68 75.61 Favored 'General case' 0 C--O 1.254 1.338 0 CA-C-O 121.824 0.821 . . . . 0.0 109.256 177.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 11.2 mp -69.14 -28.89 66.85 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.591 177.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 139' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' B' ' 135' ' ' GLU . 31.2 mmt180 -60.8 -42.76 98.27 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.443 0.535 . . . . 0.0 112.443 176.287 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -64.08 -35.29 80.28 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.639 0.733 . . . . 0.0 110.028 178.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.3 m -70.12 -43.17 71.54 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.149 178.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.614 ' O ' ' HG2' ' B' ' 146' ' ' LYS . 34.5 tt0 -60.47 -45.29 94.26 Favored 'General case' 0 C--O 1.22 -0.467 0 O-C-N 123.862 0.726 . . . . 0.0 109.677 177.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.75 -46.26 77.89 Favored 'General case' 0 CA--C 1.514 -0.419 0 O-C-N 124.007 0.817 . . . . 0.0 111.41 -177.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -70.51 -41.7 72.28 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.454 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -62.87 -39.98 96.12 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.709 -179.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 146' ' ' LYS . . . . . 0.614 ' HG2' ' O ' ' B' ' 142' ' ' GLU . 18.4 ptpt -73.28 -35.69 66.2 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 176.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -59.77 -47.58 85.12 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 122.023 0.916 . . . . 0.0 109.599 176.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -89.33 -3.2 58.57 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 113.88 -1.509 . . . . 0.0 112.123 -173.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' B' ' 154' ' ' SER . 34.1 mmtp 54.24 47.54 22.87 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.048 0.939 . . . . 0.0 111.113 178.132 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 90.5 mt -78.96 117.64 20.22 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.201 -176.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 48.7 -89.8 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.303 1.841 . . . . 0.0 113.646 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 41.6 mt -59.38 -49.18 84.49 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.989 0 C-N-CA 122.988 0.515 . . . . 0.0 111.764 -177.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -69.33 -10.41 57.75 Favored 'General case' 0 CA--C 1.495 -1.139 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -171.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 154' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 23.0 t -72.52 2.33 6.54 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.037 174.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -60.5 -32.86 71.85 Favored 'General case' 0 C--N 1.355 0.809 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 168.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.6 t70 . . . . . 0 C--O 1.24 0.566 0 C-N-CA 125.593 1.557 . . . . 0.0 111.241 178.05 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.409 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.3 m -61.42 -24.41 66.5 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 123.851 0.86 . . . . 0.0 110.55 176.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.2 m -128.18 164.66 22.01 Favored 'General case' 0 N--CA 1.427 -1.615 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 175.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 20.7 m -58.6 -40.95 84.68 Favored 'General case' 0 C--O 1.25 1.118 0 CA-C-O 121.363 0.601 . . . . 0.0 111.005 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.413 ' NZ ' ' HB3' ' A' ' 5' ' ' LYS . 2.0 ttpm? -132.79 91.45 2.9 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.51 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -140.31 74.25 1.46 Allowed 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 175.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -126.31 -167.59 1.74 Allowed 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 114.284 -1.326 . . . . 0.0 108.816 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -115.95 113.86 23.86 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -110.24 150.97 27.92 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-O 121.317 0.579 . . . . 0.0 110.481 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -138.86 143.97 39.58 Favored Pre-proline 0 C--N 1.277 -2.558 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.823 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_exo -73.75 138.81 26.9 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.788 2.326 . . . . 0.0 113.625 -177.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.404 ' O ' ' HB ' ' A' ' 72' ' ' ILE . . . -125.68 153.94 43.13 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.191 -178.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.402 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 42.8 m -105.34 135.5 46.59 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 177.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.1 tp -80.35 137.9 36.62 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 118.143 0.429 . . . . 0.0 110.711 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 72.6 mt -107.11 -49.81 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 172.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -161.67 138.01 8.11 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.289 -177.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -101.93 107.46 18.62 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 174.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 56.3 mt -89.5 -52.64 10.52 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-O 120.778 0.323 . . . . 0.0 111.367 -173.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.461 ' HA ' ' HB3' ' A' ' 59' ' ' SER . 28.1 m-20 -138.15 -176.22 4.37 Favored 'General case' 0 CA--C 1.499 -0.997 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -178.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -92.95 54.38 2.58 Favored Glycine 0 CA--C 1.489 -1.543 0 N-CA-C 107.348 -2.301 . . . . 0.0 107.348 178.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -177.59 -54.67 0.01 OUTLIER 'General case' 0 CA--C 1.486 -1.502 0 C-N-CA 125.271 1.428 . . . . 0.0 107.222 -171.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.665 ' HA ' ' O ' ' A' ' 34' ' ' PHE . 1.9 m -101.88 113.06 25.94 Favored 'General case' 0 N--CA 1.407 -2.597 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.465 -173.147 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 35.4 m -124.71 167.05 19.27 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.803 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 173.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -121.47 114.13 20.82 Favored 'General case' 0 C--N 1.27 -2.855 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 176.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.465 ' O ' ' HA ' ' A' ' 31' ' ' PRO . 2.4 pp -136.11 159.41 41.8 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -176.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.412 ' HA ' ' HA ' ' A' ' 31' ' ' PRO . 47.4 ttm -117.51 114.98 24.25 Favored 'General case' 0 C--N 1.295 -1.775 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.536 -176.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -119.14 126.71 52.25 Favored 'General case' 0 C--N 1.281 -2.392 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 176.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt 59.97 27.21 16.56 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 123.804 0.69 . . . . 0.0 110.67 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.46 9.11 82.24 Favored Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.9 -178.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -111.7 102.2 52.91 Favored Pre-proline 0 C--N 1.312 -1.043 0 O-C-N 122.57 -0.37 . . . . 0.0 110.411 178.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.465 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 4.9 Cg_exo -81.47 134.77 8.99 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.379 2.72 . . . . 0.0 111.834 178.168 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 48.1 mtt -140.83 156.09 46.21 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 178.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 85.4 m -85.13 118.29 24.6 Favored 'General case' 0 N--CA 1.423 -1.819 0 N-CA-C 103.047 -2.946 . . . . 0.0 103.047 170.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.665 ' O ' ' HA ' ' A' ' 22' ' ' THR . 34.0 t80 -112.22 151.78 29.18 Favored 'General case' 0 C--N 1.271 -2.83 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -162.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.1 mmt180 -117.76 131.57 56.58 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 127.494 2.317 . . . . 0.0 106.186 172.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.441 ' HB2' ' CG2' ' A' ' 39' ' ' VAL . 32.6 mt -80.75 140.16 35.68 Favored 'General case' 0 C--N 1.289 -2.024 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 177.494 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.43 ' HG ' ' C ' ' A' ' 90' ' ' ALA . 41.2 mt -65.68 133.45 51.12 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 178.061 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.517 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 2.9 mp 66.44 48.92 1.46 Allowed 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 125.674 1.59 . . . . 0.0 111.821 177.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.441 ' CG2' ' HB2' ' A' ' 36' ' ' LEU . 96.4 t -122.73 125.29 72.24 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.063 0 CA-C-O 121.035 0.445 . . . . 0.0 110.461 177.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.487 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 12.2 t70 -102.25 107.13 18.07 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.702 -1.222 . . . . 0.0 107.702 175.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.448 ' H ' ' CD ' ' A' ' 42' ' ' PRO . 30.0 p -121.08 -33.4 0.05 OUTLIER Pre-proline 0 C--N 1.307 -1.249 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.267 172.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.448 ' CD ' ' H ' ' A' ' 41' ' ' THR . 42.8 Cg_exo -62.59 128.02 22.34 Favored 'Trans proline' 0 C--N 1.398 3.136 0 N-CA-C 106.467 -2.167 . . . . 0.0 106.467 166.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.469 ' OE2' ' HB3' ' A' ' 45' ' ' LYS . 0.1 OUTLIER -68.86 131.19 44.72 Favored 'General case' 0 C--N 1.302 -1.484 0 C-N-CA 119.821 -0.751 . . . . 0.0 112.753 -170.572 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.0 p -111.71 -9.32 14.13 Favored 'General case' 0 N--CA 1.422 -1.829 0 CA-C-N 114.978 -1.01 . . . . 0.0 112.37 -178.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.469 ' HB3' ' OE2' ' A' ' 43' ' ' GLU . 82.5 tttt -92.44 -51.88 4.93 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 175.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 18.8 t-80 -142.19 90.32 8.29 Favored Pre-proline 0 C--N 1.305 -1.336 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 176.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -78.03 100.95 1.42 Allowed 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.944 2.429 . . . . 0.0 114.115 -175.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -138.7 -51.04 0.55 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.8 0.333 . . . . 0.0 110.837 172.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -114.16 -7.46 13.02 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.434 0.635 . . . . 0.0 110.554 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.424 ' C ' ' H ' ' A' ' 52' ' ' GLU . . . 88.43 -162.28 31.84 Favored Glycine 0 N--CA 1.442 -0.924 0 N-CA-C 108.069 -2.012 . . . . 0.0 108.069 -173.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 26.9 m -81.39 35.77 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.311 -1.097 0 CA-C-N 118.653 1.227 . . . . 0.0 110.217 174.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.424 ' H ' ' C ' ' A' ' 50' ' ' GLY . 37.0 tt0 -43.51 -45.17 6.4 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.292 1.837 . . . . 0.0 113.617 -174.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.452 ' HE2' ' HA ' ' A' ' 53' ' ' LYS . 8.1 mmpt? -68.58 -23.46 64.49 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.821 -175.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -101.54 -13.89 17.7 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.252 0.548 . . . . 0.0 109.839 -178.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -50.95 -58.48 9.38 Favored Glycine 0 CA--C 1.527 0.843 0 CA-C-N 114.85 -1.068 . . . . 0.0 114.663 -178.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -64.8 -12.77 35.72 Favored 'Trans proline' 0 C--N 1.371 1.737 0 C-N-CA 123.006 2.471 . . . . 0.0 113.164 -178.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -89.92 -43.45 10.58 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.86 -43.62 87.89 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.753 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.461 ' HB3' ' HA ' ' A' ' 19' ' ' ASP . 35.3 p -66.56 -36.11 81.85 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.824 -179.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.82 -44.51 96.83 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -66.27 -46.89 75.46 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.531 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.484 ' O ' HG23 ' A' ' 66' ' ' VAL . 60.3 m -55.37 -51.68 66.01 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 123.684 0.615 . . . . 0.0 111.394 -178.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 39.4 mttp -53.69 -51.87 61.85 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 120.926 0.393 . . . . 0.0 111.432 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.42 ' HZ2' ' HB2' ' A' ' 64' ' ' LYS . 10.5 mtmp? -64.62 -40.9 96.31 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.535 -177.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.441 ' HE2' ' HA ' ' A' ' 65' ' ' MET . 0.3 OUTLIER -70.92 -47.02 61.38 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.964 -176.077 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 62' ' ' THR . 36.3 t -66.52 -38.07 80.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 120.965 0.412 . . . . 0.0 110.669 -177.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -75.0 -22.99 58.18 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.374 -0.531 . . . . 0.0 111.571 178.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -83.11 -24.42 32.64 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 121.204 0.526 . . . . 0.0 110.199 177.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.18 151.89 30.17 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.16 179.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -84.49 -65.35 1.02 Allowed 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.158 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -118.15 136.5 53.57 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 -176.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.404 ' HB ' ' O ' ' A' ' 12' ' ' ALA . 69.8 mt -104.84 112.96 40.61 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.475 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 22.1 mt-10 -112.8 133.48 54.78 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -177.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.431 HG12 ' CD1' ' A' ' 92' ' ' ILE . 29.2 m -110.82 123.1 66.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 178.17 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -120.1 122.31 40.76 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -92.99 145.77 24.12 Favored 'General case' 0 N--CA 1.422 -1.868 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -87.04 -175.35 5.31 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.437 ' HZ2' ' HB3' ' A' ' 78' ' ' LYS . 7.1 mtpm? -78.13 14.07 1.27 Allowed 'General case' 0 C--N 1.313 -0.99 0 O-C-N 121.935 -0.478 . . . . 0.0 111.915 -176.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -95.69 -130.67 6.34 Favored Glycine 0 N--CA 1.436 -1.331 0 N-CA-C 112.247 -0.341 . . . . 0.0 112.247 -179.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -97.23 145.79 25.73 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 -177.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.422 HH11 ' HG2' ' A' ' 81' ' ' ARG . 11.8 ttt-85 -90.15 -13.71 35.11 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 119.09 -1.044 . . . . 0.0 109.472 -178.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 23.2 p -128.2 140.86 51.68 Favored 'General case' 0 N--CA 1.432 -1.331 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.523 176.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -69.09 153.73 43.25 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 178.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -65.5 -15.88 63.11 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 121.58 0.705 . . . . 0.0 110.332 179.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -76.34 -12.95 60.15 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.838 177.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 83.25 63.11 1.75 Allowed Glycine 0 CA--C 1.505 -0.534 0 N-CA-C 109.314 -1.515 . . . . 0.0 109.314 -176.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 -156.16 147.61 22.63 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 105.755 -1.943 . . . . 0.0 105.755 -169.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -75.72 134.64 16.64 Favored Glycine 0 C--O 1.206 -1.594 0 C-N-CA 120.539 -0.839 . . . . 0.0 113.777 -173.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 62.7 mt -112.22 110.66 21.04 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 123.26 0.624 . . . . 0.0 111.741 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.43 ' C ' ' HG ' ' A' ' 37' ' ' LEU . . . -157.58 163.44 38.33 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 171.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.447 ' OH ' ' HB3' ' A' ' 98' ' ' MET . 35.6 t80 -95.14 141.73 28.42 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.431 ' CD1' HG12 ' A' ' 74' ' ' VAL . 49.5 mm -99.69 123.57 52.54 Favored 'Isoleucine or valine' 0 C--O 1.252 1.198 0 CA-C-O 121.206 0.526 . . . . 0.0 111.096 -179.475 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.475 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 96.2 m-85 -111.05 131.35 55.13 Favored 'General case' 0 C--N 1.29 -1.999 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 172.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.29 100.42 10.01 Favored 'General case' 0 C--N 1.286 -2.177 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 177.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.6 t70 47.57 57.32 6.02 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 122.474 1.131 . . . . 0.0 110.526 -177.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 77.27 -5.15 52.13 Favored Glycine 0 CA--C 1.53 0.989 0 CA-C-N 114.605 -1.18 . . . . 0.0 114.86 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 32.7 mtmm -104.37 124.25 48.86 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 117.625 0.712 . . . . 0.0 111.144 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' MET . . . . . 0.447 ' HB3' ' OH ' ' A' ' 91' ' ' TYR . 2.1 mpt? -63.23 112.82 2.84 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 123.907 0.883 . . . . 0.0 112.059 -176.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 91.9 t -73.2 -46.16 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.23 -177.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.451 ' O ' HG22 ' A' ' 104' ' ' VAL . 46.2 t30 -63.93 -37.23 86.65 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.121 -178.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -54.94 -44.13 74.0 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.157 176.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.91 -44.22 93.6 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.504 179.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 97.2 mt -58.03 -52.22 66.45 Favored 'General case' 0 C--O 1.244 0.779 0 CA-C-O 121.389 0.614 . . . . 0.0 111.209 178.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.458 HG11 ' CG1' ' A' ' 111' ' ' VAL . 27.2 m -70.78 -38.0 71.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.496 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -176.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 82.4 mtp180 -65.0 -16.22 63.18 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 175.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -93.62 -5.6 48.38 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.766 174.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.29 25.1 69.27 Favored Glycine 0 CA--C 1.507 -0.438 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.68 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 90.4 mt -88.87 -15.97 33.13 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.744 0.307 . . . . 0.0 111.047 -178.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -157.26 174.3 15.66 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -178.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.487 ' HB2' ' HB3' ' A' ' 40' ' ' ASP . 18.4 mttt -119.28 170.98 8.63 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 176.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.517 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 32.8 m -108.05 107.32 22.53 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -177.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -141.32 118.08 11.05 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 119.599 -0.84 . . . . 0.0 112.92 176.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -122.99 98.0 5.7 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 105.293 -2.114 . . . . 0.0 105.293 164.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 97.9 t -133.2 116.21 25.15 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 N-CA-C 114.522 1.305 . . . . 0.0 114.522 -169.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -135.44 -9.96 2.18 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.984 169.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.407 ' HE3' ' OXT' ' A' ' 121' ' ' HIS . 5.0 mptp? 65.57 161.81 0.13 Allowed Pre-proline 0 N--CA 1.496 1.872 0 C-N-CA 123.74 0.816 . . . . 0.0 111.724 -175.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -70.3 -76.68 0.01 OUTLIER 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 121.159 1.24 . . . . 0.0 110.593 173.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -136.63 88.38 2.37 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 173.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -174.62 -32.19 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.576 -177.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 31.3 m 76.97 -48.38 0.53 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.043 1.337 . . . . 0.0 113.479 177.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . 0.407 ' OXT' ' HE3' ' A' ' 116' ' ' LYS . 66.4 t-80 . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.264 -177.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -0.973 0 N-CA-C 111.365 -0.694 . . . . 0.0 111.365 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 30.6 m -88.04 96.7 10.61 Favored 'General case' 0 N--CA 1.423 -1.822 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 6.1 p -78.4 93.65 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.544 0 CA-C-O 122.605 1.193 . . . . 0.0 111.024 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -133.43 74.17 1.55 Allowed 'General case' 0 C--N 1.292 -1.901 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 178.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -85.52 91.47 8.25 Favored 'General case' 0 N--CA 1.418 -2.046 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.418 -173.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 25.0 t -121.6 84.8 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.286 -2.163 0 N-CA-C 105.423 -2.065 . . . . 0.0 105.423 172.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -126.04 106.52 9.66 Favored 'General case' 0 C--N 1.292 -1.898 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.739 -175.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -87.02 167.66 20.9 Favored Pre-proline 0 C--N 1.294 -1.811 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 172.482 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -55.76 152.19 36.28 Favored 'Trans proline' 0 C--O 1.248 1.016 0 C-N-CA 121.47 1.447 . . . . 0.0 110.3 171.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -89.56 91.79 8.83 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 120.087 -0.645 . . . . 0.0 110.974 -176.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -171.68 61.82 0.03 OUTLIER 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 106.341 -1.725 . . . . 0.0 106.341 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 75.5 p -63.72 -8.66 11.01 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 114.292 1.219 . . . . 0.0 114.292 -173.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -85.68 2.17 46.4 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.824 -0.548 . . . . 0.0 111.289 173.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -37.76 -61.68 0.61 Allowed 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 126.731 2.012 . . . . 0.0 113.087 -178.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -47.58 -54.32 12.13 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.475 1.11 . . . . 0.0 113.883 -173.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.1 mt -60.54 -43.75 96.85 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.815 -177.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.36 -38.03 77.88 Favored 'General case' 0 N--CA 1.432 -1.355 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.477 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -57.16 -45.6 83.48 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-O 120.859 0.361 . . . . 0.0 110.39 176.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -62.48 -43.4 98.92 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.931 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 25.2 m -65.24 -41.24 94.56 Favored 'General case' 0 N--CA 1.438 -1.03 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.539 -178.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -67.06 -50.77 60.78 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.198 177.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.88 -34.78 70.13 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.819 0.699 . . . . 0.0 111.908 -177.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 144' ' ' GLN . . . . . 0.44 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 57.8 tt0 -61.94 -48.01 82.31 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -70.56 -32.66 70.16 Favored 'General case' 0 C--O 1.245 0.853 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.771 -178.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 146' ' ' LYS . . . . . . . . . . . . . 81.6 mttt -57.9 -51.21 70.56 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 123.661 0.601 . . . . 0.0 109.645 176.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -71.07 -22.87 62.06 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.548 -176.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 22.8 mm-40 -87.24 -4.35 59.09 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 121.073 -0.251 . . . . 0.0 111.588 178.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . 0.569 ' O ' ' HB3' ' B' ' 154' ' ' SER . 10.0 mmpt? 54.71 57.36 5.78 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.076 0.95 . . . . 0.0 108.855 -176.049 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 98.2 mt -95.49 119.3 33.74 Favored 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 120.084 -0.646 . . . . 0.0 112.539 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 50.9 -84.41 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 127.633 2.373 . . . . 0.0 114.181 175.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 152' ' ' ILE . . . . . 0.549 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 58.5 mt -68.56 -34.06 63.27 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.41 0 CA-C-O 121.764 0.792 . . . . 0.0 109.784 178.118 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 60.0 m95 -81.53 -11.1 59.3 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.767 -172.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 154' ' ' SER . . . . . 0.569 ' HB3' ' O ' ' B' ' 149' ' ' LYS . 79.6 p -91.14 0.86 57.45 Favored 'General case' 0 N--CA 1.423 -1.803 0 C-N-CA 119.73 -0.788 . . . . 0.0 112.438 -178.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . 0.549 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 5.6 pt-20 -93.82 -17.76 22.74 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 174.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 13.7 t70 . . . . . 0 N--CA 1.431 -1.409 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.3 -170.984 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.426 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.6 p -90.91 -40.67 11.59 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 121.396 0.617 . . . . 0.0 110.024 177.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.7 m -88.45 78.43 7.89 Favored 'General case' 0 N--CA 1.424 -1.749 0 CA-C-O 121.541 0.686 . . . . 0.0 110.222 178.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.5 p -91.23 -56.9 2.97 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.939 177.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.4 ' HB3' ' H ' ' B' ' 134' ' ' HIS . 61.4 mttp -131.5 22.83 4.73 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 177.031 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -123.77 124.39 42.6 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 105.116 -2.179 . . . . 0.0 105.116 -178.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.418 ' CD1' ' HA ' ' A' ' 77' ' ' ASP . 96.1 mt -104.7 -149.89 0.42 Allowed 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 117.917 0.326 . . . . 0.0 111.244 -177.465 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.6 m-70 -100.25 116.24 31.77 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 122.173 -0.329 . . . . 0.0 110.957 -177.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.41 ' HZ1' ' CD ' ' A' ' 73' ' ' GLU . 21.2 pttp -110.42 141.92 42.85 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 176.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -139.34 143.75 37.36 Favored Pre-proline 0 C--N 1.276 -2.607 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.29 177.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -62.04 147.91 94.2 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.825 2.35 . . . . 0.0 113.487 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.02 166.09 25.41 Favored 'General case' 0 C--N 1.307 -1.266 0 C-N-CA 124.499 1.12 . . . . 0.0 108.965 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.428 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 57.2 m -100.76 132.03 46.36 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 178.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.2 tp -79.98 126.23 30.77 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 120.995 0.426 . . . . 0.0 110.316 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.3 mm -92.07 -54.62 7.12 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.674 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 175.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -166.42 149.08 6.88 Favored 'General case' 0 N--CA 1.425 -1.702 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.809 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -82.45 128.84 34.66 Favored 'General case' 0 N--CA 1.438 -1.075 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 171.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 47.5 mm -102.79 -51.8 8.71 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.719 0 CA-C-O 121.057 0.456 . . . . 0.0 109.961 -174.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -133.65 -176.8 4.28 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.66 50.54 4.01 Favored Glycine 0 C--O 1.222 -0.643 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 175.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.61 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 5.6 t70 -178.61 -59.91 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 -170.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.537 ' HA ' ' O ' ' A' ' 34' ' ' PHE . 21.5 m -82.32 120.14 25.03 Favored 'General case' 0 N--CA 1.409 -2.507 0 CA-C-N 113.597 -1.638 . . . . 0.0 111.246 -176.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.6 m -126.9 144.56 36.69 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.353 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 177.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -98.25 119.57 37.14 Favored 'General case' 0 C--N 1.292 -1.893 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -176.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.525 ' O ' ' HA ' ' A' ' 31' ' ' PRO . 3.1 mm? -120.42 158.27 27.54 Favored 'General case' 0 CA--C 1.5 -0.963 0 CA-C-O 121.462 0.648 . . . . 0.0 111.985 -176.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.428 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 27.0 ttt -124.07 105.98 9.99 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 174.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -113.8 116.46 29.38 Favored 'General case' 0 C--N 1.292 -1.909 0 C-N-CA 119.191 -1.004 . . . . 0.0 110.086 -178.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 94.6 mttt 57.73 38.14 27.41 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.482 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 91.77 -1.52 75.11 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-N 114.354 -1.294 . . . . 0.0 113.83 175.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -107.74 106.22 57.97 Favored Pre-proline 0 C--N 1.314 -0.963 0 CA-C-N 117.183 0.492 . . . . 0.0 110.437 -177.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.525 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 33.9 Cg_endo -90.89 125.22 1.02 Allowed 'Trans proline' 0 N--CA 1.448 -1.149 0 C-N-CA 123.007 2.471 . . . . 0.0 112.908 178.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 63.6 mtt -141.32 156.23 45.87 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.016 178.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.3 m -90.67 103.83 16.48 Favored 'General case' 0 C--N 1.294 -1.844 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 178.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.537 ' O ' ' HA ' ' A' ' 22' ' ' THR . 73.5 m-85 -95.29 125.25 39.79 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 -170.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.61 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 6.7 mmm180 -95.68 146.12 24.75 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 125.417 1.487 . . . . 0.0 108.281 175.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.452 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 93.3 mt -82.65 125.21 30.95 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 121.631 0.729 . . . . 0.0 111.484 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 69.3 mt -79.0 139.38 38.21 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.333 174.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.541 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 87.9 mt 73.77 10.99 4.66 Favored 'General case' 0 C--O 1.218 -0.598 0 C-N-CA 125.158 1.383 . . . . 0.0 111.919 178.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 66.6 t -128.85 136.32 60.08 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.242 0 CA-C-O 121.084 0.468 . . . . 0.0 110.093 -179.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -121.68 107.87 12.87 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.0 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.407 ' O ' ' HE3' ' A' ' 53' ' ' LYS . 8.7 m -123.26 -49.66 0.04 OUTLIER Pre-proline 0 C--N 1.31 -1.122 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.778 176.136 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -61.61 156.84 45.1 Favored 'Trans proline' 0 C--N 1.391 2.808 0 C-N-CA 121.572 1.514 . . . . 0.0 111.64 -178.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 71.02 175.41 0.29 Allowed 'General case' 0 C--O 1.236 0.359 0 O-C-N 124.16 0.913 . . . . 0.0 111.205 -179.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 23.2 m 70.29 74.4 0.21 Allowed 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 123.855 0.862 . . . . 0.0 111.01 178.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.566 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 0.0 OUTLIER -96.52 -51.8 4.2 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 118.43 -1.308 . . . . 0.0 111.01 176.662 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 87.0 m-70 34.21 73.19 0.62 Allowed Pre-proline 0 N--CA 1.498 1.967 0 C-N-CA 125.247 1.419 . . . . 0.0 113.004 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_exo -65.27 97.08 0.29 Allowed 'Trans proline' 0 C--O 1.241 0.641 0 C-N-CA 122.118 1.879 . . . . 0.0 114.167 -176.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.434 ' HB2' ' OE1' ' A' ' 52' ' ' GLU . 10.3 mtmp? -115.35 -45.97 2.9 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 172.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -97.15 -34.53 11.1 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 172.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 132.78 72.73 0.09 OUTLIER Glycine 0 CA--C 1.492 -1.349 0 N-CA-C 108.946 -1.661 . . . . 0.0 108.946 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.566 ' HA ' ' O ' ' A' ' 45' ' ' LYS . 52.6 t 61.56 89.5 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 -171.419 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.434 ' OE1' ' HB2' ' A' ' 48' ' ' LYS . 4.5 mm-40 -56.09 -32.41 64.12 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 113.938 -1.483 . . . . 0.0 113.264 -169.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.441 ' HE2' HD12 ' B' ' 152' ' ' ILE . 13.9 ptmm? -85.41 -13.1 50.4 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 74.91 91.79 0.08 Allowed 'General case' 0 CA--C 1.509 -0.6 0 C-N-CA 124.659 1.184 . . . . 0.0 112.2 -175.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.401 ' N ' ' HD2' ' A' ' 56' ' ' PRO . . . -71.44 -58.59 5.38 Favored Glycine 0 C--O 1.246 0.857 0 CA-C-N 114.401 -1.272 . . . . 0.0 112.833 -177.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.401 ' HD2' ' N ' ' A' ' 55' ' ' GLY . 1.0 OUTLIER -46.06 -54.84 4.19 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 124.006 3.137 . . . . 0.0 113.125 177.151 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -60.3 -46.59 89.33 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.04 -44.57 96.41 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.271 0.558 . . . . 0.0 110.853 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.6 m -69.17 -44.61 71.87 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.928 -178.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.51 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -65.19 -41.63 94.39 Favored 'General case' 0 C--O 1.209 -1.044 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.924 -178.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -59.96 -43.7 94.89 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 122.588 0.355 . . . . 0.0 110.315 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.2 m -60.7 -50.99 71.25 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.624 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.76 -36.83 85.59 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.837 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.51 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 98.2 mttt -56.96 -46.83 81.89 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 174.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.1 mmt -65.65 -51.5 59.02 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 32.9 m -74.36 -31.61 28.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -174.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -81.12 -28.22 35.23 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 119.536 -0.866 . . . . 0.0 110.944 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -82.01 -25.56 34.59 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.83 177.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.74 145.86 38.82 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 123.209 0.604 . . . . 0.0 111.683 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -79.46 -37.29 37.26 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 44.2 mtmt -133.59 145.48 50.09 Favored 'General case' 0 CA--C 1.484 -1.563 0 CA-C-N 114.625 -1.171 . . . . 0.0 108.85 -178.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.429 HG22 HD13 ' A' ' 25' ' ' LEU . 4.2 mp -117.52 118.54 58.84 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.612 0 N-CA-C 105.348 -2.094 . . . . 0.0 105.348 171.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.563 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 31.5 mt-10 -112.84 141.36 46.74 Favored 'General case' 0 C--N 1.28 -2.453 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -173.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.503 HG13 ' CD1' ' A' ' 92' ' ' ILE . 30.6 m -112.71 124.57 69.5 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.277 -178.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.431 ' HB3' ' HB3' ' A' ' 91' ' ' TYR . 35.5 tt0 -109.75 115.56 30.07 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 175.53 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -87.94 127.46 35.37 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-O 121.397 0.617 . . . . 0.0 111.639 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.418 ' HA ' ' CD1' ' A' ' 7' ' ' LEU . 11.4 t70 -95.8 166.44 11.8 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.086 -0.961 . . . . 0.0 111.798 -174.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -62.31 -24.05 67.09 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 125.847 1.659 . . . . 0.0 110.904 -177.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -55.05 -84.07 0.04 OUTLIER Glycine 0 CA--C 1.493 -1.315 0 O-C-N 123.549 0.531 . . . . 0.0 114.309 -175.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.419 ' HB2' HD11 ' A' ' 89' ' ' LEU . 24.8 mt-30 -149.86 149.61 30.72 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 178.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -84.37 -34.64 23.57 Favored 'General case' 0 C--N 1.285 -2.205 0 CA-C-O 121.599 0.714 . . . . 0.0 109.092 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.403 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 6.9 p -144.48 148.27 34.32 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-N 114.922 -1.035 . . . . 0.0 108.809 -179.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -110.67 158.28 18.78 Favored 'General case' 0 C--N 1.294 -1.83 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -63.46 -16.9 61.96 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.047 0.939 . . . . 0.0 111.13 -179.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -65.3 -20.51 66.44 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 121.373 0.606 . . . . 0.0 109.37 176.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 102.54 24.69 8.12 Favored Glycine 0 N--CA 1.443 -0.846 0 CA-C-N 115.584 -0.734 . . . . 0.0 112.947 176.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -130.07 159.21 37.44 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.403 ' HA2' ' HA ' ' A' ' 82' ' ' THR . . . -88.55 161.18 30.89 Favored Glycine 0 N--CA 1.427 -1.922 0 N-CA-C 109.118 -1.593 . . . . 0.0 109.118 177.235 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.419 HD11 ' HB2' ' A' ' 80' ' ' GLN . 91.1 mt -130.24 118.37 21.26 Favored 'General case' 0 C--N 1.286 -2.174 0 CA-C-N 117.38 0.59 . . . . 0.0 110.318 -177.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.17 168.01 28.63 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.239 0.543 . . . . 0.0 110.716 -178.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.431 ' HB3' ' HB3' ' A' ' 75' ' ' GLU . 18.2 t80 -97.79 126.47 43.16 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 105.363 -2.088 . . . . 0.0 105.363 173.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.503 ' CD1' HG13 ' A' ' 74' ' ' VAL . 47.8 mm -99.84 129.97 49.66 Favored 'Isoleucine or valine' 0 C--O 1.246 0.874 0 C-N-CA 119.75 -0.78 . . . . 0.0 112.912 -176.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.563 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 41.1 m-85 -110.62 145.32 38.1 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.434 173.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -109.41 99.35 8.6 Favored 'General case' 0 C--N 1.29 -1.982 0 N-CA-C 106.417 -1.697 . . . . 0.0 106.417 173.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.317 3.7 p30 42.13 57.42 3.28 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 114.228 1.196 . . . . 0.0 114.228 -176.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.62 -18.49 52.48 Favored Glycine 0 N--CA 1.432 -1.594 0 CA-C-N 114.948 -1.024 . . . . 0.0 113.992 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -90.47 147.35 23.46 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-N 117.114 0.457 . . . . 0.0 110.069 -177.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 57.4 mtt -92.4 108.1 19.71 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-O 121.471 0.653 . . . . 0.0 111.853 -177.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 62.4 t -67.67 -42.32 86.34 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 CA-C-N 114.51 -1.223 . . . . 0.0 109.763 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.452 ' ND2' ' HB3' ' A' ' 36' ' ' LEU . 11.8 m120 -54.13 -49.08 70.01 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.828 177.09 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -54.08 -56.08 21.42 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.377 175.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.83 -41.08 73.71 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 89.6 mt -65.06 -46.58 80.62 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 57.8 t -73.12 -38.26 54.66 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.158 0 CA-C-O 120.588 0.232 . . . . 0.0 110.866 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.523 ' CZ ' ' HA ' ' B' ' 141' ' ' SER . 12.7 tpp180 -65.33 -34.89 79.4 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.556 0.743 . . . . 0.0 110.898 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -84.94 -3.34 58.7 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.205 177.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.521 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 70.69 38.26 67.25 Favored Glycine 0 N--CA 1.432 -1.614 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.661 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 82.8 mt -103.79 -10.9 17.91 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 121.628 0.728 . . . . 0.0 109.287 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -150.18 169.9 20.23 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 114.475 -1.238 . . . . 0.0 108.923 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.424 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 93.4 mttt -123.21 159.01 29.57 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 176.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.5 p -83.79 124.24 39.52 Favored 'Isoleucine or valine' 0 C--O 1.246 0.913 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.846 177.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.541 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . -101.33 121.83 42.6 Favored 'General case' 0 C--N 1.305 -1.331 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -95.84 116.19 28.54 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -176.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 72.3 t -124.01 105.67 15.82 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 N-CA-C 107.643 -1.244 . . . . 0.0 107.643 174.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.414 ' HB2' ' ND2' ' A' ' 119' ' ' ASN . 93.8 m-85 -99.56 46.87 0.96 Allowed 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 178.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 55.6 mmtt 68.92 134.86 0.04 OUTLIER Pre-proline 0 C--O 1.212 -0.903 0 C-N-CA 124.821 1.248 . . . . 0.0 110.465 -169.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.75 -17.13 41.23 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 122.824 2.35 . . . . 0.0 113.12 -175.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -83.67 3.98 30.62 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 179.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . 0.431 ' ND2' ' HB3' ' A' ' 121' ' ' HIS . 25.7 p-10 -78.95 -26.07 43.55 Favored 'General case' 0 C--O 1.223 -0.297 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 176.313 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 7.7 m 66.68 38.09 4.08 Favored 'General case' 0 CA--C 1.557 1.215 0 CA-C-O 122.536 1.16 . . . . 0.0 109.689 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . 0.431 ' HB3' ' ND2' ' A' ' 119' ' ' ASN . 27.9 t60 . . . . . 0 C--O 1.246 0.891 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.497 -1.062 0 N-CA-C 110.664 -0.974 . . . . 0.0 110.664 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 40.1 p -80.59 112.66 18.16 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 51.2 t -78.17 90.19 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.967 0 CA-C-O 121.685 0.755 . . . . 0.0 109.919 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -148.37 126.32 12.0 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.186 -0.915 . . . . 0.0 108.866 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -93.36 96.58 10.03 Favored 'General case' 0 C--N 1.298 -1.671 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 178.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 127' ' ' VAL . . . . . 0.521 ' C ' ' H ' ' B' ' 129' ' ' LYS . 26.3 m -121.49 -52.05 3.22 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 CA-C-N 116.026 -0.534 . . . . 0.0 112.228 -178.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . 0.27 44.5 m-85 62.79 -27.39 0.07 Allowed 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 125.272 1.429 . . . . 0.0 114.834 -175.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.521 ' H ' ' C ' ' B' ' 127' ' ' VAL . 35.3 mtmm -73.8 115.56 43.28 Favored Pre-proline 0 C--N 1.291 -1.968 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 170.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -75.56 -175.65 2.56 Favored 'Trans proline' 0 N--CA 1.437 -1.823 0 C-N-CA 122.073 1.849 . . . . 0.0 113.838 -173.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -81.32 88.53 6.08 Favored 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 175.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 26.0 p-10 -109.21 10.92 25.71 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 113.75 -1.568 . . . . 0.0 108.474 -175.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 17.3 m -56.97 97.46 0.02 OUTLIER 'General case' 0 N--CA 1.412 -2.373 0 C-N-CA 125.737 1.615 . . . . 0.0 112.417 -176.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . 0.4 ' H ' ' HB3' ' A' ' 5' ' ' LYS . 79.6 m-70 69.46 18.69 7.79 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.833 1.653 . . . . 0.0 111.577 179.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -47.01 -49.68 20.6 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.865 0.866 . . . . 0.0 111.967 -178.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . 0.505 ' O ' ' HG3' ' B' ' 140' ' ' LYS . 9.4 pt20 -51.48 -48.77 62.74 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.738 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 85.0 mt -70.35 -44.88 67.24 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.427 -177.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.65 -34.06 77.4 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.422 -178.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 139' ' ' ARG . . . . . 0.539 ' O ' ' HD3' ' B' ' 139' ' ' ARG . 0.0 OUTLIER -76.31 -36.35 58.35 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.574 -179.905 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' B' ' 136' ' ' GLN . 29.6 mtpp -69.24 -29.69 67.67 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-O 121.066 0.46 . . . . 0.0 110.132 177.722 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 141' ' ' SER . . . . . 0.523 ' HA ' ' CZ ' ' A' ' 105' ' ' ARG . 22.6 t -61.2 -55.05 36.58 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-N 114.806 -1.088 . . . . 0.0 108.342 175.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.46 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 33.2 tt0 -59.48 -53.15 61.39 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.63 -1.168 . . . . 0.0 111.087 178.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.6 -42.58 75.06 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -176.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -71.72 -46.97 56.95 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.052 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -65.0 -31.92 73.39 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.919 -177.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 146' ' ' LYS . . . . . 0.46 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 87.7 mttt -59.62 -47.98 83.48 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.247 0.546 . . . . 0.0 110.363 175.014 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -70.52 -31.8 69.02 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.548 -176.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -76.25 -22.1 55.54 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.6 177.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' B' ' 154' ' ' SER . 51.0 mtpt 56.47 65.13 1.49 Allowed 'General case' 0 N--CA 1.441 -0.902 0 C-N-CA 124.434 1.093 . . . . 0.0 110.477 -174.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 89.5 mt -94.96 122.02 37.18 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.239 -179.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 151' ' ' ASN . . . . . 0.521 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 39.6 m-80 46.4 -89.16 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 126.25 1.82 . . . . 0.0 114.191 179.279 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 152' ' ' ILE . . . . . 0.441 HD12 ' HE2' ' A' ' 53' ' ' LYS . 13.3 tt -70.29 -30.94 45.28 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.751 0 CA-C-O 121.3 0.571 . . . . 0.0 110.027 -177.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 153' ' ' TRP . . . . . 0.456 ' CH2' ' HG3' ' B' ' 142' ' ' GLU . 65.9 m95 -78.26 -7.22 56.92 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 121.683 0.754 . . . . 0.0 110.172 -178.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 154' ' ' SER . . . . . 0.424 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 8.2 t -102.85 19.4 19.4 Favored 'General case' 0 N--CA 1.408 -2.542 0 CA-C-N 115.394 -0.821 . . . . 0.0 108.905 179.083 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -71.34 -16.38 62.43 Favored 'General case' 0 C--N 1.351 0.673 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 174.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 15.7 t70 . . . . . 0 N--CA 1.436 -1.139 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.362 176.169 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.412 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 29.6 m -134.89 111.0 9.51 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 121.356 0.598 . . . . 0.0 109.695 179.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 45.6 m -138.9 112.19 8.09 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 176.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.8 m -125.2 -38.41 2.31 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.915 -175.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -86.54 -19.43 29.48 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.444 0.64 . . . . 0.0 109.518 178.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -118.61 122.98 43.87 Favored 'General case' 0 N--CA 1.435 -1.223 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 170.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.444 ' HB3' ' O ' ' A' ' 76' ' ' PHE . 96.6 mt -106.2 165.11 11.47 Favored 'General case' 0 C--N 1.286 -2.167 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 54.6 m80 -77.55 103.22 7.36 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 121.181 0.515 . . . . 0.0 110.441 -178.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 74' ' ' VAL . 27.7 ttpp -115.32 131.38 56.95 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.012 179.267 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.59 163.83 46.94 Favored Pre-proline 0 C--N 1.296 -1.749 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -79.72 150.36 21.36 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.192 1.928 . . . . 0.0 112.185 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.25 156.84 46.79 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.109 177.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.453 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 18.0 m -101.32 138.41 38.38 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 177.507 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 61.7 tp -76.11 126.52 31.15 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 -179.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 48.2 mm -98.41 -55.11 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 175.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 58.5 pttt -175.12 148.09 0.97 Allowed 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 122.432 0.293 . . . . 0.0 111.198 178.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -104.32 115.64 30.75 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 174.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.6 mp -86.91 -47.31 16.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.195 0 CA-C-O 121.416 0.627 . . . . 0.0 109.744 -175.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -138.95 175.71 9.32 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.279 -176.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.03 52.96 4.45 Favored Glycine 0 C--N 1.316 -0.581 0 N-CA-C 108.572 -1.811 . . . . 0.0 108.572 172.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.426 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 7.7 t70 -172.53 -58.97 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 -172.406 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 23.8 m -98.41 117.46 32.88 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 114.438 -1.255 . . . . 0.0 110.89 -176.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.4 m -133.45 156.43 41.66 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.427 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -121.24 125.08 46.21 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.467 -0.77 . . . . 0.0 109.965 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.0 mp -131.16 159.11 38.63 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.093 0.473 . . . . 0.0 110.436 -178.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.453 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 49.0 ttm -116.09 115.92 26.94 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.105 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -121.92 132.45 54.56 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 59.3 mttp 60.83 26.34 16.19 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.958 0.903 . . . . 0.0 110.586 -176.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 82.62 3.41 90.52 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 121.148 -0.548 . . . . 0.0 112.047 -177.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -105.24 113.03 64.94 Favored Pre-proline 0 C--N 1.315 -0.918 0 O-C-N 122.541 -0.388 . . . . 0.0 110.914 -178.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -85.93 120.22 1.94 Allowed 'Trans proline' 0 N--CA 1.443 -1.472 0 C-N-CA 122.389 2.059 . . . . 0.0 112.047 177.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 49.7 mtt -132.35 156.09 47.25 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.021 176.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.4 m -88.48 115.97 26.38 Favored 'General case' 0 N--CA 1.418 -2.043 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -102.14 166.88 10.36 Favored 'General case' 0 N--CA 1.414 -2.225 0 CA-C-O 122.127 0.965 . . . . 0.0 111.157 -177.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.426 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 18.4 ttp180 -139.2 136.63 35.23 Favored 'General case' 0 N--CA 1.405 -2.714 0 N-CA-C 107.124 -1.435 . . . . 0.0 107.124 172.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.0 mp -69.8 119.08 13.49 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 123.997 0.811 . . . . 0.0 110.23 -176.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.0 mt -57.66 131.47 50.36 Favored 'General case' 0 CA--C 1.499 -0.991 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.145 177.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.413 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 87.5 mt 73.19 19.92 3.46 Favored 'General case' 0 C--O 1.217 -0.648 0 O-C-N 125.205 1.565 . . . . 0.0 112.696 175.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.7 t -111.15 125.9 68.51 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 177.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -125.47 110.13 13.54 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.9 p -114.41 91.09 22.96 Favored Pre-proline 0 C--N 1.306 -1.297 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 169.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -101.95 -155.0 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.088 0 C-N-CA 123.137 2.558 . . . . 0.0 113.739 -173.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -128.19 153.39 46.95 Favored 'General case' 0 N--CA 1.423 -1.79 0 N-CA-C 103.533 -2.766 . . . . 0.0 103.533 174.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.1 t -150.59 -175.52 5.14 Favored 'General case' 0 C--N 1.29 -1.996 0 C-N-CA 119.179 -1.008 . . . . 0.0 110.156 -174.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.466 ' O ' ' HD3' ' A' ' 45' ' ' LYS . 8.9 tmtt? -64.38 -33.47 75.92 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 42.8 m80 -68.11 127.7 93.28 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 172.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -33.32 130.0 0.13 Allowed 'Trans proline' 0 C--N 1.36 1.144 0 C-N-CA 125.11 3.873 . . . . 0.0 115.702 -174.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 52' ' ' GLU . 36.7 ttmt -50.21 -49.4 52.79 Favored 'General case' 0 CA--C 1.491 -1.295 0 C-N-CA 124.76 1.224 . . . . 0.0 110.205 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.1 mtpp -85.76 10.47 13.51 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 122.078 0.942 . . . . 0.0 111.269 -174.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -97.64 -49.38 1.82 Allowed Glycine 0 C--N 1.291 -1.95 0 N-CA-C 109.221 -1.552 . . . . 0.0 109.221 174.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 26.9 m -86.76 -6.28 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 CA-C-O 121.391 0.615 . . . . 0.0 111.044 178.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 48' ' ' LYS . 39.9 tt0 -58.37 -34.55 70.81 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 124.151 0.98 . . . . 0.0 111.753 -178.233 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 47.5 pttt -57.8 -19.8 31.09 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -177.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -78.38 -21.58 49.16 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.041 -177.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -64.46 -59.23 8.55 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 120.976 -0.63 . . . . 0.0 112.612 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.405 ' HA ' ' OG ' ' A' ' 59' ' ' SER . 20.2 Cg_exo -69.79 -12.45 32.85 Favored 'Trans proline' 0 C--N 1.369 1.651 0 C-N-CA 122.454 2.103 . . . . 0.0 111.755 176.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -78.48 -48.71 14.79 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 177.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.41 -37.68 80.55 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.862 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.405 ' OG ' ' HA ' ' A' ' 56' ' ' PRO . 26.1 p -68.17 -36.98 80.47 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.16 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -67.8 -43.63 79.23 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 176.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.29 -48.41 81.73 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.659 -179.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.408 HG23 HD22 ' A' ' 103' ' ' LEU . 12.2 p -62.94 -48.85 77.12 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.907 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -56.77 -46.92 81.16 Favored 'General case' 0 CA--C 1.509 -0.621 0 O-C-N 123.349 0.406 . . . . 0.0 111.8 179.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -56.76 -46.17 81.59 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.423 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 49.1 ttm -68.46 -46.47 69.69 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 123.366 0.416 . . . . 0.0 111.881 -177.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.8 m -70.33 -36.65 67.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -177.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -71.95 -34.88 69.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.733 0.302 . . . . 0.0 110.834 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -71.95 -37.77 69.91 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.152 0.501 . . . . 0.0 110.79 -178.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.68 153.73 40.87 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.304 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -86.22 -18.22 32.72 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-O 121.125 0.488 . . . . 0.0 110.766 179.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -130.46 125.74 35.16 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.382 -175.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 64.0 mt -106.86 112.74 41.13 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.84 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 170.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.542 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 26.8 mt-10 -115.42 137.23 52.27 Favored 'General case' 0 C--N 1.285 -2.229 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.365 -172.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.436 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 18.9 m -110.89 121.23 63.22 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 175.199 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.458 ' HB3' ' HB2' ' A' ' 91' ' ' TYR . 40.6 tt0 -110.76 121.09 44.47 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.444 ' O ' ' HB3' ' A' ' 7' ' ' LEU . 88.3 m-85 -95.84 147.0 24.11 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 178.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.509 ' OD1' ' HG2' ' A' ' 78' ' ' LYS . 10.8 t70 -85.0 -179.36 7.04 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 -177.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.509 ' HG2' ' OD1' ' A' ' 77' ' ' ASP . 21.2 pttp -73.05 -16.15 61.49 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 123.115 0.566 . . . . 0.0 112.084 -172.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.445 ' HA3' ' HB3' ' B' ' 131' ' ' ASN . . . -89.99 -107.15 1.25 Allowed Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.865 -179.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -110.9 165.06 12.16 Favored 'General case' 0 C--N 1.309 -1.193 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.826 -173.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 63.2 mtp180 -109.57 -21.4 12.47 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.83 -174.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 22.9 p -130.39 155.64 46.06 Favored 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.8 p30 -98.91 -167.65 1.52 Allowed 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 178.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -111.21 7.96 21.4 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 121.931 0.872 . . . . 0.0 109.305 177.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -86.84 -25.62 24.44 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 114.344 -1.298 . . . . 0.0 107.878 -178.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 105.46 49.12 0.99 Allowed Glycine 0 CA--C 1.487 -1.694 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 177.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 10.4 tpp85 -151.74 153.59 34.63 Favored 'General case' 0 N--CA 1.414 -2.268 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 -177.177 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -95.63 133.49 11.51 Favored Glycine 0 N--CA 1.432 -1.591 0 N-CA-C 108.595 -1.802 . . . . 0.0 108.595 173.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.2 pp -112.84 125.66 54.59 Favored 'General case' 0 N--CA 1.411 -2.415 0 CA-C-N 118.138 0.969 . . . . 0.0 112.91 -177.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -152.63 162.29 41.43 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.313 -179.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.458 ' HB2' ' HB3' ' A' ' 75' ' ' GLU . 83.6 m-85 -87.49 128.6 35.23 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 105.58 -2.007 . . . . 0.0 105.58 174.057 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 48.4 mm -99.32 123.9 52.29 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.663 0 C-N-CA 120.029 -0.668 . . . . 0.0 109.241 -177.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.542 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 6.1 m-85 -116.84 143.56 45.54 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.536 178.522 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -121.55 100.24 6.91 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 175.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.1 t70 46.77 58.72 4.45 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 124.802 1.241 . . . . 0.0 111.323 -175.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.96 -22.5 11.73 Favored Glycine 0 N--CA 1.444 -0.829 0 CA-C-N 114.818 -1.083 . . . . 0.0 114.475 179.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -80.32 129.55 34.58 Favored 'General case' 0 CA--C 1.501 -0.92 0 CA-C-N 117.475 0.638 . . . . 0.0 111.309 -178.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -75.68 105.84 6.93 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 52.2 t -73.19 -39.18 56.1 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.09 0 CA-C-O 121.452 0.644 . . . . 0.0 109.554 -178.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -64.61 -44.41 90.68 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.689 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -66.42 -33.78 76.48 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.995 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.42 -37.81 84.82 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.09 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.408 HD22 HG23 ' A' ' 62' ' ' THR . 84.9 mt -63.13 -44.45 95.57 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.042 177.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 44.0 t -69.7 -37.78 74.71 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.156 0 CA-C-O 121.549 0.69 . . . . 0.0 109.591 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -61.72 -44.85 96.12 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 124.953 1.301 . . . . 0.0 111.693 179.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -83.59 2.12 38.83 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.27 -177.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.441 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 66.04 35.87 91.2 Favored Glycine 0 N--CA 1.43 -1.759 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 -179.042 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.6 mt -96.69 -18.61 19.56 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -151.19 164.85 35.6 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 115.232 -0.895 . . . . 0.0 108.816 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.417 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 94.5 mttt -104.39 168.79 8.87 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 176.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.444 HG13 ' OE2' ' B' ' 142' ' ' GLU . 7.4 p -79.12 132.54 31.9 Favored 'Isoleucine or valine' 0 C--O 1.251 1.173 0 C-N-CA 118.205 -1.398 . . . . 0.0 107.937 175.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.82 158.16 18.22 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.546 -178.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -88.31 149.73 23.62 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-O 121.595 0.712 . . . . 0.0 112.144 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.458 HG21 ' HB3' ' B' ' 132' ' ' ASN . 18.2 t -88.8 134.36 28.55 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.013 0 CA-C-N 114.512 -1.222 . . . . 0.0 109.799 -174.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.435 ' O ' ' HD3' ' A' ' 117' ' ' PRO . 88.5 t80 -83.6 140.63 32.1 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 175.337 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -101.38 104.76 35.75 Favored Pre-proline 0 C--N 1.302 -1.49 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.435 ' HD3' ' O ' ' A' ' 115' ' ' TYR . 91.9 Cg_endo -89.65 -157.97 0.07 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.56 0 C-N-CA 122.368 2.046 . . . . 0.0 108.976 175.431 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -80.72 69.25 7.21 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.597 0.713 . . . . 0.0 111.177 -179.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 55.1 m-20 -127.75 -6.36 5.68 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 176.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.416 ' HA ' ' HB3' ' B' ' 129' ' ' LYS . 9.0 t -71.24 114.99 9.87 Favored 'General case' 0 N--CA 1.425 -1.716 0 CA-C-N 115.264 -0.88 . . . . 0.0 112.303 -172.56 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 . . . . . 0 N--CA 1.43 -1.465 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 176.838 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.529 0 N-CA-C 111.934 -0.466 . . . . 0.0 111.934 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 51.1 m -87.05 179.93 6.59 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 39.4 t -85.57 88.26 2.63 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.199 0 C-N-CA 120.543 -0.463 . . . . 0.0 111.403 -177.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . 50.97 -91.74 0.02 OUTLIER 'General case' 0 C--O 1.253 1.285 0 C-N-CA 126.129 1.771 . . . . 0.0 114.975 174.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -91.31 101.23 13.93 Favored 'General case' 0 N--CA 1.433 -1.282 0 N-CA-C 107.41 -1.329 . . . . 0.0 107.41 -177.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 22.0 t -86.24 -22.3 7.25 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 CA-C-O 121.913 0.863 . . . . 0.0 110.812 -174.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -85.02 46.63 1.3 Allowed 'General case' 0 C--N 1.292 -1.932 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.221 -175.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.416 ' HB3' ' HA ' ' A' ' 120' ' ' THR . 60.8 mttm -59.71 -46.35 98.51 Favored Pre-proline 0 CA--C 1.564 1.513 0 CA-C-N 114.653 -1.158 . . . . 0.0 113.318 -176.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -78.38 -164.01 0.25 Allowed 'Trans proline' 0 CA--C 1.557 1.644 0 C-N-CA 121.638 1.558 . . . . 0.0 112.629 176.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 131' ' ' ASN . . . . . 0.462 ' HB2' ' HB3' ' A' ' 77' ' ' ASP . 1.7 p-10 -109.3 98.4 7.82 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.147 0.499 . . . . 0.0 110.975 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.458 ' HB3' HG21 ' A' ' 114' ' ' VAL . 3.0 p-10 -171.24 39.57 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.158 -171.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 12.3 t -66.56 -11.13 51.52 Favored 'General case' 0 CA--C 1.56 1.342 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 -170.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 14.0 p80 -134.21 34.05 3.32 Favored 'General case' 0 C--O 1.266 1.925 0 CA-C-O 121.76 0.791 . . . . 0.0 112.005 176.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.467 ' OE1' ' HG2' ' B' ' 136' ' ' GLN . 0.2 OUTLIER -65.44 -33.52 76.13 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.855 179.334 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . 0.56 ' O ' ' HG2' ' B' ' 140' ' ' LYS . 15.2 mm100 -57.8 -34.17 69.35 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.799 177.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 64.1 mt -66.24 -42.68 88.28 Favored 'General case' 0 C--O 1.242 0.689 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 6.8 mp -69.54 -30.94 68.88 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 120.352 -0.539 . . . . 0.0 111.75 175.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -69.85 -28.19 65.47 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 176.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' B' ' 136' ' ' GLN . 3.9 mmmp? -61.63 -42.34 98.76 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 174.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 2.6 p -71.89 -41.17 68.28 Favored 'General case' 0 N--CA 1.426 -1.641 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.904 176.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.568 ' HG3' ' CZ2' ' B' ' 153' ' ' TRP . 39.4 tt0 -61.39 -58.02 9.91 Favored 'General case' 0 C--O 1.211 -0.931 0 O-C-N 123.244 0.34 . . . . 0.0 111.839 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . 0.408 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -56.34 -39.21 72.47 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 123.477 0.485 . . . . 0.0 111.435 -176.239 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 144' ' ' GLN . . . . . 0.4 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 52.0 tt0 -70.21 -45.25 66.96 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.179 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -69.48 -28.18 65.85 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.492 -178.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 146' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 92.8 mttt -58.9 -44.31 91.18 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 174.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . 0.408 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 74.7 mmtt -71.8 -35.27 69.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.898 -178.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . 0.411 ' CB ' ' HG ' ' B' ' 150' ' ' LEU . 20.4 mm-40 -66.61 -29.84 69.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.822 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' B' ' 154' ' ' SER . 46.5 mtpt 59.75 57.42 3.18 Favored 'General case' 0 CA--C 1.505 -0.757 0 C-N-CA 124.737 1.215 . . . . 0.0 109.03 -174.442 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . 0.411 ' HG ' ' CB ' ' B' ' 148' ' ' GLU . 87.9 mt -87.85 117.67 26.86 Favored 'General case' 0 CA--C 1.489 -1.392 0 CA-C-N 114.291 -1.322 . . . . 0.0 110.659 -178.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 151' ' ' ASN . . . . . 0.441 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 88.3 m-20 52.52 -89.46 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.903 0 O-C-N 124.673 1.233 . . . . 0.0 114.127 172.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 13.0 tt -72.98 -25.8 22.38 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.222 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -178.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 153' ' ' TRP . . . . . 0.568 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 55.2 m95 -79.39 -7.94 58.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.892 0.853 . . . . 0.0 109.459 178.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 154' ' ' SER . . . . . 0.423 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 35.2 t -103.79 26.73 8.25 Favored 'General case' 0 N--CA 1.419 -1.988 0 CA-C-N 114.457 -1.247 . . . . 0.0 108.426 174.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -62.23 -34.11 75.87 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 174.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 5.6 t70 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 127.71 2.404 . . . . 0.0 114.17 170.756 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.265 0 CA-C-O 121.017 0.437 . . . . 0.0 109.993 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 89.1 m -155.16 -64.88 0.12 Allowed 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 178.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.4 p -154.08 -75.85 0.11 Allowed 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 39.6 m -154.42 67.32 0.71 Allowed 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 106.552 -1.647 . . . . 0.0 106.552 171.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -142.44 90.2 2.21 Favored 'General case' 0 CA--C 1.497 -1.068 0 CA-C-N 114.416 -1.266 . . . . 0.0 110.265 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -85.3 173.11 10.59 Favored 'General case' 0 N--CA 1.422 -1.838 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 173.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.506 ' HB2' ' CG ' ' A' ' 75' ' ' GLU . 3.0 mm? -91.53 166.18 12.97 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -95.19 114.54 26.34 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 120.389 -0.524 . . . . 0.0 109.871 -178.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -111.48 153.58 25.96 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 115.26 -0.882 . . . . 0.0 108.869 177.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -138.68 162.18 54.4 Favored Pre-proline 0 C--N 1.278 -2.51 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 176.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.538 ' HA ' ' O ' ' A' ' 72' ' ' ILE . 19.5 Cg_exo -74.51 155.77 45.32 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 122.294 1.996 . . . . 0.0 111.629 178.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -138.83 166.64 23.91 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.453 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 30.6 m -104.32 139.79 38.81 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 177.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.4 tp -88.69 133.52 34.19 Favored 'General case' 0 C--N 1.306 -1.301 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.234 -177.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 66.6 mt -92.55 -59.22 3.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.549 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 175.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -174.49 161.6 3.34 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.949 -1.023 . . . . 0.0 108.562 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -97.75 151.23 20.38 Favored 'General case' 0 C--N 1.29 -2.004 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 174.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.0 mm -112.89 -56.56 4.21 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -135.3 -160.59 1.07 Allowed 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 -176.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -76.45 -38.04 34.27 Favored Glycine 0 C--N 1.303 -1.298 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.134 -179.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.502 ' OD2' HG21 ' A' ' 41' ' ' THR . 4.0 p30 -106.42 -12.33 15.68 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 120.788 0.327 . . . . 0.0 111.603 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.43 111.87 24.63 Favored 'General case' 0 N--CA 1.425 -1.676 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.521 -174.674 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.9 m -136.91 147.43 27.18 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 C-N-CA 122.66 0.384 . . . . 0.0 110.48 -177.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -103.14 118.39 36.68 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 121.426 0.631 . . . . 0.0 111.188 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.9 mp -127.44 156.29 42.32 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.949 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.453 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 26.2 ttt -118.01 98.92 6.57 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 178.447 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.406 ' CD1' ' HZ ' ' A' ' 34' ' ' PHE . 7.6 p90 -98.67 111.76 24.03 Favored 'General case' 0 C--N 1.308 -1.204 0 C-N-CA 119.896 -0.722 . . . . 0.0 111.159 -174.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 37.4 mtpt 57.96 37.75 26.78 Favored 'General case' 0 C--O 1.245 0.862 0 CA-C-N 114.106 -1.406 . . . . 0.0 109.871 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 90.83 6.63 67.18 Favored Glycine 0 N--CA 1.436 -1.36 0 CA-C-N 114.001 -1.454 . . . . 0.0 113.703 177.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -112.59 106.17 55.7 Favored Pre-proline 0 C--N 1.311 -1.077 0 O-C-N 122.112 -0.64 . . . . 0.0 110.772 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -77.38 124.86 7.35 Favored 'Trans proline' 0 CA--C 1.534 0.504 0 C-N-CA 123.243 2.629 . . . . 0.0 112.648 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 53.7 mtt -145.57 156.54 43.75 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 122.948 0.499 . . . . 0.0 110.734 176.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.6 m -89.53 117.5 28.48 Favored 'General case' 0 N--CA 1.422 -1.866 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 172.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.406 ' HZ ' ' CD1' ' A' ' 27' ' ' TYR . 39.2 m-85 -95.96 145.64 25.26 Favored 'General case' 0 C--N 1.281 -2.379 0 CA-C-O 121.645 0.736 . . . . 0.0 112.488 -175.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 tpp85 -115.13 125.11 53.08 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 170.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.431 ' HA ' ' O ' ' A' ' 90' ' ' ALA . 71.3 mt -71.98 119.2 15.83 Favored 'General case' 0 C--N 1.288 -2.078 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.192 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.464 HD13 ' OD2' ' A' ' 77' ' ' ASP . 74.1 mt -60.42 139.57 57.63 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.756 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.516 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 88.2 mt 74.0 -0.38 3.37 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.924 1.29 . . . . 0.0 112.684 -178.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.5 t -115.21 133.8 60.32 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -179.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.42 ' HB2' ' HB3' ' A' ' 112' ' ' ALA . 16.4 t70 -142.28 108.39 5.22 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 175.385 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.502 HG21 ' OD2' ' A' ' 21' ' ' ASP . 14.1 t -112.63 4.27 0.09 OUTLIER Pre-proline 0 CA--C 1.6 2.868 0 N-CA-C 115.009 1.485 . . . . 0.0 115.009 -178.029 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.451 ' HD3' ' N ' ' A' ' 41' ' ' THR . 48.5 Cg_endo -106.55 13.56 0.16 Allowed 'Trans proline' 0 C--N 1.384 2.437 0 CA-C-N 123.52 2.293 . . . . 0.0 113.409 177.172 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -125.39 122.45 36.81 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 119.866 -0.733 . . . . 0.0 111.841 -174.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.404 ' OG1' HG23 ' A' ' 51' ' ' VAL . 26.4 m -161.23 135.07 6.78 Favored 'General case' 0 C--N 1.31 -1.132 0 N-CA-C 105.886 -1.894 . . . . 0.0 105.886 174.058 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -87.12 -38.08 16.79 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -175.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . 0.269 26.9 t-80 -62.26 -60.93 8.68 Favored Pre-proline 0 CA--C 1.56 1.335 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -173.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -69.86 138.34 37.26 Favored 'Trans proline' 0 C--N 1.357 1.014 0 CA-C-N 121.412 1.54 . . . . 0.0 110.217 173.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -64.22 -23.42 67.3 Favored 'General case' 0 C--N 1.308 -1.234 0 C-N-CA 123.94 0.896 . . . . 0.0 113.023 -173.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.446 ' HB2' ' HB2' ' A' ' 52' ' ' GLU . 30.1 mmmt -97.85 4.74 49.62 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 120.912 0.387 . . . . 0.0 110.386 -178.596 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 90.44 -112.47 4.08 Favored Glycine 0 N--CA 1.433 -1.549 0 N-CA-C 108.602 -1.799 . . . . 0.0 108.602 -174.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.404 HG23 ' OG1' ' A' ' 44' ' ' THR . 21.6 t -95.24 77.08 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 177.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.446 ' HB2' ' HB2' ' A' ' 49' ' ' LYS . 44.2 tt0 -75.28 -57.28 3.99 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.918 -176.46 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.3 mtpp -69.23 -35.53 76.25 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 113.758 1.022 . . . . 0.0 113.758 -170.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -117.48 9.57 13.28 Favored 'General case' 0 C--N 1.311 -1.083 0 C-N-CA 120.327 -0.549 . . . . 0.0 112.243 -172.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -63.78 -56.31 19.72 Favored Glycine 0 CA--C 1.526 0.732 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.566 179.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -52.26 -36.57 68.24 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.805 2.336 . . . . 0.0 112.506 176.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -61.48 -50.54 72.32 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.84 -50.96 66.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.71 -177.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.5 m -59.89 -38.79 83.23 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 120.919 0.39 . . . . 0.0 111.463 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.42 -36.18 76.45 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.113 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -61.92 -50.03 73.81 Favored 'General case' 0 C--O 1.241 0.605 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.454 ' O ' HG22 ' A' ' 66' ' ' VAL . 27.9 m -57.49 -49.72 75.37 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 123.972 0.795 . . . . 0.0 110.03 177.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -54.98 -52.99 61.37 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 178.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -59.23 -40.18 85.08 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 120.676 0.274 . . . . 0.0 111.601 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.6 mmt -72.45 -50.96 22.4 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.454 HG22 ' O ' ' A' ' 62' ' ' THR . 22.2 m -77.08 -28.89 16.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -174.289 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -77.86 -35.51 50.92 Favored 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 119.848 -0.741 . . . . 0.0 111.28 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -79.26 -14.7 58.87 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 121.267 0.556 . . . . 0.0 110.737 177.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.59 133.82 56.45 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.112 -178.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -80.25 -62.93 1.53 Allowed 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 176.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -106.42 118.86 37.76 Favored 'General case' 0 N--CA 1.425 -1.724 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.538 ' O ' ' HA ' ' A' ' 11' ' ' PRO . 64.9 mt -99.62 118.72 46.64 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.497 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 178.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.44 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 3.5 mm-40 -111.24 133.64 53.43 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -175.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.6 m -110.92 118.5 57.45 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.725 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 174.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.506 ' CG ' ' HB2' ' A' ' 7' ' ' LEU . 34.2 tt0 -107.76 121.24 44.31 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 120.638 0.256 . . . . 0.0 110.408 -177.203 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -98.59 129.7 45.12 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 -177.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.464 ' OD2' HD13 ' A' ' 37' ' ' LEU . 2.2 p30 -94.8 -173.86 3.11 Favored 'General case' 0 N--CA 1.426 -1.631 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -176.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -75.76 -8.02 55.84 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.573 0.749 . . . . 0.0 112.288 -174.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -79.88 -70.88 1.3 Allowed Glycine 0 N--CA 1.428 -1.885 0 N-CA-C 111.696 -0.562 . . . . 0.0 111.696 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -145.61 150.57 36.6 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 -176.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -102.36 -39.07 7.34 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 122.033 0.921 . . . . 0.0 109.048 176.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 15.2 p -143.55 142.63 31.18 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.407 -178.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.431 ' HB3' ' HB3' ' A' ' 87' ' ' ARG . 11.5 t70 -76.87 141.42 40.61 Favored 'General case' 0 C--N 1.284 -2.257 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -51.26 -36.99 44.69 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 124.319 1.047 . . . . 0.0 112.605 -177.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -89.4 10.46 22.48 Favored 'General case' 0 CA--C 1.559 1.294 0 CA-C-O 121.598 0.713 . . . . 0.0 111.209 -171.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 94.93 41.5 4.05 Favored Glycine 0 CA--C 1.507 -0.41 0 C-N-CA 120.568 -0.825 . . . . 0.0 114.206 172.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.431 ' HB3' ' HB3' ' A' ' 83' ' ' ASP . 48.4 ttp180 -125.88 138.84 53.82 Favored 'General case' 0 C--N 1.292 -1.893 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 177.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -82.17 143.66 23.12 Favored Glycine 0 C--N 1.305 -1.191 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 91.5 mt -127.36 108.46 10.86 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -179.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.431 ' O ' ' HA ' ' A' ' 36' ' ' LEU . . . -156.63 166.19 34.11 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.851 -177.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -91.61 142.38 27.69 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 170.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 14.0 tt -113.3 135.7 51.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.453 0 C-N-CA 118.316 -1.354 . . . . 0.0 111.559 -178.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.44 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 8.5 m-85 -116.46 139.03 50.9 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.675 176.735 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -109.0 100.17 9.4 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.7 t70 46.35 57.88 5.0 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 124.725 1.21 . . . . 0.0 111.431 -177.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.63 -23.55 12.68 Favored Glycine 0 CA--C 1.52 0.393 0 CA-C-N 114.846 -1.07 . . . . 0.0 114.02 177.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.2 mtmm -90.57 119.39 30.78 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -177.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' MET . . . . . 0.417 ' HA ' ' HA ' ' A' ' 93' ' ' TYR . 41.7 ttp -83.98 103.68 13.43 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 121.951 0.881 . . . . 0.0 112.991 -175.108 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 43.7 t -67.02 -29.18 45.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.653 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -53.54 -52.17 60.54 Favored 'General case' 0 C--O 1.258 1.517 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.106 -178.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.659 ' O ' ' HG2' ' A' ' 105' ' ' ARG . 6.9 pt-20 -77.31 -30.29 54.06 Favored 'General case' 0 N--CA 1.412 -2.365 0 C-N-CA 118.216 -1.394 . . . . 0.0 110.123 -179.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -56.83 -38.98 73.4 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 122.779 0.432 . . . . 0.0 110.904 -179.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 99.1 mt -60.84 -46.7 89.52 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.172 175.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 66.1 t -70.15 -37.35 71.51 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.186 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.492 178.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.659 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 33.9 mmm-85 -58.22 -41.62 84.46 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.23 0.612 . . . . 0.0 110.481 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -83.49 -4.68 58.74 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.719 -177.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.88 33.89 80.96 Favored Glycine 0 N--CA 1.439 -1.152 0 C-N-CA 120.156 -1.021 . . . . 0.0 111.092 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.3 mt -91.05 -6.24 54.11 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 122.16 0.981 . . . . 0.0 108.667 178.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -152.13 165.69 34.0 Favored 'General case' 0 N--CA 1.405 -2.701 0 CA-C-N 114.295 -1.321 . . . . 0.0 107.775 -179.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -103.82 152.09 22.31 Favored 'General case' 0 N--CA 1.409 -2.5 0 N-CA-C 105.136 -2.172 . . . . 0.0 105.136 176.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.7 p -77.28 128.99 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 118.384 -1.326 . . . . 0.0 109.601 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.516 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . -91.44 120.26 32.13 Favored 'General case' 0 C--N 1.293 -1.882 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 173.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 28.3 p90 -89.18 146.76 24.57 Favored 'General case' 0 C--N 1.29 -2.009 0 C-N-CA 119.892 -0.723 . . . . 0.0 109.388 -178.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.431 HG21 HD21 ' B' ' 131' ' ' ASN . 41.0 t -89.0 152.87 3.27 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 N-CA-C 106.827 -1.546 . . . . 0.0 106.827 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.454 ' O ' ' HB2' ' A' ' 116' ' ' LYS . 81.8 m-85 -96.92 -54.35 3.22 Favored 'General case' 0 C--N 1.291 -1.944 0 C-N-CA 120.257 -0.577 . . . . 0.0 112.514 -178.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 115' ' ' TYR . 50.2 mmtt 74.8 125.52 0.03 OUTLIER Pre-proline 0 C--O 1.24 0.588 0 O-C-N 124.359 1.037 . . . . 0.0 109.557 -165.038 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -46.07 -25.61 3.03 Favored 'Trans proline' 0 N--CA 1.488 1.19 0 C-N-CA 124.984 3.789 . . . . 0.0 117.24 -169.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . 0.527 ' HA ' ' OXT' ' A' ' 121' ' ' HIS . 2.9 t-20 -140.02 32.62 1.96 Allowed 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.469 0.652 . . . . 0.0 110.69 -177.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -61.13 -60.44 3.76 Favored 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 121.499 0.666 . . . . 0.0 110.383 176.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 14.6 t -140.42 19.69 2.39 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 175.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . 0.527 ' OXT' ' HA ' ' A' ' 118' ' ' ASN . 46.1 t-80 . . . . . 0 N--CA 1.428 -1.564 0 CA-C-N 113.525 -1.671 . . . . 0.0 108.014 -177.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.698 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 18.1 m 64.54 19.75 11.92 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.216 1.006 . . . . 0.0 113.067 175.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 7.1 p -80.4 -35.01 15.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-O 121.539 0.685 . . . . 0.0 109.311 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -132.96 66.43 1.56 Allowed 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 177.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -107.65 -45.0 4.13 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.47 178.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 58.4 t -75.01 102.86 2.52 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 -178.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -92.53 86.57 5.66 Favored 'General case' 0 N--CA 1.421 -1.888 0 CA-C-O 121.926 0.869 . . . . 0.0 109.758 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -102.12 -177.11 0.51 Allowed Pre-proline 0 C--N 1.292 -1.907 0 N-CA-C 105.61 -1.996 . . . . 0.0 105.61 177.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -55.1 164.48 3.54 Favored 'Trans proline' 0 CA--C 1.556 1.596 0 C-N-CA 121.508 1.472 . . . . 0.0 111.805 174.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 131' ' ' ASN . . . . . 0.434 HD22 ' CG ' ' A' ' 77' ' ' ASP . 62.0 t30 -59.26 -56.94 15.71 Favored 'General case' 0 C--N 1.307 -1.269 0 O-C-N 122.119 -0.363 . . . . 0.0 110.044 176.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 17.3 m120 81.9 -22.59 0.25 Allowed 'General case' 0 N--CA 1.501 2.102 0 C-N-CA 126.002 1.721 . . . . 0.0 113.531 169.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 133' ' ' THR . . . . . 0.418 HG22 ' HB2' ' A' ' 77' ' ' ASP . 21.1 p -36.5 -74.23 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 125.389 1.476 . . . . 0.0 114.187 -169.16 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -116.06 2.39 13.41 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 170.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -62.37 -45.43 93.21 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 114.23 -1.35 . . . . 0.0 113.005 -168.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -60.05 -42.94 95.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.033 0.444 . . . . 0.0 110.082 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.85 -50.17 73.32 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.623 -177.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 9.1 mp -68.86 -38.49 79.76 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 -179.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -61.77 -41.73 98.08 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.977 0.417 . . . . 0.0 109.948 176.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . 0.434 ' HA ' ' HE3' ' B' ' 140' ' ' LYS . 1.4 tpmt? -71.2 -37.77 72.09 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.704 -179.137 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.4 m -65.78 -37.17 85.6 Favored 'General case' 0 C--O 1.244 0.811 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.488 178.238 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.613 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 29.8 tt0 -65.52 -41.86 92.65 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.445 175.558 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -54.24 -46.01 72.47 Favored 'General case' 0 CA--C 1.518 -0.281 0 O-C-N 123.555 0.534 . . . . 0.0 110.399 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 144' ' ' GLN . . . . . 0.463 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 2.6 mp0 -64.78 -46.19 83.14 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.172 175.236 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -58.31 -36.22 73.02 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 123.038 0.535 . . . . 0.0 112.369 -179.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 146' ' ' LYS . . . . . 0.613 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 50.8 mttm -59.76 -47.67 84.73 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 176.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -65.32 -41.91 93.5 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.636 -178.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 20.8 mm-40 -71.89 -18.27 62.05 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.914 -178.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . 0.583 ' O ' ' HB2' ' B' ' 154' ' ' SER . 29.6 mtpp 56.77 65.57 1.37 Allowed 'General case' 0 N--CA 1.437 -1.079 0 C-N-CA 124.098 0.959 . . . . 0.0 110.698 -176.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 94.4 mt -99.76 126.81 45.89 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.146 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 46.67 -93.96 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 125.549 1.54 . . . . 0.0 114.563 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 65.1 mt -63.88 -31.33 52.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 CA-C-O 121.586 0.708 . . . . 0.0 110.708 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 153' ' ' TRP . . . . . 0.421 ' CG ' ' HA ' ' B' ' 146' ' ' LYS . 49.1 m95 -83.98 -3.68 58.17 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.778 0.799 . . . . 0.0 110.247 -179.032 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 154' ' ' SER . . . . . 0.583 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 11.8 t -115.0 28.75 8.5 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 177.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -75.06 -25.48 58.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.043 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 9.8 t70 . . . . . 0 C--N 1.298 -1.656 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 -176.836 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.773 0 CA-C-O 120.54 0.21 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 90.3 m 63.83 -81.42 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.806 0.842 . . . . 0.0 109.861 -173.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.451 ' C ' ' H ' ' A' ' 5' ' ' LYS . 16.4 m -145.39 -4.58 0.69 Allowed 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 178.281 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 87.2 m 68.69 -41.76 0.47 Allowed 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 124.343 1.057 . . . . 0.0 111.774 -173.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.451 ' H ' ' C ' ' A' ' 3' ' ' SER . 23.1 ttmt 81.75 105.79 0.06 Allowed 'General case' 0 CA--C 1.503 -0.84 0 C-N-CA 127.896 2.478 . . . . 0.0 111.001 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.665 ' HE2' ' O ' ' A' ' 7' ' ' LEU . 13.9 ptmt -89.5 174.14 7.95 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 106.965 -1.495 . . . . 0.0 106.965 172.001 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.665 ' O ' ' HE2' ' A' ' 6' ' ' LYS . 73.7 mt -67.71 147.62 52.4 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.2 m170 -91.47 118.37 30.51 Favored 'General case' 0 C--N 1.294 -1.843 0 C-N-CA 119.805 -0.758 . . . . 0.0 112.279 -172.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.446 ' HG2' ' HB2' ' A' ' 75' ' ' GLU . 46.4 mtmt -89.64 109.68 20.63 Favored 'General case' 0 N--CA 1.432 -1.362 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 170.413 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.41 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 7.2 pt-20 -112.73 138.24 22.02 Favored Pre-proline 0 C--N 1.273 -2.759 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.651 178.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 17.3 Cg_exo -67.37 136.65 40.73 Favored 'Trans proline' 0 C--O 1.24 0.605 0 C-N-CA 122.575 2.183 . . . . 0.0 113.199 -176.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -128.31 159.46 35.21 Favored 'General case' 0 N--CA 1.425 -1.676 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.753 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 72.9 m -110.93 128.7 55.91 Favored 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 177.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 57.4 tp -69.38 128.13 35.49 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 120.631 0.253 . . . . 0.0 110.638 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.4 mm -95.05 -55.1 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 173.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -171.54 137.91 1.1 Allowed 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.437 179.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.403 ' HA ' HG13 ' A' ' 23' ' ' VAL . . . -86.67 105.75 17.13 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 175.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.4 mm -74.41 -49.16 32.85 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.594 -175.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.435 ' CG ' ' HZ3' ' A' ' 53' ' ' LYS . 5.3 t70 -142.91 -163.71 1.69 Allowed 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 106.851 -1.537 . . . . 0.0 106.851 -173.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -110.8 44.69 1.45 Allowed Glycine 0 C--N 1.293 -1.818 0 N-CA-C 107.555 -2.218 . . . . 0.0 107.555 176.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -167.21 -52.23 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 113.144 -1.528 . . . . 0.0 107.905 -170.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.411 ' H ' ' HB3' ' A' ' 19' ' ' ASP . 31.1 m -105.88 122.34 45.91 Favored 'General case' 0 N--CA 1.428 -1.567 0 CA-C-N 114.281 -1.327 . . . . 0.0 108.931 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.403 HG13 ' HA ' ' A' ' 17' ' ' ALA . 22.9 t -133.89 145.08 33.9 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.678 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 -178.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -107.19 125.21 50.81 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 119.589 1.086 . . . . 0.0 109.804 -179.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.401 ' O ' ' HA ' ' A' ' 31' ' ' PRO . 4.7 mp -136.12 158.41 44.47 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-O 121.076 0.465 . . . . 0.0 110.74 -178.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.416 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 59.4 ttp -110.31 106.05 15.29 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 11.1 p90 -111.94 121.33 44.73 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 178.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp 58.29 27.71 15.63 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 123.627 0.771 . . . . 0.0 111.002 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.434 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 94.1 3.25 63.75 Favored Glycine 0 N--CA 1.444 -0.772 0 CA-C-N 115.796 -0.638 . . . . 0.0 113.167 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.416 ' O ' ' HA ' ' A' ' 26' ' ' MET . 14.1 mm100 -103.67 101.39 23.93 Favored Pre-proline 0 C--N 1.313 -1.007 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 179.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.434 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 2.0 Cg_endo -81.85 85.08 1.76 Allowed 'Trans proline' 0 N--CA 1.448 -1.196 0 C-N-CA 122.532 2.155 . . . . 0.0 109.783 175.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 29.5 mmt -100.29 156.27 17.32 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.757 -175.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.42 ' O ' ' HB3' ' A' ' 87' ' ' ARG . 9.1 m -84.27 113.23 20.97 Favored 'General case' 0 N--CA 1.409 -2.493 0 N-CA-C 105.916 -1.883 . . . . 0.0 105.916 174.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -95.61 148.16 22.81 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-O 121.78 0.8 . . . . 0.0 111.842 -176.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.2 tpp85 -122.2 129.77 52.57 Favored 'General case' 0 C--N 1.278 -2.541 0 N-CA-C 105.758 -1.941 . . . . 0.0 105.758 173.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 86.0 mt -72.37 119.2 16.24 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 175.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 17.9 mt -55.89 129.03 37.93 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 -177.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 11.1 mt 69.77 33.45 2.92 Favored 'General case' 0 C--N 1.356 0.873 0 O-C-N 124.787 1.304 . . . . 0.0 112.424 164.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.2 t -110.56 128.93 66.52 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.185 0 CA-C-N 114.678 -1.146 . . . . 0.0 108.09 178.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -103.84 108.27 19.51 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.468 ' OG1' ' HD3' ' A' ' 42' ' ' PRO . 36.7 p -120.31 -43.25 0.04 OUTLIER Pre-proline 0 CA--C 1.561 1.385 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 176.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.468 ' HD3' ' OG1' ' A' ' 41' ' ' THR . 23.7 Cg_exo -67.26 95.43 0.38 Allowed 'Trans proline' 0 C--N 1.398 3.14 0 C-N-CA 121.672 1.582 . . . . 0.0 111.666 179.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -128.42 143.88 51.06 Favored 'General case' 0 N--CA 1.409 -2.483 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.113 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.3 p -104.93 94.7 5.4 Favored 'General case' 0 N--CA 1.415 -2.203 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 170.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.445 ' O ' ' HB2' ' A' ' 46' ' ' HIS . 19.6 ttmm -90.52 -54.48 3.98 Favored 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 120.389 -0.525 . . . . 0.0 109.796 -171.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.445 ' HB2' ' O ' ' A' ' 45' ' ' LYS . 36.3 t-80 159.95 -55.4 0.0 OUTLIER Pre-proline 0 N--CA 1.486 1.331 0 C-N-CA 125.517 1.527 . . . . 0.0 110.49 178.63 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.404 ' HD3' ' HB3' ' A' ' 46' ' ' HIS . 1.5 Cg_endo -82.13 94.79 0.89 Allowed 'Trans proline' 0 C--N 1.38 2.223 0 C-N-CA 121.63 1.553 . . . . 0.0 110.701 -178.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.46 ' HA ' ' HG2' ' A' ' 52' ' ' GLU . 58.3 mtmt -70.25 -26.66 63.93 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.159 -0.928 . . . . 0.0 113.479 -174.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -99.5 3.83 45.77 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 122.094 0.95 . . . . 0.0 109.571 175.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -88.68 -2.14 79.37 Favored Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 108.404 -1.878 . . . . 0.0 108.404 171.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.461 HG13 ' H ' ' A' ' 54' ' ' TYR . 57.9 t 73.34 89.64 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.212 0 C-N-CA 126.329 1.852 . . . . 0.0 111.242 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.46 ' HG2' ' HA ' ' A' ' 48' ' ' LYS . 4.8 mm-40 -61.75 -45.64 93.05 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.626 1.571 . . . . 0.0 111.378 -178.167 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.435 ' HZ3' ' CG ' ' A' ' 19' ' ' ASP . 2.2 mmmm -76.63 -27.7 55.79 Favored 'General case' 0 CA--C 1.497 -1.062 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 -175.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.461 ' H ' HG13 ' A' ' 51' ' ' VAL . 77.5 m-85 63.06 14.08 7.32 Favored 'General case' 0 N--CA 1.484 1.227 0 O-C-N 124.043 0.839 . . . . 0.0 110.23 -170.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -50.84 -58.22 9.7 Favored Glycine 0 C--O 1.211 -1.302 0 CA-C-N 114.676 -1.147 . . . . 0.0 113.813 -178.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -51.07 -45.45 36.62 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 122.755 2.304 . . . . 0.0 112.406 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -63.75 -48.1 78.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.854 -179.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.33 -41.65 66.26 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.276 -177.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.3 p -63.23 -43.6 97.62 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -178.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.99 -41.05 95.76 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-O 120.937 0.398 . . . . 0.0 110.519 179.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -64.98 -50.92 64.47 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.458 177.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.527 ' O ' HG23 ' A' ' 66' ' ' VAL . 61.5 m -55.87 -46.97 78.13 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 123.9 0.75 . . . . 0.0 110.975 -179.085 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -56.54 -53.97 51.29 Favored 'General case' 0 C--O 1.214 -0.775 0 O-C-N 123.395 0.435 . . . . 0.0 111.608 178.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -64.2 -32.31 73.84 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 120.91 0.386 . . . . 0.0 111.52 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 11.4 tpt -67.74 -45.83 73.87 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.706 -178.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.527 HG23 ' O ' ' A' ' 62' ' ' THR . 28.8 m -89.61 -31.77 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 -175.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -75.96 -20.42 57.93 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.987 0.423 . . . . 0.0 111.552 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -90.38 -15.21 31.46 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.327 0.584 . . . . 0.0 110.504 175.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -77.58 149.16 34.87 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.747 -176.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -76.66 -65.62 0.91 Allowed 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.626 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.4 mtmm -109.52 135.43 50.53 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 -178.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 69.6 mt -104.74 119.93 54.44 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.091 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 175.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.42 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 32.9 mt-10 -113.32 136.56 52.62 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -177.261 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.449 HG13 HG12 ' A' ' 92' ' ' ILE . 33.1 m -110.41 126.15 67.68 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.873 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 176.011 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.446 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 40.8 tt0 -115.62 115.55 26.61 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -92.2 148.98 21.73 Favored 'General case' 0 C--N 1.287 -2.126 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.449 ' HA ' HD11 ' A' ' 7' ' ' LEU . 6.3 t70 -84.63 -178.78 6.98 Favored 'General case' 0 C--O 1.245 0.817 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 -176.494 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -8.07 54.94 Favored 'General case' 0 N--CA 1.44 -0.946 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 -172.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -93.32 -98.75 1.49 Allowed Glycine 0 N--CA 1.421 -2.364 0 C-N-CA 120.213 -0.994 . . . . 0.0 112.148 178.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.502 ' NE2' ' HA ' ' A' ' 117' ' ' PRO . 21.9 mp0 -98.71 127.11 44.53 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.295 0.569 . . . . 0.0 112.378 -176.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -89.2 -27.9 20.34 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 174.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.419 ' O ' ' HB3' ' A' ' 80' ' ' GLN . 11.0 p -120.92 148.09 44.55 Favored 'General case' 0 N--CA 1.422 -1.825 0 CA-C-N 114.618 -1.174 . . . . 0.0 109.952 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.474 ' CB ' ' HB2' ' A' ' 87' ' ' ARG . 9.9 t0 -84.37 151.95 24.38 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 106.803 -1.555 . . . . 0.0 106.803 178.053 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -62.38 -20.46 64.46 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 179.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -83.39 -3.68 57.77 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.893 0.378 . . . . 0.0 111.656 175.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 90.71 28.76 15.13 Favored Glycine 0 C--N 1.313 -0.722 0 C-N-CA 120.543 -0.837 . . . . 0.0 111.642 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.474 ' HB2' ' CB ' ' A' ' 83' ' ' ASP . 69.8 mtt180 -100.89 176.98 5.1 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 178.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -104.21 128.96 9.67 Favored Glycine 0 N--CA 1.431 -1.65 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 174.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 76.6 mt -110.01 108.35 18.55 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 117.154 0.477 . . . . 0.0 109.754 -179.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.11 167.33 30.76 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-O 121.654 0.74 . . . . 0.0 111.913 -178.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -96.94 127.48 42.95 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 104.332 -2.47 . . . . 0.0 104.332 170.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.449 HG12 HG13 ' A' ' 74' ' ' VAL . 55.3 mt -98.55 126.83 51.58 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.108 0 C-N-CA 117.684 -1.607 . . . . 0.0 111.578 -178.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.42 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 6.2 m-85 -105.77 127.1 52.89 Favored 'General case' 0 N--CA 1.428 -1.555 0 N-CA-C 107.478 -1.305 . . . . 0.0 107.478 176.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.34 99.93 9.64 Favored 'General case' 0 C--N 1.28 -2.451 0 N-CA-C 106.676 -1.601 . . . . 0.0 106.676 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 12.5 t70 45.39 57.73 4.67 Favored 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 125.797 1.639 . . . . 0.0 110.725 -172.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.87 -25.73 7.29 Favored Glycine 0 CA--C 1.526 0.722 0 CA-C-N 114.475 -1.239 . . . . 0.0 113.952 179.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -81.33 114.38 20.07 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -178.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 33.3 ttm -73.99 108.88 7.07 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 120.519 -0.472 . . . . 0.0 110.163 -176.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.0 t -66.12 -34.85 72.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 -178.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -57.76 -50.59 72.72 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.938 178.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.426 ' HG3' ' OG ' ' B' ' 141' ' ' SER . 22.4 tt0 -65.86 -42.74 90.03 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.647 175.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.74 -44.11 77.26 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 122.92 0.488 . . . . 0.0 112.286 -178.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 90.0 mt -62.93 -44.09 97.01 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.844 0.354 . . . . 0.0 110.865 178.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.432 ' HA ' ' O ' ' A' ' 109' ' ' ALA . 58.6 t -70.43 -37.4 70.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.25 -179.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 10.3 tpp180 -67.16 -25.78 66.33 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.803 0.841 . . . . 0.0 110.2 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.443 ' O ' ' HB3' ' B' ' 150' ' ' LEU . 25.5 mm-40 -95.42 0.1 53.04 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.501 178.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.442 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 65.09 22.99 69.35 Favored Glycine 0 C--O 1.218 -0.848 0 C-N-CA 121.245 -0.502 . . . . 0.0 112.523 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 82.2 mt -81.67 -21.07 38.35 Favored 'General case' 0 CA--C 1.495 -1.139 0 CA-C-O 121.743 0.782 . . . . 0.0 108.981 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.432 ' O ' ' HA ' ' A' ' 104' ' ' VAL . . . -154.86 159.15 40.32 Favored 'General case' 0 N--CA 1.409 -2.524 0 N-CA-C 106.673 -1.603 . . . . 0.0 106.673 -179.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 15.4 pttp -121.23 157.86 29.36 Favored 'General case' 0 N--CA 1.416 -2.126 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.7 p -92.77 120.81 42.74 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 119.725 -0.79 . . . . 0.0 112.099 -172.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -119.0 119.25 33.73 Favored 'General case' 0 N--CA 1.436 -1.148 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.512 ' HB3' HD21 ' B' ' 132' ' ' ASN . 8.9 p90 -120.11 95.47 4.76 Favored 'General case' 0 N--CA 1.434 -1.228 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 78.0 t -141.5 105.18 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 169.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -174.03 126.11 0.36 Allowed 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.7 mppt? -106.66 144.9 29.96 Favored Pre-proline 0 C--N 1.31 -1.142 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 177.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.502 ' HA ' ' NE2' ' A' ' 80' ' ' GLN . 21.2 Cg_endo -81.68 -85.45 0.0 OUTLIER 'Trans proline' 0 N--CA 1.44 -1.644 0 C-N-CA 121.746 1.63 . . . . 0.0 112.741 177.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -130.22 -46.15 1.11 Allowed 'General case' 0 C--N 1.307 -1.253 0 N-CA-C 107.626 -1.249 . . . . 0.0 107.626 175.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -145.96 -75.82 0.21 Allowed 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.471 177.32 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 44.3 m -108.7 -40.48 5.06 Favored 'General case' 0 C--O 1.249 1.035 0 N-CA-C 105.425 -2.065 . . . . 0.0 105.425 171.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 4.6 p-80 . . . . . 0 N--CA 1.416 -2.132 0 N-CA-C 105.562 -2.014 . . . . 0.0 105.562 164.317 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -0.97 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 49.1 m -87.72 86.16 7.14 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-O 121.416 0.627 . . . . 0.0 111.033 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 56.6 t -109.7 -64.58 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 177.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -87.36 -26.01 23.56 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 175.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -75.43 98.71 3.97 Favored 'General case' 0 N--CA 1.427 -1.578 0 CA-C-N 114.364 -1.289 . . . . 0.0 108.325 176.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 16.6 m -109.15 26.64 2.32 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 CA-C-O 121.416 0.627 . . . . 0.0 110.695 -178.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -71.69 93.93 1.31 Allowed 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 114.943 -1.026 . . . . 0.0 111.856 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.416 ' HA ' ' HD3' ' B' ' 130' ' ' PRO . 20.6 pttp -135.56 122.15 14.43 Favored Pre-proline 0 C--N 1.274 -2.703 0 CA-C-N 113.901 -1.5 . . . . 0.0 107.073 167.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' B' ' 129' ' ' LYS . 1.4 Cg_endo -80.66 -148.85 0.04 OUTLIER 'Trans proline' 0 C--O 1.245 0.867 0 C-N-CA 123.088 2.525 . . . . 0.0 112.225 -173.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -80.07 94.65 6.0 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 171.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.512 HD21 ' HB3' ' A' ' 113' ' ' TYR . 40.8 t-20 173.65 76.54 0.0 OUTLIER 'General case' 0 CA--C 1.495 -1.138 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 -179.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 9.2 m -83.34 30.12 0.48 Allowed 'General case' 0 C--N 1.275 -2.669 0 CA-C-O 122.668 1.223 . . . . 0.0 108.569 177.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . 0.466 ' H ' ' C ' ' B' ' 132' ' ' ASN . 72.7 m80 -143.49 13.74 1.77 Allowed 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.548 ' O ' ' HG2' ' B' ' 139' ' ' ARG . 12.3 pt-20 -51.7 -46.33 63.87 Favored 'General case' 0 C--N 1.358 0.946 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -171.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -66.37 -38.52 87.75 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 123.091 0.244 . . . . 0.0 111.236 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 79.4 mt -60.93 -48.43 81.86 Favored 'General case' 0 C--O 1.246 0.871 0 CA-C-O 121.913 0.863 . . . . 0.0 109.616 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 44.7 mt -69.69 -37.28 76.55 Favored 'General case' 0 N--CA 1.42 -1.93 0 N-CA-C 113.888 1.069 . . . . 0.0 113.888 -178.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 139' ' ' ARG . . . . . 0.548 ' HG2' ' O ' ' B' ' 135' ' ' GLU . 16.7 ptt-85 -70.7 -28.01 64.43 Favored 'General case' 0 N--CA 1.435 -1.205 0 C-N-CA 119.333 -0.947 . . . . 0.0 112.392 177.05 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -67.57 -41.24 84.46 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 173.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 141' ' ' SER . . . . . 0.426 ' OG ' ' HG3' ' A' ' 101' ' ' GLU . 43.3 m -59.11 -44.78 92.0 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.418 177.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.63 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 40.8 tt0 -66.13 -45.43 81.1 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 115.043 -0.981 . . . . 0.0 109.994 179.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -51.46 -47.3 63.16 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.894 0.877 . . . . 0.0 112.692 -178.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -64.55 -46.68 81.78 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 123.225 0.328 . . . . 0.0 111.024 177.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -61.07 -37.3 82.2 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.101 -178.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 146' ' ' LYS . . . . . 0.63 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 86.7 mttt -57.71 -48.85 78.42 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.136 0.493 . . . . 0.0 109.819 177.482 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -72.53 -37.15 68.39 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.439 -174.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -72.64 -12.21 60.95 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.603 178.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . 0.632 ' O ' ' HB2' ' B' ' 154' ' ' SER . 29.0 mmmt 59.74 53.33 4.94 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 -178.112 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . 0.443 ' HB3' ' O ' ' A' ' 106' ' ' GLN . 79.7 mt -92.17 121.42 33.68 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.09 -177.116 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 151' ' ' ASN . . . . . 0.442 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 45.9 m-80 50.46 -90.55 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.236 1.815 . . . . 0.0 113.704 176.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 152' ' ' ILE . . . . . 0.523 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 55.1 mt -63.48 -38.0 81.04 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.945 0 CA-C-O 121.407 0.622 . . . . 0.0 109.957 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 153' ' ' TRP . . . . . 0.437 ' CG ' ' HA ' ' B' ' 146' ' ' LYS . 60.5 m95 -79.77 -4.91 54.07 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-O 121.225 0.536 . . . . 0.0 111.574 -176.22 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 154' ' ' SER . . . . . 0.632 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 32.5 t -95.62 9.54 39.88 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.724 175.405 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 9.2 pt-20 -70.19 -30.56 67.7 Favored 'General case' 0 C--N 1.35 0.59 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 173.26 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 18.0 t70 . . . . . 0 N--CA 1.447 -0.614 0 C-N-CA 126.153 1.781 . . . . 0.0 110.267 178.936 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.497 -1.091 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 20.0 m -80.86 96.98 7.19 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.447 ' O ' ' HE2' ' A' ' 9' ' ' LYS . 16.9 m -95.45 125.93 40.39 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.355 -174.074 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.8 p -132.27 153.93 50.17 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 177.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -87.34 -39.06 15.66 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.684 0.754 . . . . 0.0 109.878 178.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 36.2 ttmt 166.72 -39.35 0.0 OUTLIER 'General case' 0 CA--C 1.49 -1.344 0 N-CA-C 102.661 -3.088 . . . . 0.0 102.661 -171.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 20.5 mt -78.22 167.83 20.78 Favored 'General case' 0 N--CA 1.418 -2.033 0 CA-C-N 110.952 -2.84 . . . . 0.0 106.98 176.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 -125.2 103.11 7.79 Favored 'General case' 0 C--N 1.3 -1.578 0 C-N-CA 120.297 -0.561 . . . . 0.0 111.165 -176.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.447 ' HE2' ' O ' ' A' ' 3' ' ' SER . 64.6 pttt -71.39 154.91 41.21 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.65 176.123 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -139.41 152.52 69.3 Favored Pre-proline 0 C--N 1.277 -2.558 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.529 176.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -77.02 140.36 20.05 Favored 'Trans proline' 0 N--CA 1.447 -1.209 0 C-N-CA 121.989 1.793 . . . . 0.0 111.268 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -119.57 166.79 12.69 Favored 'General case' 0 C--N 1.288 -2.079 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.463 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 11.7 m -105.01 134.43 48.13 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 178.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 64.5 tp -72.99 133.61 44.36 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 120.931 0.396 . . . . 0.0 110.793 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 64.8 mt -106.01 -59.11 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.751 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 172.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.4 pttt -170.95 134.02 0.94 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.162 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -95.5 106.25 18.31 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 107.759 -1.201 . . . . 0.0 107.759 174.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 48.3 mm -71.3 -50.13 43.16 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-O 121.399 0.619 . . . . 0.0 109.528 -176.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.473 ' HA ' ' CB ' ' A' ' 59' ' ' SER . 7.5 t70 -139.89 -162.33 1.32 Allowed 'General case' 0 C--N 1.294 -1.83 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 -178.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -91.84 -7.59 64.35 Favored Glycine 0 C--N 1.302 -1.314 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 177.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.433 ' HB2' ' OG1' ' A' ' 41' ' ' THR . 13.8 t70 -95.18 -56.97 2.55 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 113.813 -1.193 . . . . 0.0 110.117 -179.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -111.46 130.12 55.81 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.014 -176.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.3 p -137.92 138.35 43.96 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 C-N-CA 124.461 1.105 . . . . 0.0 108.281 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.8 tttp -100.11 122.5 43.06 Favored 'General case' 0 C--N 1.293 -1.878 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 -175.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.0 mp -125.71 159.4 32.39 Favored 'General case' 0 CA--C 1.497 -1.066 0 CA-C-O 121.358 0.599 . . . . 0.0 110.477 -178.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.463 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 43.6 ttm -118.0 120.03 36.58 Favored 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 114.737 -1.119 . . . . 0.0 108.368 177.159 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.8 p90 -120.41 114.13 21.36 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 59.1 mttp 60.95 27.45 17.31 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.821 0.848 . . . . 0.0 111.856 -177.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.13 2.76 64.01 Favored Glycine 0 C--N 1.314 -0.669 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.684 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.424 ' O ' ' HA ' ' A' ' 26' ' ' MET . 42.5 mt-30 -97.97 109.27 50.78 Favored Pre-proline 0 C--N 1.313 -0.983 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 177.578 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -88.86 106.4 0.45 Allowed 'Trans proline' 0 N--CA 1.443 -1.46 0 C-N-CA 122.732 2.288 . . . . 0.0 111.949 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -119.81 145.45 46.61 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.037 178.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 10.6 m -85.47 104.5 15.31 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 175.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -95.19 142.77 27.23 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-O 121.481 0.658 . . . . 0.0 111.155 -174.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.41 ' HD3' ' OD1' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -113.12 132.85 55.28 Favored 'General case' 0 C--N 1.275 -2.635 0 N-CA-C 104.416 -2.438 . . . . 0.0 104.416 174.016 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.438 ' HB2' ' HB ' ' A' ' 39' ' ' VAL . 6.6 mp -66.57 130.33 42.82 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -175.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.2 mt -62.11 127.36 30.98 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.787 174.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 74.4 mt 75.18 8.22 4.02 Favored 'General case' 0 C--O 1.221 -0.429 0 O-C-N 124.751 1.282 . . . . 0.0 113.062 176.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.438 ' HB ' ' HB2' ' A' ' 36' ' ' LEU . 84.9 t -118.12 125.8 74.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -135.56 123.57 22.79 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 178.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.433 ' OG1' ' HB2' ' A' ' 21' ' ' ASP . 73.8 p -108.19 -44.18 0.11 Allowed Pre-proline 0 CA--C 1.569 1.701 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 178.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -87.08 89.75 0.6 Allowed 'Trans proline' 0 C--N 1.378 2.095 0 C-N-CA 121.405 1.403 . . . . 0.0 111.271 -178.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.49 171.75 10.3 Favored 'General case' 0 C--N 1.295 -1.776 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.271 178.417 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.7 t -156.85 83.19 0.95 Allowed 'General case' 0 N--CA 1.407 -2.591 0 CA-C-O 122.486 1.136 . . . . 0.0 109.9 170.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -74.71 -27.94 60.59 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 114.966 -1.015 . . . . 0.0 108.273 174.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 50.9 t-80 -169.83 -53.12 0.0 OUTLIER Pre-proline 0 C--N 1.309 -1.195 0 CA-C-N 114.321 -1.309 . . . . 0.0 109.921 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.54 149.32 82.83 Favored 'Trans proline' 0 C--N 1.384 2.439 0 C-N-CA 121.812 1.675 . . . . 0.0 111.714 176.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -83.24 -26.54 30.66 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 122.011 0.91 . . . . 0.0 109.067 -177.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -86.98 -10.58 52.85 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.784 -177.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.83 -107.81 2.32 Favored Glycine 0 N--CA 1.432 -1.604 0 N-CA-C 109.381 -1.488 . . . . 0.0 109.381 -175.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 23.6 t -107.58 95.46 3.82 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.648 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 176.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -46.94 -61.91 1.65 Allowed 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -170.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.454 ' HZ1' ' HB3' ' A' ' 53' ' ' LYS . 8.4 mtpm? -84.92 -25.16 28.08 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -172.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -88.93 -23.78 22.61 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.983 -0.687 . . . . 0.0 112.316 -174.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -54.94 -51.27 54.69 Favored Glycine 0 CA--C 1.539 1.577 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.847 176.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -55.9 -22.99 40.39 Favored 'Trans proline' 0 C--N 1.37 1.675 0 C-N-CA 123.073 2.516 . . . . 0.0 114.237 176.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -86.3 -36.13 19.5 Favored 'General case' 0 C--O 1.209 -1.066 0 C-N-CA 120.113 -0.635 . . . . 0.0 109.817 178.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.35 -43.3 92.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.505 0.669 . . . . 0.0 110.16 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.473 ' CB ' ' HA ' ' A' ' 19' ' ' ASP . 8.8 p -68.05 -40.4 82.83 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.22 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.07 -46.63 64.55 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.13 -177.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -56.2 -44.78 79.77 Favored 'General case' 0 CA--C 1.507 -0.702 0 C-N-CA 123.795 0.838 . . . . 0.0 110.075 -179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.441 ' O ' HG21 ' A' ' 66' ' ' VAL . 39.5 m -62.15 -45.17 94.61 Favored 'General case' 0 N--CA 1.439 -1.024 0 O-C-N 123.992 0.808 . . . . 0.0 110.591 179.091 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.518 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 49.1 mttp -58.0 -54.55 45.7 Favored 'General case' 0 C--O 1.212 -0.917 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 176.635 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -60.07 -33.86 72.65 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.509 -0.768 . . . . 0.0 112.046 -176.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.12 -51.44 21.39 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 179.741 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.441 HG21 ' O ' ' A' ' 62' ' ' THR . 32.8 m -71.5 -26.23 26.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -176.357 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.518 ' HG2' ' O ' ' A' ' 63' ' ' LYS . 79.9 mm-40 -71.9 -35.18 69.64 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.782 0.801 . . . . 0.0 109.191 174.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -73.59 -41.56 62.72 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.2 -178.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.13 146.64 54.05 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -177.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.8 mptt -78.09 -60.08 2.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.911 0.862 . . . . 0.0 108.714 179.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -107.06 128.08 54.05 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.521 -174.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 60.3 mt -100.56 124.11 53.91 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.345 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 170.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.51 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 21.5 mt-10 -112.34 133.38 54.47 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -173.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 28.9 m -111.97 129.51 67.3 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.187 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.969 179.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -128.93 142.58 50.89 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -110.13 116.29 31.28 Favored 'General case' 0 N--CA 1.423 -1.795 0 N-CA-C 110.552 -0.166 . . . . 0.0 110.552 177.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -102.29 -175.15 2.75 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 178.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.51 ' HB2' ' HZ3' ' A' ' 78' ' ' LYS . 0.1 OUTLIER -79.9 64.61 4.8 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 -172.948 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -128.27 -106.31 1.31 Allowed Glycine 0 C--N 1.292 -1.9 0 CA-C-N 114.779 -1.101 . . . . 0.0 110.477 174.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -137.91 145.94 42.71 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 -99.3 -10.06 22.81 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 120.356 -0.538 . . . . 0.0 109.736 178.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.411 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 40.1 p -134.3 137.08 43.96 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-O 120.857 0.36 . . . . 0.0 110.528 177.051 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.422 ' HB3' ' HB2' ' A' ' 87' ' ' ARG . 24.5 t0 -94.8 127.43 40.8 Favored 'General case' 0 CA--C 1.493 -1.22 0 N-CA-C 104.697 -2.334 . . . . 0.0 104.697 172.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -74.9 62.35 1.1 Allowed 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 114.841 1.422 . . . . 0.0 114.841 -166.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -135.58 7.24 3.28 Favored 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 126.381 1.872 . . . . 0.0 107.236 173.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 86.33 28.86 26.45 Favored Glycine 0 N--CA 1.441 -1.027 0 N-CA-C 109.149 -1.58 . . . . 0.0 109.149 -171.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.422 ' HB2' ' HB3' ' A' ' 83' ' ' ASP . 98.4 mtt180 -110.34 177.66 4.63 Favored 'General case' 0 C--N 1.309 -1.169 0 C-N-CA 123.901 0.881 . . . . 0.0 110.311 -177.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.411 ' HA2' ' HA ' ' A' ' 82' ' ' THR . . . -119.01 162.5 13.47 Favored Glycine 0 N--CA 1.421 -2.351 0 N-CA-C 108.971 -1.652 . . . . 0.0 108.971 174.046 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 74.8 mt -134.16 129.51 35.93 Favored 'General case' 0 C--N 1.29 -1.993 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 176.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -153.16 157.66 40.64 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.078 0.466 . . . . 0.0 110.004 179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -90.96 112.31 24.14 Favored 'General case' 0 C--N 1.294 -1.841 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 176.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 45.6 mm -98.81 126.56 51.97 Favored 'Isoleucine or valine' 0 C--O 1.257 1.451 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -170.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.51 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 4.4 m-85 -112.98 152.75 29.03 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 106.133 -1.803 . . . . 0.0 106.133 173.227 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -130.32 100.07 5.25 Favored 'General case' 0 C--N 1.28 -2.438 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 175.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.7 t70 45.63 58.02 4.57 Favored 'General case' 0 C--O 1.244 0.793 0 C-N-CA 125.017 1.327 . . . . 0.0 113.298 -179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.86 -25.12 23.15 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.382 -0.913 . . . . 0.0 114.432 176.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -100.29 150.33 22.67 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 117.551 0.676 . . . . 0.0 109.304 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 58.6 mtm -97.13 119.87 36.43 Favored 'General case' 0 N--CA 1.414 -2.238 0 C-N-CA 120.336 -0.546 . . . . 0.0 111.429 178.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 38.4 t -63.38 -37.93 80.81 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.27 0 CA-C-N 114.621 -1.172 . . . . 0.0 108.404 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -59.24 -42.61 91.47 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 114.527 -1.215 . . . . 0.0 110.851 177.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -65.57 -56.09 14.17 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.85 -51.01 62.6 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.775 0.83 . . . . 0.0 112.636 -176.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 90.0 mt -58.15 -45.55 87.2 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 60.8 t -73.23 -36.81 50.66 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.04 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 30.0 mmt180 -65.97 -34.52 78.3 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 122.544 0.338 . . . . 0.0 111.541 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -87.14 2.16 50.73 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.645 178.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.04 33.19 86.51 Favored Glycine 0 C--O 1.226 -0.406 0 CA-C-N 116.34 -0.391 . . . . 0.0 112.995 177.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.3 mt -105.32 4.28 30.77 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 120.882 0.372 . . . . 0.0 110.559 -178.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -155.84 160.16 39.97 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.515 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -112.61 171.77 7.32 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.3 p -78.15 126.04 38.12 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.724 0 CA-C-O 121.476 0.655 . . . . 0.0 110.185 178.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -89.5 122.13 32.38 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.602 178.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.488 ' HB2' ' HG3' ' A' ' 116' ' ' LYS . 5.0 p90 -82.71 98.38 9.04 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.36 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 60.5 t -102.34 141.38 18.6 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.354 -174.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.512 ' O ' ' HB3' ' B' ' 130' ' ' PRO . 12.0 t80 59.1 54.81 4.71 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.224 1.41 . . . . 0.0 109.84 177.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.488 ' HG3' ' HB2' ' A' ' 113' ' ' TYR . 71.5 mmtt -110.21 118.5 49.29 Favored Pre-proline 0 C--N 1.292 -1.912 0 CA-C-N 115.118 -0.946 . . . . 0.0 112.143 -172.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -89.07 20.14 1.16 Allowed 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.781 2.987 . . . . 0.0 110.707 178.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 66.35 62.95 0.55 Allowed 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 124.708 1.203 . . . . 0.0 109.565 -179.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 60.93 10.03 2.58 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 125.502 1.521 . . . . 0.0 112.06 179.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.412 ' HG1' HG21 ' B' ' 127' ' ' VAL . 13.7 m 65.4 29.7 11.27 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-O 122.954 1.359 . . . . 0.0 108.309 -175.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 64.3 t60 . . . . . 0 N--CA 1.425 -1.684 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 177.841 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.94 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 17.8 t -80.71 135.99 36.09 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 64.7 t -64.89 -39.51 85.92 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 CA-C-O 121.185 0.516 . . . . 0.0 110.231 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -116.74 106.17 13.21 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.405 179.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -78.03 96.58 5.13 Favored 'General case' 0 N--CA 1.422 -1.863 0 CA-C-O 121.899 0.857 . . . . 0.0 111.994 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 127' ' ' VAL . . . . . 0.412 HG21 ' HG1' ' A' ' 120' ' ' THR . 1.6 p -60.82 -33.92 57.2 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 113.565 -1.652 . . . . 0.0 111.531 179.187 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 33.2 t80 74.12 -15.21 0.62 Allowed 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 125.047 1.339 . . . . 0.0 113.394 171.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.41 ' HB3' ' HD3' ' B' ' 130' ' ' PRO . 41.2 ttmt -67.08 -48.27 49.72 Favored Pre-proline 0 CA--C 1.562 1.434 0 CA-C-O 119.294 -0.384 . . . . 0.0 111.829 174.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . 0.512 ' HB3' ' O ' ' A' ' 115' ' ' TYR . 25.1 Cg_exo -70.72 -172.73 0.71 Allowed 'Trans proline' 0 C--N 1.383 2.346 0 C-N-CA 122.183 1.922 . . . . 0.0 110.548 174.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -82.68 84.92 7.13 Favored 'General case' 0 N--CA 1.437 -1.104 0 C-N-CA 118.307 -1.357 . . . . 0.0 109.87 179.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -100.64 -19.36 16.13 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.957 176.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 6.9 p -50.93 -57.14 9.28 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 125.486 1.515 . . . . 0.0 113.446 -173.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 -99.1 -9.73 23.47 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.46 ' CG ' ' HE ' ' B' ' 139' ' ' ARG . 43.6 tt0 -62.28 -45.84 91.46 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.798 -177.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -57.86 -38.44 75.73 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.294 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 85.1 mt -67.02 -50.04 63.4 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.187 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.03 -26.51 65.91 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 139' ' ' ARG . . . . . 0.46 ' HE ' ' CG ' ' B' ' 135' ' ' GLU . 47.7 mtt180 -76.24 -22.25 55.4 Favored 'General case' 0 C--O 1.211 -0.971 0 C-N-CA 119.788 -0.765 . . . . 0.0 110.733 175.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -74.08 -32.0 63.06 Favored 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 172.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 13.6 m -65.85 -44.8 84.39 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.253 -0.885 . . . . 0.0 108.629 174.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.514 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 0.0 OUTLIER -64.99 -38.86 92.37 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.047 176.75 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -58.59 -39.79 81.36 Favored 'General case' 0 C--O 1.243 0.76 0 C-N-CA 122.7 0.4 . . . . 0.0 110.937 177.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 144' ' ' GLN . . . . . 0.428 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 53.8 tt0 -69.18 -48.56 61.86 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.836 179.022 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -64.25 -34.35 77.91 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.223 -175.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 146' ' ' LYS . . . . . 0.514 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 80.7 mttt -58.32 -50.22 74.4 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.065 0.459 . . . . 0.0 111.124 174.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -70.46 -22.76 62.65 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.127 -177.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 34.5 mm-40 -89.57 -7.71 54.25 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.31 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . 0.566 ' O ' ' HB2' ' B' ' 154' ' ' SER . 30.5 mmmt 52.08 52.51 14.23 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.543 1.137 . . . . 0.0 109.02 -177.024 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 95.5 mt -88.36 113.38 23.9 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.23 -177.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 54.61 -89.26 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 125.841 1.656 . . . . 0.0 114.072 172.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 22.4 mt -65.01 -36.66 78.35 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.128 0 CA-C-O 121.049 0.452 . . . . 0.0 110.444 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 64.5 m95 -77.59 -9.25 58.84 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-O 121.523 0.678 . . . . 0.0 111.286 -177.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 154' ' ' SER . . . . . 0.566 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 32.9 t -92.66 10.59 29.95 Favored 'General case' 0 N--CA 1.428 -1.575 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.574 175.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' B' ' 156' ' ' ASP . 6.6 pt-20 -55.14 -37.7 67.29 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 121.24 0.543 . . . . 0.0 110.418 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 156' ' ' ASP . . . . . 0.411 ' N ' ' HG3' ' B' ' 155' ' ' GLU . 29.4 t70 . . . . . 0 N--CA 1.423 -1.805 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -177.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.508 -0.651 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.8 p -81.05 82.81 6.9 Favored 'General case' 0 N--CA 1.424 -1.749 0 CA-C-O 121.976 0.893 . . . . 0.0 111.789 -178.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.2 p -103.97 -22.1 13.52 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.234 177.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 21.3 m -134.85 139.53 45.12 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -86.52 -101.89 0.07 Allowed 'General case' 0 C--O 1.24 0.596 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 177.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.9 tptm 165.23 125.66 0.01 OUTLIER 'General case' 0 CA--C 1.507 -0.698 0 C-N-CA 124.984 1.314 . . . . 0.0 107.64 178.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 88.2 mt -86.57 139.59 30.69 Favored 'General case' 0 C--N 1.292 -1.914 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 172.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -74.4 103.02 4.62 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -176.235 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.7 tptm -108.13 131.88 54.17 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 114.712 -1.131 . . . . 0.0 108.569 -177.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -128.38 144.76 53.15 Favored Pre-proline 0 C--N 1.303 -1.43 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_exo -81.09 138.48 11.36 Favored 'Trans proline' 0 N--CA 1.447 -1.215 0 C-N-CA 121.89 1.726 . . . . 0.0 108.762 170.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -130.36 141.0 50.58 Favored 'General case' 0 C--N 1.289 -2.043 0 CA-C-O 121.152 0.501 . . . . 0.0 111.747 -177.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.46 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 38.0 m -90.23 127.24 36.08 Favored 'General case' 0 N--CA 1.416 -2.149 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 176.219 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.0 tp -78.47 129.71 35.2 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-O 120.623 0.249 . . . . 0.0 111.317 -177.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 71.7 mt -93.83 -56.94 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.625 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 175.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.403 ' HE3' ' HA ' ' A' ' 16' ' ' LYS . 1.8 tpmt? -175.2 145.22 0.77 Allowed 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 179.006 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -94.71 112.72 24.46 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 173.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.4 mp -82.75 -63.31 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.04 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 -173.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -114.47 -164.07 0.91 Allowed 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 -176.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.67 -29.58 38.82 Favored Glycine 0 C--N 1.304 -1.215 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 -178.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.602 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 2.4 p30 -104.62 -30.44 9.97 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 120.869 -0.332 . . . . 0.0 111.452 178.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.75 116.14 31.95 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-O 121.84 0.829 . . . . 0.0 112.472 -175.064 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.5 p -131.85 142.32 43.32 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 -178.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.2 tttp -104.34 118.89 37.71 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.607 -0.683 . . . . 0.0 109.561 -173.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -119.06 159.3 24.16 Favored 'General case' 0 CA--C 1.502 -0.892 0 CA-C-O 121.731 0.777 . . . . 0.0 111.6 -178.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.46 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 46.0 ttm -121.7 102.15 8.03 Favored 'General case' 0 C--N 1.285 -2.214 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 174.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -105.29 117.62 34.47 Favored 'General case' 0 C--N 1.292 -1.913 0 C-N-CA 119.23 -0.988 . . . . 0.0 109.473 -176.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.9 mttt 61.96 30.62 18.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.748 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.02 -2.55 69.14 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 115.139 -0.937 . . . . 0.0 113.488 177.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.403 ' O ' ' HA ' ' A' ' 26' ' ' MET . 34.4 tt0 -103.84 112.48 65.57 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 117.013 0.406 . . . . 0.0 111.091 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -79.64 116.09 3.47 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 122.52 2.147 . . . . 0.0 111.924 177.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 51.0 ttm -136.43 141.2 43.58 Favored 'General case' 0 N--CA 1.423 -1.82 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.9 m -82.79 122.56 28.36 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 176.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.469 ' HA ' ' O ' ' A' ' 88' ' ' GLY . 56.4 m-85 -112.2 160.78 17.26 Favored 'General case' 0 N--CA 1.423 -1.796 0 CA-C-O 121.852 0.834 . . . . 0.0 112.762 -176.059 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.602 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 37.7 mtt180 -119.54 148.31 43.45 Favored 'General case' 0 C--N 1.288 -2.086 0 CA-C-N 113.508 -1.678 . . . . 0.0 106.565 167.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.9 mp -77.49 135.96 38.3 Favored 'General case' 0 C--N 1.289 -2.057 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.982 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 22.9 mt -70.34 152.73 43.82 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.357 175.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.493 HD22 ' CD2' ' A' ' 113' ' ' TYR . 3.6 mt 68.28 19.86 8.9 Favored 'General case' 0 C--O 1.212 -0.919 0 C-N-CA 125.964 1.706 . . . . 0.0 110.98 177.116 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 66.0 t -110.04 125.12 67.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 CA-C-O 121.27 0.557 . . . . 0.0 109.671 -178.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.496 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 26.6 t70 -98.33 108.07 20.69 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 105.601 -2.0 . . . . 0.0 105.601 173.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.438 HG23 ' NH2' ' A' ' 35' ' ' ARG . 5.0 t -83.37 139.49 41.68 Favored Pre-proline 0 C--N 1.288 -2.09 0 CA-C-N 114.697 -1.138 . . . . 0.0 111.698 -173.627 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.55 -9.22 24.73 Favored 'Trans proline' 0 N--CA 1.452 -0.914 0 C-N-CA 122.424 2.083 . . . . 0.0 112.091 177.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -125.14 127.29 46.62 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-O 121.777 0.799 . . . . 0.0 110.535 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.0 t -175.44 -33.05 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 124.903 1.281 . . . . 0.0 107.984 177.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 55.3 mttp -71.65 -16.45 62.26 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.182 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . 0.28 43.7 m-70 61.51 80.89 0.25 Allowed Pre-proline 0 CA--C 1.495 -1.142 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 179.095 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -71.72 154.04 59.25 Favored 'Trans proline' 0 N--CA 1.441 -1.616 0 N-CA-C 105.615 -2.494 . . . . 0.0 105.615 164.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.6 mtpt -54.09 -49.51 68.91 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 -172.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -100.37 11.71 38.81 Favored 'General case' 0 C--N 1.287 -2.128 0 CA-C-O 121.458 0.647 . . . . 0.0 110.622 178.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 75.93 -167.25 54.66 Favored Glycine 0 N--CA 1.437 -1.282 0 CA-C-N 114.915 -1.039 . . . . 0.0 111.652 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 29.6 t -99.35 86.54 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.229 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 176.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -65.81 -26.12 67.54 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.734 -170.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.48 -14.58 58.15 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 177.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -115.01 -48.61 2.82 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -60.15 -59.43 10.4 Favored Glycine 0 CA--C 1.535 1.328 0 CA-C-O 119.229 -0.761 . . . . 0.0 114.545 -175.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -55.49 -34.03 88.18 Favored 'Trans proline' 0 C--N 1.364 1.351 0 C-N-CA 123.051 2.501 . . . . 0.0 113.514 178.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -71.26 -48.43 51.02 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.071 0.462 . . . . 0.0 110.446 178.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.413 ' HA ' HD12 ' A' ' 108' ' ' LEU . . . -65.07 -40.12 94.23 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.519 -178.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.48 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 29.8 p -65.28 -43.92 89.67 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.721 -178.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.27 -37.16 86.49 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.089 0.471 . . . . 0.0 110.706 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -67.95 -47.55 68.33 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.878 179.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.556 ' O ' HG21 ' A' ' 66' ' ' VAL . 58.5 m -58.84 -41.65 87.45 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.09 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.48 ' HG3' ' O ' ' A' ' 59' ' ' SER . 48.2 mttp -54.24 -54.71 36.29 Favored 'General case' 0 C--N 1.35 0.615 0 O-C-N 123.233 0.333 . . . . 0.0 110.848 178.353 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -66.39 -32.01 73.13 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.335 -176.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 17.4 tpt -67.0 -51.08 59.44 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.972 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.556 HG21 ' O ' ' A' ' 62' ' ' THR . 29.6 m -83.51 -27.53 7.6 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -175.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -81.46 -20.29 40.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -85.18 -20.63 29.92 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.585 0.707 . . . . 0.0 110.619 178.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -77.97 160.47 28.17 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.034 178.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -84.6 -57.95 2.92 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -105.46 144.19 32.57 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.081 -174.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 4.0 mp -116.86 120.39 64.9 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.811 0 N-CA-C 105.987 -1.857 . . . . 0.0 105.987 174.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.459 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 22.5 mt-10 -112.81 133.28 54.88 Favored 'General case' 0 C--N 1.279 -2.466 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -175.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 30.2 m -110.87 122.75 65.93 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.321 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -118.26 140.36 49.93 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-O 121.326 0.584 . . . . 0.0 111.374 -176.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -104.76 126.28 51.68 Favored 'General case' 0 N--CA 1.421 -1.923 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.897 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -85.68 -173.47 4.65 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 178.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -71.78 -12.29 61.23 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.903 -0.498 . . . . 0.0 112.091 -175.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -79.79 -118.05 0.31 Allowed Glycine 0 CA--C 1.525 0.708 0 N-CA-C 114.557 0.583 . . . . 0.0 114.557 -178.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -124.36 153.34 41.98 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 -176.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 -106.97 -15.63 14.65 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 121.832 0.825 . . . . 0.0 108.876 174.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 2.2 p -101.87 133.79 46.09 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.96 178.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -100.05 149.3 23.63 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.214 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -61.84 -26.89 68.4 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 124.855 1.262 . . . . 0.0 112.478 -175.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -78.48 -5.49 52.7 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 121.464 0.65 . . . . 0.0 110.215 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 85.78 56.68 2.3 Favored Glycine 0 N--CA 1.431 -1.658 0 N-CA-C 109.407 -1.477 . . . . 0.0 109.407 -178.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 9.7 tpp180 -142.89 149.48 38.54 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 -177.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.469 ' O ' ' HA ' ' A' ' 34' ' ' PHE . . . -95.53 142.43 16.09 Favored Glycine 0 N--CA 1.432 -1.573 0 N-CA-C 109.18 -1.568 . . . . 0.0 109.18 175.446 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -134.38 135.15 42.45 Favored 'General case' 0 N--CA 1.419 -1.987 0 CA-C-N 117.9 0.85 . . . . 0.0 112.504 177.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -152.49 156.49 39.51 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -83.31 130.73 35.08 Favored 'General case' 0 N--CA 1.434 -1.259 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 178.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 60.5 mt -103.72 126.54 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.025 0 CA-C-O 121.563 0.697 . . . . 0.0 112.02 -175.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.459 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 79.1 m-85 -107.43 132.44 53.18 Favored 'General case' 0 N--CA 1.423 -1.805 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 172.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.27 99.36 8.97 Favored 'General case' 0 C--N 1.285 -2.237 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 177.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.3 t70 45.83 53.25 9.04 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 125.155 1.382 . . . . 0.0 111.355 -176.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 84.1 -5.02 81.65 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 115.617 -0.72 . . . . 0.0 114.641 179.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -96.89 141.07 30.52 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 117.927 0.863 . . . . 0.0 109.681 177.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 62.9 mtm -84.29 110.58 18.69 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-O 121.37 0.605 . . . . 0.0 110.901 179.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 54.9 t -65.94 -42.2 91.4 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 CA-C-N 114.525 -1.216 . . . . 0.0 111.49 -176.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -69.41 -30.41 68.36 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.057 0.456 . . . . 0.0 110.46 -178.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -62.12 -38.47 89.07 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 175.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -69.58 -36.72 76.52 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.237 178.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 89.2 mt -64.02 -44.16 93.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.35 177.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 66.3 t -69.74 -32.5 52.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 121.018 0.437 . . . . 0.0 110.27 178.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.93 -17.25 64.4 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.265 0.555 . . . . 0.0 111.008 179.455 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -108.86 -3.68 17.44 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 121.086 0.469 . . . . 0.0 110.033 176.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.522 ' HA3' ' O ' ' B' ' 150' ' ' LEU . . . 63.08 42.47 99.54 Favored Glycine 0 N--CA 1.437 -1.244 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.034 -177.191 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.413 HD12 ' HA ' ' A' ' 58' ' ' ALA . 75.8 mt -90.68 -20.57 22.34 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 121.006 0.432 . . . . 0.0 110.39 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -155.1 173.51 16.49 Favored 'General case' 0 N--CA 1.433 -1.275 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.523 -177.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.496 ' HB2' ' HB3' ' A' ' 40' ' ' ASP . 89.6 mttt -118.14 168.78 10.25 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 105.472 -2.048 . . . . 0.0 105.472 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 11.6 m -106.83 127.84 62.07 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 C-N-CA 117.378 -1.729 . . . . 0.0 111.937 178.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.467 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . -114.01 119.64 37.88 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 175.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.493 ' CD2' HD22 ' A' ' 38' ' ' LEU . 1.8 t80 -120.45 120.49 36.05 Favored 'General case' 0 C--N 1.286 -2.195 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 -176.28 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 90.7 t -88.63 108.43 18.84 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.79 0 C-N-CA 119.702 -0.799 . . . . 0.0 109.751 176.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.51 ' HA ' ' HB2' ' B' ' 131' ' ' ASN . 23.7 p90 -85.54 162.41 18.91 Favored 'General case' 0 N--CA 1.395 -3.19 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 170.006 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 115' ' ' TYR . 3.8 mppt? 82.07 140.68 0.06 OUTLIER Pre-proline 0 C--N 1.318 -0.801 0 C-N-CA 125.151 1.38 . . . . 0.0 108.274 -164.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -53.23 -52.8 7.89 Favored 'Trans proline' 0 C--O 1.247 0.925 0 C-N-CA 122.106 1.871 . . . . 0.0 112.712 -178.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 61.24 22.08 12.47 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.761 0.824 . . . . 0.0 112.584 176.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -123.55 87.81 2.81 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 72.9 p 72.23 1.92 4.13 Favored 'General case' 0 C--N 1.308 -1.232 0 C-N-CA 127.111 2.164 . . . . 0.0 112.007 -176.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 1.6 p80 . . . . . 0 N--CA 1.434 -1.261 0 N-CA-C 106.627 -1.619 . . . . 0.0 106.627 177.097 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.325 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 40.5 m 68.52 -57.04 0.5 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.971 1.309 . . . . 0.0 113.72 178.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 30.1 m -72.72 -45.09 58.35 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.092 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -176.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -116.06 94.78 4.8 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.477 0.656 . . . . 0.0 110.61 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -144.69 -64.42 0.35 Allowed 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.142 177.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 14.5 p -100.12 119.11 47.76 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.167 0 CA-C-O 121.972 0.891 . . . . 0.0 110.642 -173.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -101.27 -8.16 22.39 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.662 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -88.71 108.19 21.64 Favored Pre-proline 0 C--N 1.306 -1.284 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 173.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -52.36 -56.47 2.85 Favored 'Trans proline' 0 C--O 1.243 0.762 0 C-N-CA 122.373 2.049 . . . . 0.0 112.082 -177.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 131' ' ' ASN . . . . . 0.51 ' HB2' ' HA ' ' A' ' 115' ' ' TYR . 2.6 m-20 -101.49 95.08 6.24 Favored 'General case' 0 N--CA 1.427 -1.583 0 N-CA-C 107.605 -1.258 . . . . 0.0 107.605 178.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -142.26 12.66 1.98 Allowed 'General case' 0 C--N 1.293 -1.848 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 177.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 1.6 m -47.98 -44.34 30.42 Favored 'General case' 0 N--CA 1.441 -0.92 0 C-N-CA 126.784 2.033 . . . . 0.0 112.661 -172.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -128.19 11.3 6.44 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.689 179.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -67.45 -50.27 59.98 Favored 'General case' 0 CA--C 1.501 -0.904 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 -172.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . 0.495 ' O ' ' HG3' ' B' ' 140' ' ' LYS . 72.7 mt-30 -52.24 -45.33 65.3 Favored 'General case' 0 C--N 1.314 -0.939 0 O-C-N 124.07 0.856 . . . . 0.0 111.784 -175.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.9 mt -63.59 -50.3 69.98 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 120.828 0.346 . . . . 0.0 110.871 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.64 -38.9 87.84 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.688 -178.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 77.0 mtt-85 -75.24 -29.15 60.14 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -176.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' B' ' 136' ' ' GLN . 63.5 mttm -70.56 -34.42 72.2 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.546 174.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 47.4 m -67.13 -41.75 85.62 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.489 174.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.486 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 40.0 tt0 -57.47 -52.77 64.03 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.427 176.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -51.84 -49.38 62.96 Favored 'General case' 0 C--O 1.24 0.558 0 O-C-N 123.782 0.676 . . . . 0.0 111.525 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 144' ' ' GLN . . . . . 0.455 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 27.5 tt0 -61.93 -47.19 86.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.417 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -63.28 -36.77 84.79 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 123.536 0.734 . . . . 0.0 111.746 -177.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 146' ' ' LYS . . . . . 0.486 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 87.7 mttt -57.62 -48.81 78.41 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.344 0.593 . . . . 0.0 109.844 176.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -66.11 -32.33 73.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.858 -178.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 22.4 mm-40 -73.51 -20.58 60.63 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.456 178.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt 54.93 65.01 1.62 Allowed 'General case' 0 CA--C 1.506 -0.733 0 C-N-CA 124.501 1.12 . . . . 0.0 110.615 -172.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . 0.522 ' O ' ' HA3' ' A' ' 107' ' ' GLY . 95.7 mt -89.33 108.19 19.49 Favored 'General case' 0 C--N 1.301 -1.528 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.092 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 151' ' ' ASN . . . . . 0.409 ' HB3' ' O ' ' A' ' 107' ' ' GLY . 61.5 t30 48.45 -81.64 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 126.635 1.974 . . . . 0.0 114.525 175.371 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 12.6 tt -72.85 -25.15 21.83 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.499 0 CA-C-O 121.475 0.655 . . . . 0.0 109.833 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 153' ' ' TRP . . . . . 0.477 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 52.4 m95 -82.08 -4.74 57.51 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 121.783 0.802 . . . . 0.0 109.243 178.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 11.7 t -110.27 31.92 5.54 Favored 'General case' 0 N--CA 1.407 -2.606 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 175.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -69.67 -26.52 64.42 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 119.61 -0.836 . . . . 0.0 109.636 176.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 . . . . . 0 C--O 1.237 0.435 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 173.237 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.612 0 CA-C-O 120.647 0.261 . . . . 0.0 111.043 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 34.5 m 63.29 67.7 0.65 Allowed 'General case' 0 C--O 1.248 1.022 0 CA-C-O 122.754 1.264 . . . . 0.0 109.385 -174.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 44.9 m -89.31 -175.52 4.78 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 114.202 -1.363 . . . . 0.0 109.973 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.9 m -72.76 91.18 1.46 Allowed 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -174.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -97.18 98.85 10.37 Favored 'General case' 0 N--CA 1.427 -1.609 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 170.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.405 ' HD3' ' O ' ' A' ' 6' ' ' LYS . 2.6 tmtp? -97.59 -36.38 10.3 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -178.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.441 HD12 ' HB2' ' A' ' 77' ' ' ASP . 40.3 mt -130.28 -149.76 0.41 Allowed 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 114.974 -1.012 . . . . 0.0 108.451 -176.172 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 67.7 t60 -98.13 104.84 16.91 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -179.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -106.83 153.56 22.3 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.158 0.504 . . . . 0.0 110.06 179.246 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -139.97 149.08 57.52 Favored Pre-proline 0 C--N 1.272 -2.785 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 172.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -74.3 144.16 32.61 Favored 'Trans proline' 0 C--O 1.247 0.973 0 C-N-CA 121.924 1.749 . . . . 0.0 111.505 -179.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -132.1 152.38 51.25 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.277 179.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.473 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 22.7 m -98.21 131.69 44.35 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 61.4 tp -76.27 124.21 27.13 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 120.943 0.402 . . . . 0.0 111.437 -178.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 70.0 mt -95.64 -60.21 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.224 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 176.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -154.81 160.2 41.1 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 123.756 0.822 . . . . 0.0 109.994 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.97 121.75 45.86 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 106.73 -1.582 . . . . 0.0 106.73 173.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.9 mp -92.95 -56.98 4.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.402 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.092 -175.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -141.57 -167.82 2.51 Favored 'General case' 0 C--N 1.311 -1.071 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 -177.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.514 ' HA2' ' OG1' ' A' ' 62' ' ' THR . . . -88.24 51.89 4.02 Favored Glycine 0 N--CA 1.44 -1.063 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 178.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.4 ' OD1' ' HD3' ' A' ' 35' ' ' ARG . 2.6 t70 179.06 -59.97 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.143 0 C-N-CA 125.813 1.645 . . . . 0.0 108.087 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.4 m -82.46 110.08 17.26 Favored 'General case' 0 N--CA 1.405 -2.706 0 CA-C-N 114.048 -1.433 . . . . 0.0 110.634 -175.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.1 t -125.15 152.82 31.98 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.2 tttp -111.19 117.67 33.86 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 118.793 0.724 . . . . 0.0 109.39 -175.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.468 ' HB2' ' CE1' ' A' ' 34' ' ' PHE . 3.3 mm? -123.62 153.94 40.02 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.614 0.721 . . . . 0.0 111.358 -175.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.534 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 49.1 ttm -112.29 109.1 18.56 Favored 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 174.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -115.96 116.19 27.49 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.165 -177.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.423 ' HA ' ' HE2' ' A' ' 28' ' ' LYS . 9.8 mmpt? 63.84 26.92 14.46 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.423 1.089 . . . . 0.0 109.577 -178.132 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.406 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 92.8 4.96 64.92 Favored Glycine 0 C--N 1.303 -1.263 0 CA-C-N 114.603 -1.18 . . . . 0.0 113.32 179.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.534 ' O ' ' HA ' ' A' ' 26' ' ' MET . 46.4 mt-30 -97.03 106.93 34.54 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.53 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 5.8 Cg_exo -80.42 102.49 1.42 Allowed 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 122.694 2.263 . . . . 0.0 110.354 177.424 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 89.6 mtp -133.98 150.64 51.27 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-O 121.371 0.605 . . . . 0.0 110.814 -177.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.6 m -86.47 126.74 34.63 Favored 'General case' 0 N--CA 1.415 -2.2 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 177.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.468 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 33.2 m-85 -97.15 157.95 15.68 Favored 'General case' 0 C--N 1.292 -1.903 0 C-N-CA 123.174 0.589 . . . . 0.0 111.853 -177.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.4 ' HD3' ' OD1' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -139.08 133.78 32.03 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 104.104 -2.554 . . . . 0.0 104.104 -179.187 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.6 mt -84.61 132.66 34.47 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.897 0.856 . . . . 0.0 112.265 -174.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.404 ' HB2' ' CE1' ' A' ' 91' ' ' TYR . 74.1 mt -73.31 138.34 45.37 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.115 177.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 38.8 mt 66.75 17.88 10.63 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.265 1.426 . . . . 0.0 112.964 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 59.5 t -110.64 136.92 45.16 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -126.15 106.67 9.73 Favored 'General case' 0 C--N 1.288 -2.103 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 174.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.402 ' H ' ' HD2' ' A' ' 42' ' ' PRO . 19.6 m -101.58 -58.41 0.11 Allowed Pre-proline 0 C--N 1.285 -2.22 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 177.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.415 ' HA ' ' CG2' ' A' ' 51' ' ' VAL . 31.4 Cg_endo -64.84 107.74 0.96 Allowed 'Trans proline' 0 C--N 1.383 2.382 0 C-N-CA 121.622 1.548 . . . . 0.0 111.441 175.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -67.17 154.15 41.95 Favored 'General case' 0 C--O 1.258 1.55 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.771 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.4 m 78.42 153.8 0.14 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 125.217 1.407 . . . . 0.0 108.759 -172.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -59.41 -25.82 64.63 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.515 0.674 . . . . 0.0 110.864 178.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 23.1 t60 -135.28 122.28 14.81 Favored Pre-proline 0 N--CA 1.429 -1.483 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 172.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -65.39 98.53 0.33 Allowed 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 121.574 1.516 . . . . 0.0 111.916 179.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -92.8 -44.16 8.65 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 178.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -85.28 -24.92 27.53 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 175.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 84.97 -132.03 10.82 Favored Glycine 0 N--CA 1.425 -2.097 0 N-CA-C 108.423 -1.871 . . . . 0.0 108.423 -177.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.415 ' CG2' ' HA ' ' A' ' 42' ' ' PRO . 5.0 t -135.25 88.29 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 173.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -83.37 -45.96 13.11 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.634 -177.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -50.06 -63.2 1.19 Allowed 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 114.797 1.406 . . . . 0.0 114.797 -175.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -134.47 20.49 3.64 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 121.261 0.553 . . . . 0.0 111.02 -175.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -61.82 -58.86 11.03 Favored Glycine 0 C--N 1.317 -0.508 0 CA-C-N 115.048 -0.978 . . . . 0.0 112.741 -179.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -51.55 -29.49 32.3 Favored 'Trans proline' 0 C--N 1.363 1.315 0 C-N-CA 123.154 2.569 . . . . 0.0 113.082 177.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -72.77 -47.58 45.55 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 122.554 0.342 . . . . 0.0 110.283 178.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.33 -44.85 93.73 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.69 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.563 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 12.9 m -59.21 -46.87 87.31 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.111 178.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.11 -46.26 89.84 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -177.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -59.37 -40.86 87.86 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.742 -177.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.514 ' OG1' ' HA2' ' A' ' 20' ' ' GLY . 30.2 m -64.45 -47.15 80.15 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.217 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.563 ' HG3' ' O ' ' A' ' 59' ' ' SER . 55.2 mtpt -60.46 -44.03 96.31 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.379 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp -56.15 -54.04 49.85 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.625 177.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 53.0 ttm -66.07 -42.17 89.77 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.729 -175.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 35.1 m -71.65 -37.75 64.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.921 -0.712 . . . . 0.0 112.351 -178.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -75.36 -24.78 57.34 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -78.67 -21.63 47.99 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.508 0.671 . . . . 0.0 110.203 178.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.406 ' HB1' ' HB1' ' A' ' 94' ' ' ALA . . . -78.62 147.08 33.78 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.518 -178.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.25 -47.49 7.75 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.4 mtmp? -110.07 139.08 45.59 Favored 'General case' 0 CA--C 1.494 -1.211 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 3.8 mp -112.25 135.0 52.96 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.404 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 176.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.491 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 7.0 mm-40 -111.99 132.89 54.51 Favored 'General case' 0 N--CA 1.422 -1.826 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 -177.082 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.427 HG12 ' CD1' ' A' ' 92' ' ' ILE . 35.4 m -116.74 118.91 60.35 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 175.448 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.424 ' HA ' ' HA ' ' A' ' 9' ' ' LYS . 25.1 tt0 -116.25 136.45 53.0 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 121.395 0.617 . . . . 0.0 112.539 -173.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -108.48 140.22 42.12 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 125.222 1.409 . . . . 0.0 111.104 -176.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.516 ' HB3' ' ND2' ' B' ' 131' ' ' ASN . 47.3 t0 -122.89 -179.3 4.21 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -179.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -73.74 69.55 1.33 Allowed 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 124.766 1.226 . . . . 0.0 112.549 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.453 ' HA2' HG23 ' B' ' 127' ' ' VAL . . . -150.75 -164.03 11.7 Favored Glycine 0 C--N 1.28 -2.557 0 CA-C-N 113.297 -1.774 . . . . 0.0 109.573 174.449 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -89.81 142.47 27.66 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 176.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -101.51 -10.6 19.99 Favored 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.697 -176.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.3 p -132.3 142.32 49.32 Favored 'General case' 0 C--N 1.29 -2.005 0 O-C-N 122.114 -0.366 . . . . 0.0 110.157 178.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -108.7 -174.9 2.63 Favored 'General case' 0 C--O 1.254 1.326 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 29.9 ttpp -77.08 -27.36 54.18 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -178.05 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -75.2 -27.19 59.5 Favored 'General case' 0 C--O 1.246 0.912 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 105.15 40.87 2.03 Favored Glycine 0 N--CA 1.433 -1.52 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.53 173.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -117.42 150.38 38.97 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-O 120.796 0.331 . . . . 0.0 110.47 176.443 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.66 115.01 3.97 Favored Glycine 0 N--CA 1.426 -1.987 0 N-CA-C 110.711 -0.956 . . . . 0.0 110.711 179.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 69.5 mt -86.41 101.55 13.23 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -157.19 167.81 29.26 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 -177.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.404 ' CE1' ' HB2' ' A' ' 37' ' ' LEU . 11.9 m-85 -90.21 127.51 36.14 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.352 175.425 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.427 ' CD1' HG12 ' A' ' 74' ' ' VAL . 51.0 mm -99.17 122.91 51.47 Favored 'Isoleucine or valine' 0 C--O 1.261 1.7 0 C-N-CA 120.193 -0.603 . . . . 0.0 109.508 177.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.491 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 14.1 m-85 -114.48 135.93 53.57 Favored 'General case' 0 N--CA 1.427 -1.623 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 174.6 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.406 ' HB1' ' HB1' ' A' ' 69' ' ' ALA . . . -105.45 109.17 21.05 Favored 'General case' 0 C--N 1.278 -2.529 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 -178.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 11.1 t70 46.95 40.45 9.28 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.614 1.566 . . . . 0.0 111.319 -177.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 96.03 -14.35 64.72 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.339 -0.846 . . . . 0.0 113.792 177.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.434 ' HD2' ' N ' ' A' ' 97' ' ' LYS . 8.4 mptt -92.29 140.84 29.2 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' MET . . . . . 0.413 ' HG3' ' CD1' ' A' ' 93' ' ' TYR . 1.9 mpt? -85.08 105.05 15.53 Favored 'General case' 0 C--N 1.297 -1.689 0 O-C-N 122.294 -0.254 . . . . 0.0 111.63 -176.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 30.0 t -66.59 -44.91 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-O 122.256 1.027 . . . . 0.0 108.456 -179.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.428 ' ND2' HD11 ' B' ' 138' ' ' LEU . 0.1 OUTLIER -56.45 -43.61 79.67 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 113.37 -1.741 . . . . 0.0 110.721 -179.259 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -66.83 -51.44 55.57 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.517 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.48 -45.24 76.98 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.111 -0.95 . . . . 0.0 112.066 -177.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.2 mt -54.65 -52.67 61.58 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 178.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 62.0 t -71.01 -37.83 69.43 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.737 -178.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 23.5 ttp85 -69.94 -21.49 63.26 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 -179.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -95.93 3.71 53.33 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.977 175.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.74 29.49 73.84 Favored Glycine 0 C--N 1.331 0.287 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.792 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.9 mt -95.08 -15.03 23.73 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.192 0.52 . . . . 0.0 110.198 -179.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -149.24 162.27 40.35 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -106.22 171.47 7.33 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 10.2 p -93.56 133.57 34.23 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 177.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -98.09 121.56 40.15 Favored 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 174.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -91.95 98.3 11.49 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -177.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 42.5 t -128.09 143.54 40.55 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.584 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.286 -174.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -97.66 -60.95 1.46 Allowed 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 173.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -135.93 137.79 26.1 Favored Pre-proline 0 C--N 1.31 -1.132 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 170.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -76.02 -167.68 0.47 Allowed 'Trans proline' 0 C--O 1.25 1.105 0 C-N-CA 121.86 1.707 . . . . 0.0 112.602 -175.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -62.78 -42.88 99.89 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.927 -177.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 72.27 -60.08 0.54 Allowed 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 125.314 1.446 . . . . 0.0 111.429 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 23.4 m -167.32 -58.78 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 125.783 1.633 . . . . 0.0 107.821 179.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 . . . . . 0 N--CA 1.442 -0.839 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -179.962 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.949 0 N-CA-C 112.591 -0.203 . . . . 0.0 112.591 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 24.8 p -81.8 83.11 7.25 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-O 121.425 0.631 . . . . 0.0 110.158 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 7.2 p -156.48 133.59 2.32 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.393 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -178.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . 68.52 -72.27 0.1 Allowed 'General case' 0 C--O 1.24 0.57 0 C-N-CA 125.208 1.403 . . . . 0.0 112.207 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -159.25 131.66 6.69 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 127' ' ' VAL . . . . . 0.453 HG23 ' HA2' ' A' ' 79' ' ' GLY . 26.8 m -98.41 142.32 14.83 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.34 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 174.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -78.99 -51.82 9.08 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.965 -172.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -82.1 158.48 67.06 Favored Pre-proline 0 C--N 1.315 -0.924 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.073 -177.259 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -75.73 154.35 39.07 Favored 'Trans proline' 0 C--O 1.252 1.186 0 C-N-CA 122.418 2.079 . . . . 0.0 112.091 176.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 131' ' ' ASN . . . . . 0.516 ' ND2' ' HB3' ' A' ' 77' ' ' ASP . 23.5 t-20 -85.85 73.84 10.28 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 175.833 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.511 ' C ' ' H ' ' B' ' 134' ' ' HIS . 26.6 p-10 -137.76 26.94 2.75 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.179 -172.479 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 1.7 m -81.58 27.75 0.43 Allowed 'General case' 0 CA--C 1.568 1.654 0 CA-C-O 122.76 1.267 . . . . 0.0 110.005 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . 0.511 ' H ' ' C ' ' B' ' 132' ' ' ASN . 5.5 p80 -162.63 21.19 0.09 Allowed 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 126.623 1.969 . . . . 0.0 107.852 -176.016 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.411 ' HB2' ' HB2' ' B' ' 132' ' ' ASN . 25.2 tt0 -67.75 -48.34 66.68 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.212 -173.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -60.08 -33.56 72.25 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.069 -0.969 . . . . 0.0 112.937 -178.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 91.8 mt -59.54 -47.71 84.48 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.324 0.583 . . . . 0.0 109.538 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 138' ' ' LEU . . . . . 0.428 HD11 ' ND2' ' A' ' 100' ' ' ASN . 4.4 mm? -68.5 -40.61 80.81 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.404 178.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 -63.96 -36.46 84.05 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.486 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -68.63 -43.72 75.73 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.707 0.289 . . . . 0.0 110.718 175.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.0 m -61.41 -45.39 94.52 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.945 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.55 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 0.1 OUTLIER -68.78 -43.11 76.41 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.207 178.434 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -60.1 -44.36 94.9 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.803 0.335 . . . . 0.0 110.722 179.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 144' ' ' GLN . . . . . 0.464 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 35.5 tt0 -67.43 -47.85 69.01 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.774 -179.703 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.91 85.4 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -177.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 146' ' ' LYS . . . . . 0.55 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 84.6 mttt -62.25 -47.35 84.76 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.888 175.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -69.92 -31.36 69.09 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 123.447 0.467 . . . . 0.0 112.019 -175.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 11.8 mm-40 -79.95 -17.68 52.36 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.89 178.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . 0.597 ' O ' ' HB3' ' B' ' 154' ' ' SER . 13.0 mmmm 60.25 65.45 1.08 Allowed 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -174.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 97.6 mt -98.98 123.44 43.28 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 115.925 -0.579 . . . . 0.0 112.287 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 49.45 -88.51 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 126.324 1.85 . . . . 0.0 114.951 173.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 48.3 mt -66.29 -37.35 79.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.165 0.507 . . . . 0.0 110.226 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 62.7 m95 -77.25 -21.0 54.38 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.575 -175.095 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 154' ' ' SER . . . . . 0.597 ' HB3' ' O ' ' B' ' 149' ' ' LYS . 80.7 p -91.89 21.11 5.11 Favored 'General case' 0 N--CA 1.419 -1.989 0 CA-C-O 121.338 0.59 . . . . 0.0 111.049 -178.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -64.33 -31.97 73.38 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 170.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 27.0 t70 . . . . . 0 N--CA 1.42 -1.948 0 CA-C-N 113.076 -1.875 . . . . 0.0 107.832 -179.378 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.252 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.3 t 179.65 158.19 0.67 Allowed 'General case' 0 N--CA 1.438 -1.056 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 178.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.7 p -79.07 130.4 35.47 Favored 'General case' 0 N--CA 1.415 -2.175 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 173.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.1 t -74.4 132.74 42.24 Favored 'General case' 0 N--CA 1.421 -1.924 0 CA-C-O 121.588 0.709 . . . . 0.0 110.195 -174.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.41 ' N ' ' HD2' ' A' ' 5' ' ' LYS . 3.1 mptp? -86.53 112.78 21.87 Favored 'General case' 0 N--CA 1.428 -1.554 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 179.018 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 53.2 tptt -63.68 -46.06 87.26 Favored 'General case' 0 C--N 1.317 -0.841 0 O-C-N 123.962 0.789 . . . . 0.0 109.87 -176.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 93.6 mt 59.73 -169.27 0.15 Allowed 'General case' 0 C--O 1.239 0.532 0 O-C-N 124.368 1.043 . . . . 0.0 111.11 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.6 m80 -123.22 109.08 13.53 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -177.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -96.6 145.45 25.73 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.68 175.332 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -139.28 149.72 61.76 Favored Pre-proline 0 C--N 1.287 -2.15 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -78.39 140.96 17.61 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 122.272 1.981 . . . . 0.0 113.172 -177.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.416 ' O ' ' HB ' ' A' ' 72' ' ' ILE . . . -132.24 154.83 49.24 Favored 'General case' 0 N--CA 1.424 -1.761 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.433 178.779 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.46 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 50.0 m -98.52 122.46 41.74 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.2 tp -66.56 118.84 10.73 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 176.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 39.0 mm -90.09 -56.9 4.69 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -165.0 153.93 12.47 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.406 ' HB2' ' HG2' ' A' ' 63' ' ' LYS . . . -111.25 123.11 49.54 Favored 'General case' 0 C--N 1.287 -2.15 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 176.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.3 mp -90.79 -64.32 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -175.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.428 ' CG ' ' HZ2' ' A' ' 49' ' ' LYS . 20.3 m-20 -130.65 -173.71 3.15 Favored 'General case' 0 C--N 1.31 -1.138 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.67 54.63 4.39 Favored Glycine 0 C--N 1.314 -0.654 0 N-CA-C 111.401 -0.68 . . . . 0.0 111.401 -178.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.54 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 4.2 p-10 -177.14 -36.51 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -178.115 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 p -111.33 112.06 23.55 Favored 'General case' 0 N--CA 1.422 -1.832 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.92 -178.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.8 m -131.63 143.19 41.14 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.645 0 CA-C-N 114.6 -1.182 . . . . 0.0 108.178 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -104.8 117.77 34.88 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 122.023 -0.423 . . . . 0.0 110.069 -176.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.2 mp -120.49 147.01 45.69 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.502 -179.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.632 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 44.1 ttm -108.15 108.96 20.25 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 175.128 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -115.38 130.7 56.97 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -178.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 32.4 pttt 41.77 35.74 0.54 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.849 1.26 . . . . 0.0 113.559 -174.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.44 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 95.32 -0.92 64.07 Favored Glycine 0 N--CA 1.442 -0.9 0 CA-C-N 114.929 -1.032 . . . . 0.0 114.668 177.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.632 ' O ' ' HA ' ' A' ' 26' ' ' MET . 1.8 mp0 -99.09 105.8 34.33 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 117.973 0.886 . . . . 0.0 111.458 178.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.44 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 1.7 Cg_endo -82.79 104.13 1.26 Allowed 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 122.261 1.974 . . . . 0.0 109.686 173.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 86.8 mtp -128.54 143.25 50.93 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 120.658 0.266 . . . . 0.0 110.562 -177.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.8 m -80.48 116.22 20.41 Favored 'General case' 0 N--CA 1.421 -1.92 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 174.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -98.19 154.62 17.64 Favored 'General case' 0 C--N 1.293 -1.891 0 C-N-CA 124.04 0.936 . . . . 0.0 111.551 -177.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.54 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -122.47 122.98 40.23 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 103.73 -2.693 . . . . 0.0 103.73 174.048 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.6 mp -61.77 126.0 25.81 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 123.389 0.431 . . . . 0.0 111.766 -177.184 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.7 mt -57.63 134.76 56.45 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.364 175.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.527 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 44.0 mt 70.04 16.77 7.5 Favored 'General case' 0 C--O 1.215 -0.714 0 C-N-CA 124.957 1.303 . . . . 0.0 113.002 179.354 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.49 HG21 HD21 ' A' ' 100' ' ' ASN . 55.6 t -119.49 127.5 75.86 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.755 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 177.557 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -137.15 129.52 29.78 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 123.432 0.457 . . . . 0.0 110.179 177.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.9 m -80.98 121.29 80.65 Favored Pre-proline 0 N--CA 1.426 -1.657 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 174.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -69.38 97.41 0.6 Allowed 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 122.186 1.924 . . . . 0.0 112.791 -178.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -62.68 122.97 17.18 Favored 'General case' 0 C--O 1.246 0.919 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.992 177.049 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.7 m -102.97 159.31 15.62 Favored 'General case' 0 N--CA 1.42 -1.974 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 177.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.472 ' HE2' ' HA ' ' A' ' 45' ' ' LYS . 0.4 OUTLIER -49.18 -34.84 15.44 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 -173.094 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -103.61 -59.16 0.08 OUTLIER Pre-proline 0 CA--C 1.555 1.137 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 -179.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.91 143.89 29.93 Favored 'Trans proline' 0 C--N 1.369 1.621 0 C-N-CA 121.709 1.606 . . . . 0.0 114.62 -174.117 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.9 mmmt -95.81 1.68 53.33 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.385 178.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.498 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.0 mmpt? -97.69 14.34 27.14 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 174.116 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 87.8 -73.06 2.38 Favored Glycine 0 N--CA 1.422 -2.239 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.495 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.3 p -141.52 129.24 21.72 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.719 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -66.36 -33.89 76.73 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -171.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -77.79 -46.2 22.3 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -178.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -95.9 -22.21 17.58 Favored 'General case' 0 C--N 1.309 -1.173 0 C-N-CA 119.937 -0.705 . . . . 0.0 112.706 -172.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -53.59 -58.16 13.24 Favored Glycine 0 CA--C 1.535 1.297 0 CA-C-O 119.634 -0.537 . . . . 0.0 113.7 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -58.15 -22.57 57.12 Favored 'Trans proline' 0 C--N 1.361 1.203 0 C-N-CA 122.792 2.328 . . . . 0.0 113.154 177.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -82.69 -37.94 24.08 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.949 0.404 . . . . 0.0 109.914 178.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.63 -47.14 85.05 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.799 177.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.529 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 16.3 p -62.16 -44.7 96.04 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.367 179.454 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.59 -47.52 81.91 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 122.684 0.394 . . . . 0.0 111.499 -179.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -64.37 -40.64 96.23 Favored 'General case' 0 C--O 1.244 0.807 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.353 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 38.7 m -61.06 -45.14 95.98 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.9 178.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.538 ' O ' ' HG3' ' A' ' 67' ' ' GLU . 61.4 mtpt -59.83 -52.94 63.32 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.593 -178.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.468 ' N ' ' HE2' ' A' ' 64' ' ' LYS . 0.3 OUTLIER -62.14 -33.46 74.54 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 179.258 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 53.3 tpp -65.5 -44.53 86.75 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 120.713 0.292 . . . . 0.0 110.8 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.7 m -75.39 -25.03 17.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.972 179.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.538 ' HG3' ' O ' ' A' ' 63' ' ' LYS . 44.9 mt-10 -71.43 -31.57 67.37 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.915 0.388 . . . . 0.0 110.053 174.059 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -78.13 -9.67 59.27 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 123.858 0.863 . . . . 0.0 111.319 -177.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.03 128.36 36.26 Favored 'General case' 0 C--O 1.252 1.211 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.459 -178.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 49.1 mttp -68.16 -47.81 67.03 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 105.755 -1.942 . . . . 0.0 105.755 171.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.415 ' H ' ' HB3' ' A' ' 95' ' ' ASP . 4.2 mtpm? -132.96 133.51 43.28 Favored 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 105.25 -2.13 . . . . 0.0 105.25 -179.108 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.416 ' HB ' ' O ' ' A' ' 12' ' ' ALA . 3.8 mp -91.72 119.96 39.98 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.361 0 N-CA-C 105.803 -1.925 . . . . 0.0 105.803 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.54 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 5.5 mm-40 -112.53 133.5 54.56 Favored 'General case' 0 C--N 1.294 -1.817 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.067 -171.225 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.5 m -110.94 125.62 68.28 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 174.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -114.01 131.33 56.39 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -178.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.46 ' CE1' ' HB2' ' A' ' 81' ' ' ARG . 60.3 t80 -102.47 122.58 44.6 Favored 'General case' 0 N--CA 1.421 -1.878 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.382 178.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.462 ' CG ' ' H ' ' A' ' 78' ' ' LYS . 14.9 t70 -94.52 -173.51 3.06 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-N 114.925 -1.034 . . . . 0.0 108.442 178.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.462 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 82.1 mttt -81.58 17.03 1.52 Allowed 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 125.002 1.321 . . . . 0.0 111.184 -173.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -107.19 -121.91 4.79 Favored Glycine 0 N--CA 1.44 -1.083 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.377 -178.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -110.81 149.14 30.99 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 122.509 0.323 . . . . 0.0 110.638 -176.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.46 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . 43.2 ttp180 -110.23 -8.16 14.78 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.577 0.703 . . . . 0.0 109.172 177.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 2.1 p -148.95 151.11 34.02 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.515 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -108.38 153.18 23.65 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 108.355 -0.979 . . . . 0.0 108.355 176.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -69.0 -15.27 63.44 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 123.533 0.733 . . . . 0.0 111.431 -176.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -74.57 -10.13 59.25 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.293 0.568 . . . . 0.0 109.793 176.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 90.84 43.11 4.88 Favored Glycine 0 CA--C 1.496 -1.108 0 N-CA-C 110.06 -1.216 . . . . 0.0 110.06 -178.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.43 ' CG ' ' HB2' ' A' ' 35' ' ' ARG . 9.8 tpp180 -126.86 142.25 51.6 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 -176.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.23 146.27 23.73 Favored Glycine 0 N--CA 1.439 -1.159 0 N-CA-C 109.821 -1.312 . . . . 0.0 109.821 177.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.403 ' O ' ' HA ' ' A' ' 81' ' ' ARG . 93.0 mt -126.64 119.91 28.2 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.05 161.65 40.39 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.43 ' CZ ' ' HB3' ' A' ' 100' ' ' ASN . 29.9 t80 -91.89 123.45 35.28 Favored 'General case' 0 N--CA 1.412 -2.369 0 N-CA-C 105.469 -2.049 . . . . 0.0 105.469 174.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 38.1 mm -99.44 130.84 47.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 CA-C-O 120.879 0.371 . . . . 0.0 110.736 -172.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.54 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 87.4 m-85 -122.09 147.59 45.93 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 174.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.13 98.95 8.59 Favored 'General case' 0 C--N 1.284 -2.241 0 N-CA-C 105.342 -2.095 . . . . 0.0 105.342 171.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.415 ' HB3' ' H ' ' A' ' 71' ' ' LYS . 4.2 p30 45.41 31.24 0.83 Allowed 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 125.045 1.338 . . . . 0.0 113.608 -175.502 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.49 -5.41 35.36 Favored Glycine 0 CA--C 1.524 0.633 0 CA-C-N 115.949 -0.568 . . . . 0.0 113.712 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -83.26 125.02 31.14 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 173.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 1.5 mpt? -67.4 102.85 1.17 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 117.868 0.303 . . . . 0.0 110.26 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 49.5 t -66.5 -38.69 82.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.49 HD21 HG21 ' A' ' 39' ' ' VAL . 6.7 t-20 -57.78 -51.68 68.59 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.438 176.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.506 ' O ' ' HG3' ' A' ' 105' ' ' ARG . 35.1 tt0 -69.96 -34.94 74.07 Favored 'General case' 0 C--O 1.204 -1.32 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.696 -174.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.49 -43.3 88.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.925 0.393 . . . . 0.0 110.293 177.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.7 mt -65.33 -42.81 92.53 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.757 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 100' ' ' ASN . 84.2 t -65.48 -41.48 91.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.346 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.506 ' HG3' ' O ' ' A' ' 101' ' ' GLU . 17.1 mtm180 -70.29 -16.39 63.01 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.082 0.553 . . . . 0.0 111.701 -178.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -105.56 1.85 27.84 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.586 176.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 59.55 44.37 96.84 Favored Glycine 0 C--O 1.219 -0.795 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.525 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.3 mt -106.27 10.4 31.75 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -177.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -165.5 170.33 14.51 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 178.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.408 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 96.8 mttt -116.57 147.12 42.14 Favored 'General case' 0 CA--C 1.491 -1.296 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 175.021 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.527 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 99.1 t -73.79 133.85 30.81 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 C-N-CA 120.122 -0.631 . . . . 0.0 109.744 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -86.33 154.8 20.96 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -72.03 139.38 48.5 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -172.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.464 HG11 ' ND2' ' B' ' 131' ' ' ASN . 93.8 t -88.56 151.92 3.43 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 CA-C-N 113.511 -1.677 . . . . 0.0 109.044 -177.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -84.6 72.89 10.63 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 122.59 1.186 . . . . 0.0 108.129 176.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -106.24 143.65 27.37 Favored Pre-proline 0 N--CA 1.429 -1.491 0 CA-C-N 114.062 -1.427 . . . . 0.0 108.269 -175.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -87.38 -165.17 0.22 Allowed 'Trans proline' 0 N--CA 1.438 -1.788 0 C-N-CA 121.826 1.684 . . . . 0.0 110.107 175.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -87.17 -25.39 24.09 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-O 121.088 0.47 . . . . 0.0 111.323 -178.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -148.29 105.83 3.67 Favored 'General case' 0 CA--C 1.49 -1.341 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -176.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 12.5 t -141.62 13.75 2.13 Favored 'General case' 0 C--N 1.283 -2.304 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 171.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 . . . . . 0 N--CA 1.43 -1.454 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 -178.63 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.59 0 N-CA-C 110.549 -1.021 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 12.0 p -79.06 -18.86 52.68 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 117.32 0.56 . . . . 0.0 112.079 -178.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 30.3 m -78.81 128.63 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.771 0 CA-C-O 122.062 0.934 . . . . 0.0 113.01 -178.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -151.24 83.04 1.31 Allowed 'General case' 0 C--N 1.291 -1.975 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 174.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -78.47 81.73 4.79 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-O 122.159 0.98 . . . . 0.0 111.987 -174.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 2.7 m -120.15 85.04 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.282 -2.346 0 CA-C-N 113.836 -1.529 . . . . 0.0 107.182 171.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 128' ' ' TYR . . . . . 0.474 ' O ' ' HD3' ' B' ' 130' ' ' PRO . 36.8 t80 -98.3 95.62 7.5 Favored 'General case' 0 N--CA 1.41 -2.451 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.622 -175.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -97.81 101.88 11.87 Favored Pre-proline 0 C--N 1.3 -1.58 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.231 173.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . 0.474 ' HD3' ' O ' ' B' ' 128' ' ' TYR . 2.7 Cg_exo -74.05 146.9 37.59 Favored 'Trans proline' 0 C--O 1.251 1.16 0 C-N-CA 121.721 1.614 . . . . 0.0 109.544 175.748 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 131' ' ' ASN . . . . . 0.464 ' ND2' HG11 ' A' ' 114' ' ' VAL . 4.3 p-10 -79.35 145.45 33.42 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -95.84 -58.13 2.18 Favored 'General case' 0 C--N 1.291 -1.959 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -179.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 133' ' ' THR . . . . . 0.452 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 6.3 p 56.06 17.43 2.66 Favored 'General case' 0 C--O 1.213 -0.864 0 C-N-CA 125.884 1.673 . . . . 0.0 113.392 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . 0.5 ' O ' ' HG ' ' B' ' 138' ' ' LEU . 64.4 m-70 67.46 25.04 8.62 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.955 1.302 . . . . 0.0 109.373 -179.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -37.44 -63.67 0.43 Allowed 'General case' 0 C--O 1.205 -1.253 0 C-N-CA 126.279 1.832 . . . . 0.0 113.907 -174.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -61.96 -33.55 74.49 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -170.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 88.0 mt -70.47 -47.25 61.48 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 122.052 0.929 . . . . 0.0 108.775 176.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 138' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' B' ' 134' ' ' HIS . 62.5 mt -67.79 -41.18 83.58 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 114.387 -1.279 . . . . 0.0 111.763 -176.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -75.44 -19.73 59.29 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.216 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 17.3 tppt? -72.6 -38.89 67.68 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 173.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 45.2 m -66.81 -35.45 80.09 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.404 174.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.569 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 24.6 tt0 -62.68 -54.08 44.81 Favored 'General case' 0 C--O 1.205 -1.24 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.245 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.56 -35.92 66.25 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 123.19 0.596 . . . . 0.0 111.226 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 144' ' ' GLN . . . . . 0.526 ' HA ' HE21 ' B' ' 144' ' ' GLN . 0.0 OUTLIER -70.97 -47.85 56.65 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.952 176.95 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -65.07 -35.41 81.07 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 122.45 0.3 . . . . 0.0 111.66 -178.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 146' ' ' LYS . . . . . 0.569 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 82.6 mttt -60.88 -46.18 91.63 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 177.009 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -62.53 -35.52 79.67 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.082 -177.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 43.7 mm-40 -88.86 -6.43 57.33 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-N 114.592 -1.185 . . . . 0.0 112.41 -174.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . 0.563 ' O ' ' HB2' ' B' ' 154' ' ' SER . 35.4 mmtp 53.61 54.35 10.13 Favored 'General case' 0 CA--C 1.512 -0.497 0 O-C-N 123.964 0.79 . . . . 0.0 110.927 -178.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 95.6 mt -82.92 114.76 21.43 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.783 -179.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 51.31 -93.28 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.475 1.51 . . . . 0.0 114.734 176.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 12.1 mt -64.38 -36.19 76.47 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.851 0 C-N-CA 122.605 0.362 . . . . 0.0 111.748 -179.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 153' ' ' TRP . . . . . 0.408 ' CH2' ' HG2' ' A' ' 110' ' ' LYS . 60.3 m95 -67.97 -23.14 65.01 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.043 0.449 . . . . 0.0 110.363 -179.284 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 154' ' ' SER . . . . . 0.563 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 10.1 t -85.79 42.98 1.0 Allowed 'General case' 0 N--CA 1.442 -0.871 0 CA-C-O 122.116 0.96 . . . . 0.0 108.792 179.227 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -74.22 -22.66 59.26 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 114.684 -1.143 . . . . 0.0 108.41 172.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 19.5 t70 . . . . . 0 N--CA 1.432 -1.355 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 175.305 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.575 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 73.1 p 60.33 1.86 0.41 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 126.453 1.901 . . . . 0.0 115.978 175.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.457 ' HA ' ' CE1' ' A' ' 8' ' ' HIS . 73.0 m 45.21 68.58 0.55 Allowed 'General case' 0 C--O 1.237 0.397 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.9 t -110.06 176.01 5.22 Favored 'General case' 0 N--CA 1.419 -2.005 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 176.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.8 mttt 71.08 -83.57 0.03 OUTLIER 'General case' 0 C--O 1.238 0.461 0 C-N-CA 125.298 1.439 . . . . 0.0 110.558 -177.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -121.69 -161.8 0.94 Allowed 'General case' 0 N--CA 1.426 -1.67 0 C-N-CA 123.847 0.859 . . . . 0.0 109.802 -176.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 49.5 mt -97.7 151.03 20.55 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.457 ' CE1' ' HA ' ' A' ' 3' ' ' SER . 23.0 m170 -104.87 131.0 52.9 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -177.059 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.417 ' HA ' ' O ' ' A' ' 74' ' ' VAL . 36.6 ttmt -121.01 135.16 55.28 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 114.377 -1.283 . . . . 0.0 109.094 -179.122 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -138.95 157.35 71.71 Favored Pre-proline 0 C--N 1.296 -1.735 0 C-N-CA 122.504 0.322 . . . . 0.0 110.848 177.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -71.18 148.09 55.24 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 122.358 2.039 . . . . 0.0 112.75 -178.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.24 161.51 37.25 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.951 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.419 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 20.4 m -109.78 145.36 36.81 Favored 'General case' 0 C--N 1.293 -1.891 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 176.276 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.7 tp -83.95 134.98 34.64 Favored 'General case' 0 C--N 1.295 -1.769 0 C-N-CA 120.089 -0.645 . . . . 0.0 109.752 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 41.3 mm -91.79 -57.58 4.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 171.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -168.84 141.73 2.82 Favored 'General case' 0 N--CA 1.416 -2.171 0 CA-C-N 115.164 -0.925 . . . . 0.0 108.899 178.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -99.93 110.1 22.44 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 171.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.6 mp -89.54 -53.79 8.74 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-O 121.376 0.608 . . . . 0.0 110.034 -174.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -129.99 169.08 15.72 Favored 'General case' 0 C--N 1.291 -1.947 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -175.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.31 -29.48 73.27 Favored Glycine 0 C--N 1.306 -1.104 0 O-C-N 123.987 0.805 . . . . 0.0 111.775 178.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.552 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 2.3 m-20 -96.99 -46.99 5.98 Favored 'General case' 0 CA--C 1.492 -1.274 0 CA-C-O 120.952 0.406 . . . . 0.0 110.866 177.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.6 m -96.72 113.33 24.87 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-O 121.472 0.653 . . . . 0.0 111.84 -171.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.8 p -135.07 144.76 33.56 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.182 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.109 -177.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -106.98 123.01 47.57 Favored 'General case' 0 CA--C 1.49 -1.353 0 O-C-N 121.63 -0.669 . . . . 0.0 111.524 -179.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.9 mp -125.82 151.03 47.34 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.987 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.481 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 25.9 ttt -117.52 106.26 12.96 Favored 'General case' 0 C--N 1.289 -2.054 0 CA-C-N 114.911 -1.041 . . . . 0.0 108.871 -178.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -113.39 123.66 50.6 Favored 'General case' 0 C--N 1.287 -2.131 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 96.4 mttt 58.79 27.73 16.43 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 123.399 0.679 . . . . 0.0 111.803 177.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.432 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 93.82 6.6 61.99 Favored Glycine 0 N--CA 1.44 -1.062 0 C-N-CA 120.83 -0.7 . . . . 0.0 113.104 179.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.481 ' O ' ' HA ' ' A' ' 26' ' ' MET . 17.9 mm-40 -107.3 98.37 22.64 Favored Pre-proline 0 C--N 1.318 -0.775 0 CA-C-N 116.85 0.325 . . . . 0.0 110.562 178.581 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.432 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 6.0 Cg_exo -80.76 97.16 1.0 Allowed 'Trans proline' 0 C--O 1.243 0.742 0 C-N-CA 122.98 2.453 . . . . 0.0 110.565 174.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 49.8 ttm -112.87 145.62 40.37 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.387 -176.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 32.1 m -82.16 120.08 24.87 Favored 'General case' 0 N--CA 1.42 -1.957 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 174.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.448 ' HA ' ' O ' ' A' ' 88' ' ' GLY . 74.9 m-85 -114.38 154.2 28.51 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-O 121.399 0.619 . . . . 0.0 111.682 -177.069 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.552 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 37.8 mtp180 -118.23 148.09 42.75 Favored 'General case' 0 C--N 1.288 -2.109 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.058 164.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.414 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 5.2 mp -77.66 123.32 26.5 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.668 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 68.1 mt -63.94 142.04 58.55 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.432 176.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.63 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 67.3 mt 72.65 10.56 5.59 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.336 1.055 . . . . 0.0 112.503 177.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 97.5 t -113.49 140.85 31.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.223 0.535 . . . . 0.0 111.979 -176.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -135.1 107.52 7.31 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 172.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 82.3 p -109.43 -11.04 0.12 Allowed Pre-proline 0 CA--C 1.571 1.772 0 N-CA-C 116.555 2.058 . . . . 0.0 116.555 179.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -62.27 152.91 73.57 Favored 'Trans proline' 0 C--N 1.403 3.401 0 CA-C-N 122.941 2.086 . . . . 0.0 111.445 -175.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.563 ' OE2' ' HG2' ' A' ' 53' ' ' LYS . 7.9 tp10 -48.35 127.44 12.95 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 124.404 1.065 . . . . 0.0 110.859 -177.433 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.5 t -50.15 -66.62 0.36 Allowed 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -163.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.447 ' HB2' ' HE2' ' A' ' 48' ' ' LYS . 2.2 mptp? -96.97 -0.12 47.96 Favored 'General case' 0 CA--C 1.496 -1.109 0 C-N-CA 120.107 -0.637 . . . . 0.0 110.147 177.444 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 29.1 m-70 80.1 131.94 0.04 OUTLIER Pre-proline 0 N--CA 1.472 0.644 0 C-N-CA 124.707 1.203 . . . . 0.0 108.52 -170.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -37.84 119.84 0.35 Allowed 'Trans proline' 0 N--CA 1.492 1.41 1 C-N-CA 125.578 4.185 . . . . 0.0 118.935 -166.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.447 ' HE2' ' HB2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -113.38 -39.47 4.11 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 167.307 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -91.93 -37.04 13.11 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 176.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 138.72 -47.93 0.9 Allowed Glycine 0 N--CA 1.431 -1.669 0 N-CA-C 108.097 -2.001 . . . . 0.0 108.097 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -141.3 104.94 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.41 -2.467 0 C-N-CA 124.903 1.281 . . . . 0.0 109.139 174.341 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -91.48 -56.88 2.96 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.347 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.563 ' HG2' ' OE2' ' A' ' 43' ' ' GLU . 11.6 ptmm? -87.17 -14.72 40.4 Favored 'General case' 0 CA--C 1.499 -1.016 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 176.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 76.78 86.05 0.08 Allowed 'General case' 0 C--O 1.244 0.772 0 C-N-CA 124.572 1.149 . . . . 0.0 111.049 179.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -58.22 -58.71 13.14 Favored Glycine 0 CA--C 1.537 1.423 0 CA-C-N 114.868 -1.06 . . . . 0.0 112.611 175.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -53.89 -34.98 78.33 Favored 'Trans proline' 0 C--N 1.368 1.601 0 C-N-CA 123.256 2.637 . . . . 0.0 113.764 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -66.4 -38.3 87.19 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.29 0.567 . . . . 0.0 109.628 -179.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.92 -48.44 63.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.871 177.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.453 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 19.1 m -57.71 -39.61 77.62 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.024 179.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.03 -34.88 78.51 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.142 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -69.63 -41.93 74.98 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 -177.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.461 ' O ' HG22 ' A' ' 66' ' ' VAL . 28.8 m -59.4 -47.99 83.33 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 175.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 59' ' ' SER . 60.8 mtpt -55.23 -51.89 65.14 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.682 178.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -64.22 -34.17 77.47 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -177.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 20.1 mmt -70.36 -47.93 58.7 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.659 177.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.461 HG22 ' O ' ' A' ' 62' ' ' THR . 33.9 m -75.18 -36.53 37.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -176.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -75.28 -23.94 57.49 Favored 'General case' 0 C--O 1.24 0.583 0 O-C-N 122.111 -0.368 . . . . 0.0 111.904 -179.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -78.98 -40.32 31.99 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.057 175.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -56.27 132.66 51.36 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 123.688 0.795 . . . . 0.0 112.329 -177.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -75.02 -50.33 16.87 Favored 'General case' 0 CA--C 1.501 -0.937 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 175.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -104.3 119.91 40.02 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.954 -178.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 69.4 mt -102.3 128.94 54.5 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.664 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 175.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.519 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 23.2 mt-10 -122.5 139.16 54.2 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 120.504 0.192 . . . . 0.0 110.758 -176.201 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.417 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 18.1 m -113.73 128.69 70.5 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 175.062 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -122.62 115.71 22.59 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.0 p90 -91.56 124.89 36.06 Favored 'General case' 0 N--CA 1.417 -2.12 0 CA-C-O 121.409 0.623 . . . . 0.0 111.323 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.452 ' CG ' ' H ' ' A' ' 78' ' ' LYS . 17.1 t70 -91.67 176.8 6.41 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.255 -176.025 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.452 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 18.0 pttm -82.14 -5.65 58.6 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 126.56 1.944 . . . . 0.0 112.109 -177.461 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -81.77 -138.45 2.63 Favored Glycine 0 C--O 1.246 0.87 0 C-N-CA 120.584 -0.817 . . . . 0.0 111.468 176.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -74.22 120.84 20.34 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 176.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -108.56 -8.18 15.56 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 121.82 0.819 . . . . 0.0 109.141 -176.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 10.0 p -139.79 141.11 36.79 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 114.986 -1.007 . . . . 0.0 110.331 179.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.469 ' HB3' ' HB2' ' A' ' 87' ' ' ARG . 22.2 t70 -102.91 134.14 46.83 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 104.823 -2.288 . . . . 0.0 104.823 171.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -60.4 -16.32 34.52 Favored 'General case' 0 CA--C 1.557 1.237 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -169.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -68.39 -22.06 64.66 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.33 0.586 . . . . 0.0 110.157 175.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 105.67 56.31 0.68 Allowed Glycine 0 N--CA 1.436 -1.339 0 N-CA-C 110.462 -1.055 . . . . 0.0 110.462 -176.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . 0.469 ' HB2' ' HB3' ' A' ' 83' ' ' ASP . 32.1 mtm180 -135.86 150.54 49.42 Favored 'General case' 0 CA--C 1.484 -1.568 0 C-N-CA 123.871 0.869 . . . . 0.0 109.639 178.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . 0.448 ' O ' ' HA ' ' A' ' 34' ' ' PHE . . . -93.42 149.72 19.58 Favored Glycine 0 N--CA 1.42 -2.373 0 N-CA-C 109.29 -1.524 . . . . 0.0 109.29 176.182 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 89.3 mt -123.52 120.35 32.64 Favored 'General case' 0 C--N 1.287 -2.116 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 179.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -149.98 167.44 26.69 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 120.832 0.349 . . . . 0.0 110.489 -176.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.504 ' CZ ' ' HB2' ' A' ' 100' ' ' ASN . 5.4 t80 -94.25 133.02 38.22 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 105.618 -1.993 . . . . 0.0 105.618 174.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 44.4 mm -103.32 125.39 57.82 Favored 'Isoleucine or valine' 0 C--O 1.249 1.064 0 CA-C-O 120.919 0.39 . . . . 0.0 110.315 -175.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.519 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 61.8 m-85 -109.63 133.16 53.43 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 177.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.53 103.44 12.96 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -178.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.8 t70 46.98 40.46 9.38 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 125.69 1.596 . . . . 0.0 111.944 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.54 -25.0 24.38 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 115.034 -0.985 . . . . 0.0 113.584 177.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -97.09 160.46 14.33 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 117.081 0.44 . . . . 0.0 110.682 -176.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' MET . . . . . 0.478 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 3.8 mpp? -92.47 116.18 28.75 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -174.371 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 49.1 t -73.05 -46.8 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 120.817 0.342 . . . . 0.0 110.697 -178.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.504 ' HB2' ' CZ ' ' A' ' 91' ' ' TYR . 1.4 m-20 -54.43 -50.92 66.49 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.025 -0.988 . . . . 0.0 112.25 -173.474 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -75.22 -27.34 59.51 Favored 'General case' 0 N--CA 1.426 -1.646 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -179.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.87 -39.78 95.5 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.038 0.447 . . . . 0.0 110.131 176.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 82.8 mt -56.72 -45.91 81.63 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.5 175.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 46.7 t -73.14 -35.4 47.54 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.109 -178.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 13.2 mmm180 -55.92 -41.47 74.61 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.983 0.913 . . . . 0.0 111.862 176.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -87.17 1.42 53.1 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.041 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.503 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 70.22 37.33 71.66 Favored Glycine 0 C--O 1.222 -0.595 0 C-N-CA 121.536 -0.364 . . . . 0.0 112.631 179.087 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 83.6 mt -106.61 -8.85 16.78 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-O 121.01 0.433 . . . . 0.0 110.733 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -147.47 154.28 40.59 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.279 -178.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -105.3 166.23 10.56 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.406 HG13 ' OE2' ' B' ' 142' ' ' GLU . 7.3 p -86.99 122.61 39.12 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 CA-C-O 121.762 0.791 . . . . 0.0 110.914 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.63 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . -94.34 120.95 35.35 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 107.135 -1.431 . . . . 0.0 107.135 174.194 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -83.55 112.38 19.94 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-O 121.554 0.692 . . . . 0.0 111.993 -177.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 86.4 t -88.1 126.15 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.149 0 CA-C-N 114.861 -1.063 . . . . 0.0 108.445 -179.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.483 ' HA ' ' HA ' ' B' ' 130' ' ' PRO . 37.3 p90 -95.18 151.15 19.47 Favored 'General case' 0 C--N 1.282 -2.336 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.141 -177.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -78.07 126.26 83.96 Favored Pre-proline 0 N--CA 1.423 -1.813 0 N-CA-C 105.407 -2.071 . . . . 0.0 105.407 172.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -77.18 -176.94 3.47 Favored 'Trans proline' 0 N--CA 1.441 -1.597 0 C-N-CA 122.013 1.808 . . . . 0.0 114.978 -166.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -101.15 106.9 18.19 Favored 'General case' 0 N--CA 1.412 -2.36 0 CA-C-N 113.496 -1.683 . . . . 0.0 106.613 -175.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -116.52 96.41 5.5 Favored 'General case' 0 C--N 1.282 -2.345 0 CA-C-N 114.96 -1.018 . . . . 0.0 108.728 -175.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 19.5 m 86.18 -33.86 0.04 OUTLIER 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 113.349 -1.75 . . . . 0.0 112.406 172.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 . . . . . 0 C--O 1.243 0.72 0 C-N-CA 123.939 0.896 . . . . 0.0 110.021 179.071 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.853 0 N-CA-C 110.736 -0.945 . . . . 0.0 110.736 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 27.2 m 62.03 -159.38 0.32 Allowed 'General case' 0 C--O 1.246 0.883 0 C-N-CA 123.635 0.774 . . . . 0.0 110.19 -179.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 27.0 m -84.24 10.09 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -179.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -78.01 83.65 4.31 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 176.174 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.8 p90 -86.64 -49.11 7.75 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.752 -174.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 70.3 t 66.4 133.1 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 O-C-N 124.16 0.912 . . . . 0.0 111.764 -176.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -76.3 -60.89 2.14 Favored 'General case' 0 C--N 1.311 -1.101 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.214 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -157.85 171.32 7.59 Favored Pre-proline 0 C--N 1.307 -1.261 0 N-CA-C 107.489 -1.301 . . . . 0.0 107.489 -177.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . 0.483 ' HA ' ' HA ' ' A' ' 115' ' ' TYR . 35.2 Cg_exo -66.02 168.85 14.59 Favored 'Trans proline' 0 C--O 1.245 0.855 0 C-N-CA 122.173 1.915 . . . . 0.0 111.809 174.424 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 131' ' ' ASN . . . . . 0.409 ' HB2' ' OD2' ' A' ' 77' ' ' ASP . 31.4 p-10 -66.87 -42.74 85.12 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 177.238 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.535 ' HA ' ' CB ' ' B' ' 135' ' ' GLU . 29.0 t-20 73.31 4.97 4.98 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 124.81 1.244 . . . . 0.0 113.761 168.163 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 7.1 t -49.06 -53.8 18.71 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 113.585 0.958 . . . . 0.0 113.585 -176.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 11.2 m-70 -135.05 19.99 3.45 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 176.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.535 ' CB ' ' HA ' ' B' ' 132' ' ' ASN . 2.3 tm-20 -57.61 -42.59 83.59 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.451 -1.25 . . . . 0.0 112.459 -172.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -69.81 -42.59 73.49 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-O 121.466 0.651 . . . . 0.0 109.449 -178.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 95.3 mt -60.95 -45.56 94.22 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.317 178.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -60.38 -47.41 86.17 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.743 176.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 139' ' ' ARG . . . . . 0.448 ' HD2' ' OE2' ' B' ' 135' ' ' GLU . 53.3 mtt180 -62.62 -41.08 98.8 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 178.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -64.48 -35.47 81.05 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.553 176.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 30.7 m -68.35 -41.9 80.04 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.228 177.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.464 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 38.5 tt0 -64.56 -50.66 66.42 Favored 'General case' 0 CA--C 1.495 -1.162 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.146 179.513 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . 0.509 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -56.64 -39.22 73.3 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.857 0.723 . . . . 0.0 110.896 -179.097 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 144' ' ' GLN . . . . . 0.469 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 35.4 tt0 -65.1 -47.67 76.39 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.689 178.239 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -63.62 -33.48 75.71 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.02 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 146' ' ' LYS . . . . . 0.516 ' HA ' ' CG ' ' B' ' 153' ' ' TRP . 79.8 mttt -62.4 -45.76 91.68 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.216 177.226 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 34.7 mmtp -66.71 -44.97 80.19 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.602 -178.418 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 22.5 mm-40 -75.43 -10.21 59.25 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.323 -176.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp 58.26 48.94 11.88 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.013 0.925 . . . . 0.0 110.588 -178.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 95.7 mt -86.02 115.39 23.59 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.277 -177.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 151' ' ' ASN . . . . . 0.503 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 40.3 m-80 53.67 -81.47 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 126.107 1.763 . . . . 0.0 113.019 178.248 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 152' ' ' ILE . . . . . 0.495 HG12 ' HE2' ' A' ' 53' ' ' LYS . 67.3 mt -56.85 -60.35 2.08 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.328 0 C-N-CA 124.183 0.993 . . . . 0.0 110.426 -178.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 153' ' ' TRP . . . . . 0.516 ' CG ' ' HA ' ' B' ' 146' ' ' LYS . 62.4 m95 -71.62 -7.83 50.26 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 114.291 -1.322 . . . . 0.0 113.414 -166.683 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 27.1 t -74.93 -0.67 19.42 Favored 'General case' 0 CA--C 1.567 1.633 0 CA-C-O 121.134 0.492 . . . . 0.0 109.808 174.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -64.39 -17.64 63.94 Favored 'General case' 0 C--O 1.25 1.1 0 C-N-CA 124.757 1.223 . . . . 0.0 111.023 173.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 N--CA 1.445 -0.689 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.146 -178.117 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.25 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.6 t -154.33 136.48 14.78 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.7 m -81.3 109.24 15.62 Favored 'General case' 0 N--CA 1.427 -1.593 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.6 m -138.97 96.91 3.2 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-O 121.44 0.638 . . . . 0.0 110.362 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -146.86 -43.29 0.18 Allowed 'General case' 0 C--N 1.298 -1.657 0 CA-C-N 114.922 -1.035 . . . . 0.0 110.263 177.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -70.07 -47.12 63.28 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -177.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.589 HD12 ' NE2' ' B' ' 134' ' ' HIS . 63.1 mt -136.21 -169.97 2.55 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 -177.595 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.538 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 46.3 m-70 -94.81 103.4 15.3 Favored 'General case' 0 C--O 1.212 -0.911 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -113.8 117.68 32.15 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 120.685 0.279 . . . . 0.0 111.239 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.41 ' CD ' ' HZ3' ' A' ' 28' ' ' LYS . 10.9 pt-20 -139.01 157.72 70.95 Favored Pre-proline 0 C--N 1.305 -1.344 0 CA-C-O 119.441 -0.314 . . . . 0.0 110.993 179.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -78.92 147.98 21.76 Favored 'Trans proline' 0 C--O 1.243 0.766 0 C-N-CA 121.998 1.799 . . . . 0.0 111.431 178.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -136.13 156.85 48.09 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 178.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.432 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 87.8 m -94.7 132.83 39.02 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.72 -178.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.433 ' HB2' HD12 ' A' ' 72' ' ' ILE . 60.7 tp -77.04 127.17 32.2 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 120.578 0.228 . . . . 0.0 111.026 -179.101 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 51.0 mm -98.79 -54.7 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 N-CA-C 107.375 -1.342 . . . . 0.0 107.375 172.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.448 ' HZ3' ' HB2' ' A' ' 16' ' ' LYS . 0.1 OUTLIER -170.67 157.15 5.56 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.065 179.46 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.04 120.61 42.94 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 174.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.448 ' HB ' ' O ' ' A' ' 22' ' ' THR . 67.0 mt -89.47 -64.12 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -175.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -129.14 -164.46 1.4 Allowed 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -177.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -88.64 48.33 3.53 Favored Glycine 0 CA--C 1.507 -0.452 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.468 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 1.9 t70 178.5 -61.91 0.01 OUTLIER 'General case' 0 CA--C 1.496 -1.123 0 C-N-CA 125.565 1.546 . . . . 0.0 108.534 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.448 ' O ' ' HB ' ' A' ' 18' ' ' ILE . 24.1 m -76.58 106.71 8.39 Favored 'General case' 0 N--CA 1.404 -2.752 0 CA-C-N 114.094 -1.412 . . . . 0.0 109.995 -174.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 24.6 m -131.63 164.54 34.24 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 -179.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -121.7 114.27 20.89 Favored 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 118.514 0.597 . . . . 0.0 109.812 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.443 ' HB2' ' CE1' ' A' ' 34' ' ' PHE . 7.4 mp -126.32 159.18 33.86 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-O 121.217 0.532 . . . . 0.0 111.517 177.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.432 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 57.5 ttp -114.77 117.08 29.77 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.523 179.252 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.5 p90 -122.91 131.65 53.83 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.41 ' HZ3' ' CD ' ' A' ' 10' ' ' GLU . 54.2 mttp 55.97 27.44 11.21 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.7 0.8 . . . . 0.0 112.514 -176.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 88.97 3.84 75.91 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 121.077 -0.582 . . . . 0.0 112.89 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.41 ' O ' ' HA ' ' A' ' 26' ' ' MET . 14.7 mm100 -106.29 104.96 52.52 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 116.842 0.321 . . . . 0.0 110.744 -179.058 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -78.98 107.37 2.23 Favored 'Trans proline' 0 C--O 1.247 0.962 0 C-N-CA 122.696 2.264 . . . . 0.0 110.264 175.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 65.5 mtt -127.32 154.13 45.32 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-O 121.137 0.494 . . . . 0.0 110.783 -177.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.9 m -81.2 136.62 35.87 Favored 'General case' 0 N--CA 1.42 -1.947 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 175.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.443 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 39.2 m-85 -105.05 149.05 26.13 Favored 'General case' 0 C--N 1.277 -2.568 0 CA-C-O 121.319 0.58 . . . . 0.0 112.257 -178.125 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.468 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 12.7 tpt85 -130.63 119.21 22.12 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 104.285 -2.487 . . . . 0.0 104.285 176.679 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 26.5 mt -83.98 137.76 33.46 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-O 122.142 0.972 . . . . 0.0 112.437 -169.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 98.5 mt -73.38 130.8 40.94 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 114.646 -1.161 . . . . 0.0 110.205 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.493 HD12 ' OH ' ' A' ' 91' ' ' TYR . 87.3 mt 73.78 7.41 4.95 Favored 'General case' 0 C--O 1.212 -0.869 0 C-N-CA 124.464 1.106 . . . . 0.0 113.438 176.106 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.7 t -125.01 125.66 69.9 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.716 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 175.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.46 ' HA ' HH12 ' A' ' 35' ' ' ARG . 11.0 t70 -105.58 140.68 38.29 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 179.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.446 HG22 ' HB3' ' A' ' 21' ' ' ASP . 1.0 OUTLIER -71.73 121.67 85.12 Favored Pre-proline 0 N--CA 1.425 -1.693 0 O-C-N 124.254 0.971 . . . . 0.0 110.399 -171.387 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -61.61 -54.87 1.38 Allowed 'Trans proline' 0 C--O 1.259 1.527 0 C-N-CA 122.65 2.233 . . . . 0.0 109.124 178.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 64.32 168.49 0.17 Allowed 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 125.804 1.642 . . . . 0.0 112.341 178.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.7 t -102.78 66.95 0.96 Allowed 'General case' 0 N--CA 1.397 -3.088 0 N-CA-C 105.295 -2.113 . . . . 0.0 105.295 168.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.7 mttp -49.72 -31.5 11.44 Favored 'General case' 0 N--CA 1.485 1.312 0 CA-C-N 113.797 -1.547 . . . . 0.0 113.618 -174.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . 0.406 ' HB2' ' HB2' ' A' ' 49' ' ' LYS . 76.7 m-70 -134.44 105.38 11.04 Favored Pre-proline 0 C--N 1.288 -2.086 0 N-CA-C 103.424 -2.806 . . . . 0.0 103.424 171.419 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -36.45 -48.77 1.31 Allowed 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 125.062 3.841 . . . . 0.0 116.762 -171.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -77.15 -24.07 51.61 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.172 0.511 . . . . 0.0 111.24 -178.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.406 ' HB2' ' HB2' ' A' ' 46' ' ' HIS . 27.9 mmmt -98.72 -1.09 41.43 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.038 -175.081 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -62.92 -18.7 60.19 Favored Glycine 0 C--N 1.337 0.584 0 CA-C-N 116.215 -0.448 . . . . 0.0 112.525 -178.374 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 41.3 t -67.57 -35.9 74.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 178.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.9 mm-40 -74.08 -24.17 59.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.638 0.733 . . . . 0.0 109.619 -177.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.8 mmtm -83.58 -15.59 48.56 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.758 -1.11 . . . . 0.0 110.533 177.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 65.29 21.64 12.03 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 123.815 0.846 . . . . 0.0 110.229 -176.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -53.6 -50.78 52.13 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-N 114.05 -1.432 . . . . 0.0 113.85 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -50.84 -50.56 13.42 Favored 'Trans proline' 0 C--N 1.37 1.676 0 C-N-CA 122.735 2.29 . . . . 0.0 112.684 176.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -63.07 -42.78 99.73 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.22 -45.59 90.93 Favored 'General case' 0 C--O 1.243 0.761 0 CA-C-O 121.066 0.46 . . . . 0.0 111.353 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.453 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 36.1 p -70.17 -41.91 73.17 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.365 -179.115 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.48 -42.1 92.59 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 122.199 0.2 . . . . 0.0 111.046 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -55.47 -43.9 75.97 Favored 'General case' 0 C--O 1.242 0.686 0 C-N-CA 122.715 0.406 . . . . 0.0 109.929 178.052 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.8 m -63.95 -46.3 85.31 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.033 177.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 59' ' ' SER . 49.7 mttp -57.39 -54.93 41.28 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.227 -179.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.98 -29.69 70.83 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -177.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.576 ' SD ' HG21 ' A' ' 99' ' ' VAL . 49.6 ttm -72.64 -46.12 55.59 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 119.621 -0.831 . . . . 0.0 111.194 179.367 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.8 m -73.39 -30.11 29.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 C-N-CA 120.338 -0.545 . . . . 0.0 112.172 -177.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -76.02 -23.55 55.18 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 120.549 0.214 . . . . 0.0 111.364 177.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -77.53 -31.84 53.61 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.492 0.663 . . . . 0.0 109.829 177.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.463 ' HB1' ' HB1' ' A' ' 94' ' ' ALA . . . -65.89 157.74 29.79 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 114.913 -1.04 . . . . 0.0 112.32 -178.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.53 ' N ' ' HD3' ' A' ' 70' ' ' LYS . 2.3 mppt? -110.42 -39.93 4.79 Favored 'General case' 0 C--N 1.291 -1.95 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 175.397 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.6 mtmt -120.75 121.81 39.02 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 114.748 -1.115 . . . . 0.0 108.506 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.433 HD12 ' HB2' ' A' ' 14' ' ' LEU . 61.0 mt -113.16 135.48 52.52 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.147 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 178.268 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.517 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 33.8 mm-40 -112.45 141.4 46.23 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -179.007 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.3 m -114.75 127.31 72.32 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.076 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 174.083 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.538 ' HA ' ' O ' ' A' ' 8' ' ' HIS . 40.2 tt0 -121.83 117.23 26.01 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.477 -179.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.514 ' O ' ' HB3' ' A' ' 7' ' ' LEU . 50.7 m-85 -95.84 143.41 27.08 Favored 'General case' 0 C--O 1.254 1.324 0 C-N-CA 123.781 0.832 . . . . 0.0 109.437 -177.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.454 ' HB3' ' OD1' ' B' ' 131' ' ' ASN . 8.2 t70 -87.98 -174.26 4.62 Favored 'General case' 0 C--O 1.253 1.255 0 CA-C-O 120.96 0.41 . . . . 0.0 111.117 -173.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.464 ' HE2' ' HA ' ' A' ' 78' ' ' LYS . 9.3 mmpt? -72.95 -21.06 60.93 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 124.087 0.955 . . . . 0.0 112.618 -170.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -99.22 -80.7 1.55 Allowed Glycine 0 C--N 1.314 -0.664 0 C-N-CA 119.303 -1.427 . . . . 0.0 114.882 -170.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -122.69 128.39 50.51 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 122.401 -0.47 . . . . 0.0 110.012 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.426 ' HD2' ' N ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -103.4 -4.67 23.81 Favored 'General case' 0 N--CA 1.427 -1.578 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.219 -173.185 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 21.9 p -136.24 150.65 49.06 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -179.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -116.58 153.74 31.7 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-O 120.836 0.35 . . . . 0.0 111.03 -178.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -65.45 -16.64 63.85 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.557 1.143 . . . . 0.0 113.634 -175.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -72.15 -12.81 61.36 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 121.206 0.527 . . . . 0.0 110.13 173.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 95.72 35.87 5.49 Favored Glycine 0 N--CA 1.439 -1.112 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -176.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -121.94 165.27 16.22 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 115.289 -0.456 . . . . 0.0 110.481 -176.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -100.44 137.7 13.41 Favored Glycine 0 N--CA 1.434 -1.438 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 174.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 95.3 mt -100.98 107.05 18.42 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 -178.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -154.38 168.06 27.91 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.437 0.637 . . . . 0.0 112.542 -175.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.493 ' OH ' HD12 ' A' ' 38' ' ' LEU . 2.5 m-85 -94.59 134.95 36.61 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.396 -1.274 . . . . 0.0 108.571 170.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 47.8 mm -99.89 126.09 53.42 Favored 'Isoleucine or valine' 0 C--O 1.254 1.328 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 175.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.517 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 31.1 m-85 -120.48 131.75 54.88 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 174.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.463 ' HB1' ' HB1' ' A' ' 69' ' ' ALA . . . -106.28 98.49 8.16 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 177.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.479 1.1 p30 31.95 57.32 0.34 Allowed 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 116.214 1.931 . . . . 0.0 116.214 -176.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 103.84 -21.95 36.83 Favored Glycine 0 N--CA 1.427 -1.925 0 CA-C-N 114.135 -1.393 . . . . 0.0 113.77 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -89.56 123.73 33.9 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -178.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' MET . . . . . 0.467 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 4.5 mpp? -84.32 101.6 12.06 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.255 178.225 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.576 HG21 ' SD ' ' A' ' 65' ' ' MET . 37.9 t -62.87 -46.06 97.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -54.86 -47.81 73.72 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 113.812 -1.54 . . . . 0.0 110.893 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -62.09 -50.64 71.13 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.734 0.814 . . . . 0.0 109.994 179.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.63 -41.14 85.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.582 -0.735 . . . . 0.0 112.192 -176.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 95.8 mt -58.4 -46.34 86.6 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-O 120.738 0.304 . . . . 0.0 111.814 178.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.8 t -73.29 -43.87 56.08 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-O 121.191 0.52 . . . . 0.0 109.99 178.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 21.8 tpt180 -60.95 -40.32 92.87 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.951 -176.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -84.0 -5.45 59.23 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.407 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 68.93 38.68 85.11 Favored Glycine 0 CA--C 1.503 -0.661 0 N-CA-C 111.575 -0.61 . . . . 0.0 111.575 -178.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.8 mt -94.27 -22.07 18.62 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -140.57 174.43 10.52 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 115.284 -0.871 . . . . 0.0 108.842 -177.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -111.54 166.08 11.45 Favored 'General case' 0 C--N 1.309 -1.166 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.467 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 73.6 t -83.89 127.07 40.12 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.237 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.076 177.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.69 125.68 34.96 Favored 'General case' 0 CA--C 1.496 -1.133 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -71.89 122.57 21.01 Favored 'General case' 0 N--CA 1.428 -1.538 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.969 179.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.45 HG11 HD21 ' B' ' 131' ' ' ASN . 13.5 t -88.07 152.27 3.41 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 N-CA-C 106.04 -1.837 . . . . 0.0 106.04 175.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -94.19 133.89 37.22 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-O 121.035 0.445 . . . . 0.0 111.414 -168.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 8.6 mptt -103.97 159.17 30.18 Favored Pre-proline 0 C--N 1.31 -1.137 0 CA-C-N 115.398 -0.819 . . . . 0.0 108.956 -178.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.19 -9.17 24.05 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.06 1.84 . . . . 0.0 109.183 173.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -79.65 -1.9 40.3 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 113.781 -1.554 . . . . 0.0 109.642 177.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -57.2 -45.41 83.79 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 175.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 7.5 t -101.11 -37.31 8.64 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.095 -0.957 . . . . 0.0 108.883 173.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 . . . . . 0 C--N 1.351 0.659 0 C-N-CA 125.08 1.352 . . . . 0.0 110.713 -177.457 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.172 0 N-CA-C 109.354 -1.498 . . . . 0.0 109.354 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 14.1 m -88.84 -18.59 27.31 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 120.996 0.427 . . . . 0.0 111.167 -175.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 42.8 t -92.18 100.05 10.65 Favored 'Isoleucine or valine' 0 C--O 1.244 0.78 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 177.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -83.04 55.32 3.06 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.755 0.788 . . . . 0.0 111.046 -178.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -127.66 97.62 4.91 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 178.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 33.6 m -103.52 -29.87 2.9 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 C-N-CA 120.132 -0.627 . . . . 0.0 111.811 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 69.5 t80 55.29 84.91 0.07 Allowed 'General case' 0 C--O 1.246 0.919 0 O-C-N 124.028 0.83 . . . . 0.0 109.946 -170.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.41 ' HA ' ' HD3' ' B' ' 130' ' ' PRO . 83.2 tttt -55.16 122.56 43.43 Favored Pre-proline 0 C--N 1.304 -1.405 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 172.099 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' B' ' 129' ' ' LYS . 17.2 Cg_exo -63.52 149.18 91.68 Favored 'Trans proline' 0 N--CA 1.449 -1.102 0 C-N-CA 122.305 2.003 . . . . 0.0 113.102 -172.19 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 131' ' ' ASN . . . . . 0.454 ' OD1' ' HB3' ' A' ' 77' ' ' ASP . 4.0 t30 -77.23 102.47 6.68 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 104.687 -2.338 . . . . 0.0 104.687 175.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -157.71 -72.17 0.09 Allowed 'General case' 0 C--N 1.297 -1.706 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -169.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 3.2 m 44.96 -53.62 0.0 OUTLIER 'General case' 0 CA--C 1.585 2.323 0 C-N-CA 128.67 2.788 . . . . 0.0 117.862 177.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . 0.589 ' NE2' HD12 ' A' ' 7' ' ' LEU . 3.0 p80 -129.26 20.37 5.78 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 125.029 1.332 . . . . 0.0 111.227 -172.287 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . 0.412 ' HA ' ' CD1' ' A' ' 38' ' ' LEU . 36.3 tt0 -58.56 -44.48 89.72 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.37 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -61.47 -34.17 75.01 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.396 -176.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 82.9 mt -63.3 -50.97 68.0 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-O 121.126 0.488 . . . . 0.0 110.002 179.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 24.7 mt -69.92 -34.42 73.45 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 178.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 15.4 mtp85 -69.23 -31.49 70.09 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -77.26 -22.66 51.78 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.359 0.599 . . . . 0.0 111.138 174.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.1 m -76.4 -38.09 56.18 Favored 'General case' 0 N--CA 1.427 -1.605 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 173.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.548 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 36.4 tt0 -60.48 -42.98 97.37 Favored 'General case' 0 C--O 1.209 -1.069 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 173.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.96 -43.37 66.3 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 123.451 0.7 . . . . 0.0 111.452 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 144' ' ' GLN . . . . . 0.475 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 75.3 mt-30 -70.7 -48.36 55.07 Favored 'General case' 0 CA--C 1.497 -1.084 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.154 177.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -57.91 -38.85 76.61 Favored 'General case' 0 C--O 1.244 0.777 0 O-C-N 123.945 0.778 . . . . 0.0 112.038 -176.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 146' ' ' LYS . . . . . 0.548 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 89.4 mttt -57.62 -51.72 68.37 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 175.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -64.13 -45.15 89.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.109 -178.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 23.3 mm-40 -64.14 -14.08 52.51 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 124.093 0.957 . . . . 0.0 113.035 -178.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . 0.494 ' O ' ' HB2' ' B' ' 154' ' ' SER . 0.0 OUTLIER 62.39 40.95 10.57 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -178.932 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 90.5 mt -76.41 109.7 10.35 Favored 'General case' 0 C--N 1.315 -0.918 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.238 -175.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 151' ' ' ASN . . . . . 0.407 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 2.7 m-20 46.1 -88.3 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.415 1.886 . . . . 0.0 114.224 179.492 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 13.1 tt -68.19 -27.63 37.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 -176.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 153' ' ' TRP . . . . . 0.504 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 63.9 m95 -80.8 -7.25 59.36 Favored 'General case' 0 N--CA 1.435 -1.198 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.545 -178.143 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 154' ' ' SER . . . . . 0.494 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 22.5 t -81.6 13.38 3.14 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 120.985 0.421 . . . . 0.0 110.052 177.058 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -81.96 -20.81 37.8 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 172.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 156' ' ' ASP . . . . . 0.403 ' HB3' ' HE2' ' B' ' 149' ' ' LYS . 14.2 t70 . . . . . 0 N--CA 1.443 -0.82 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.27 -176.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.603 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.2 t -158.74 143.15 15.75 Favored 'General case' 0 N--CA 1.422 -1.853 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 176.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 30.2 t -100.85 119.82 39.22 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 178.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.7 p -88.59 134.51 33.86 Favored 'General case' 0 N--CA 1.421 -1.896 0 C-N-CA 120.336 -0.546 . . . . 0.0 110.116 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 61.1 mttp 65.78 -92.78 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 124.749 1.219 . . . . 0.0 110.547 -177.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HB2' ' HZ2' ' A' ' 6' ' ' LYS . 4.1 ttmp? 178.15 176.02 0.49 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 105.213 -2.143 . . . . 0.0 105.213 178.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.423 ' H ' ' HG2' ' A' ' 6' ' ' LYS . 0.7 OUTLIER -109.68 92.43 4.05 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-O 122.307 1.051 . . . . 0.0 113.232 177.635 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -123.81 169.85 11.13 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-N 113.917 -1.492 . . . . 0.0 111.058 173.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.433 ' HA ' ' O ' ' A' ' 74' ' ' VAL . 43.1 mtmt -65.29 143.98 57.43 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 124.481 1.113 . . . . 0.0 112.562 -172.186 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -126.86 158.09 69.53 Favored Pre-proline 0 C--N 1.297 -1.71 0 N-CA-C 105.31 -2.107 . . . . 0.0 105.31 167.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -74.34 147.34 36.91 Favored 'Trans proline' 0 C--N 1.322 -0.817 0 C-N-CA 122.163 1.909 . . . . 0.0 112.096 -178.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.01 155.47 47.96 Favored 'General case' 0 N--CA 1.428 -1.566 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.414 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 37.5 m -103.19 123.07 46.02 Favored 'General case' 0 N--CA 1.415 -2.195 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.27 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 49.1 tp -69.29 124.76 24.69 Favored 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.4 mm -88.15 -52.33 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 N-CA-C 107.159 -1.422 . . . . 0.0 107.159 174.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -174.87 161.92 3.1 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 176.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -103.55 147.52 27.08 Favored 'General case' 0 C--N 1.285 -2.196 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 174.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.0 mp -107.25 -58.08 3.99 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 N-CA-C 107.359 -1.349 . . . . 0.0 107.359 176.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -140.91 173.58 11.34 Favored 'General case' 0 CA--C 1.484 -1.562 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.517 178.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -82.91 60.63 4.87 Favored Glycine 0 CA--C 1.5 -0.878 0 N-CA-C 108.449 -1.86 . . . . 0.0 108.449 174.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.413 ' HB2' ' HB ' ' A' ' 41' ' ' THR . 7.2 t70 -174.86 -56.98 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 124.691 1.196 . . . . 0.0 108.682 -172.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 34.8 m -119.04 127.78 53.74 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.966 178.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 15.9 m -135.52 167.57 24.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 C-N-CA 124.356 1.062 . . . . 0.0 109.796 -176.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -121.09 117.88 28.32 Favored 'General case' 0 C--N 1.316 -0.856 0 O-C-N 121.852 -0.53 . . . . 0.0 110.044 -177.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.0 mp -127.92 159.5 34.75 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.473 0.654 . . . . 0.0 111.667 -178.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.474 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 57.7 ttp -119.92 111.19 17.63 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 175.047 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.6 p90 -109.91 114.93 28.88 Favored 'General case' 0 C--N 1.293 -1.85 0 C-N-CA 118.709 -1.197 . . . . 0.0 109.962 -177.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt 63.28 28.44 15.73 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.736 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.445 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 94.82 2.78 62.67 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 114.868 -1.06 . . . . 0.0 113.072 -178.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.474 ' O ' ' HA ' ' A' ' 26' ' ' MET . 1.9 mp0 -99.72 101.97 15.47 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 117.022 0.411 . . . . 0.0 111.488 178.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.445 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 4.4 Cg_exo -78.09 113.7 3.46 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.351 2.034 . . . . 0.0 110.828 177.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 26.4 mmt -136.25 156.06 49.21 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.954 -178.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.0 m -95.04 112.21 23.94 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 176.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -95.85 145.07 25.65 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-O 121.526 0.679 . . . . 0.0 112.129 -174.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -123.07 117.75 26.14 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 105.464 -2.05 . . . . 0.0 105.464 176.607 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.7 mp -60.62 116.14 4.15 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 123.945 0.778 . . . . 0.0 112.219 -174.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 74.1 mt -70.19 140.35 52.51 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.571 175.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.5 mt 76.54 10.07 2.92 Favored 'General case' 0 C--O 1.217 -0.625 0 C-N-CA 125.534 1.534 . . . . 0.0 110.705 -175.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 53.8 t -126.02 138.21 55.29 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.135 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 176.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -148.13 106.58 3.77 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.596 ' N ' ' HD3' ' A' ' 42' ' ' PRO . 3.3 m -127.61 38.55 0.43 Allowed Pre-proline 0 CA--C 1.598 2.821 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 175.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.596 ' HD3' ' N ' ' A' ' 41' ' ' THR . 4.0 Cg_endo -89.76 77.12 1.03 Allowed 'Trans proline' 0 C--N 1.375 1.956 0 C-N-CA 121.829 1.686 . . . . 0.0 111.976 -179.597 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -129.9 127.86 41.0 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 174.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 22.4 m -65.37 113.01 3.78 Favored 'General case' 0 N--CA 1.429 -1.521 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 178.068 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.545 ' O ' ' HD2' ' A' ' 47' ' ' PRO . 56.9 mttp -66.88 -44.46 80.83 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.845 -173.51 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . 0.358 97.9 m-70 85.53 -83.12 0.0 OUTLIER Pre-proline 0 CA--C 1.555 1.149 0 C-N-CA 126.271 1.828 . . . . 0.0 112.381 -177.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.545 ' HD2' ' O ' ' A' ' 45' ' ' LYS . 72.5 Cg_endo -81.06 173.82 11.49 Favored 'Trans proline' 0 C--N 1.366 1.473 0 CA-C-N 122.306 1.859 . . . . 0.0 109.696 172.544 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -118.62 -37.52 3.27 Favored 'General case' 0 C--N 1.294 -1.812 0 CA-C-O 121.193 0.52 . . . . 0.0 110.273 178.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -83.83 -6.07 59.34 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.647 -174.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -151.38 85.02 0.15 Allowed Glycine 0 C--N 1.305 -1.157 0 C-N-CA 120.116 -1.04 . . . . 0.0 112.383 -178.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 59.5 t -124.91 113.25 35.07 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.221 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -61.41 -29.94 70.25 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.564 0.746 . . . . 0.0 112.526 -176.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.2 ptpt -86.23 -12.72 48.9 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 69.48 30.39 4.08 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 175.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -47.46 -50.94 17.19 Favored Glycine 0 CA--C 1.55 2.266 0 CA-C-N 115.047 -0.979 . . . . 0.0 114.429 176.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -64.83 -25.85 60.16 Favored 'Trans proline' 0 C--N 1.373 1.82 0 CA-C-N 120.488 2.144 . . . . 0.0 112.379 178.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -80.06 -28.15 39.26 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.581 -177.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.19 -48.06 81.71 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 174.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.405 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 14.6 m -62.84 -34.54 77.56 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.21 177.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.4 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -64.46 -46.9 81.11 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.893 0.378 . . . . 0.0 110.056 177.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -60.82 -41.63 96.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.913 177.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.509 ' O ' HG23 ' A' ' 66' ' ' VAL . 54.2 m -58.38 -48.63 79.99 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.127 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.405 ' HG3' ' O ' ' A' ' 59' ' ' SER . 56.2 mtpt -56.37 -51.84 66.82 Favored 'General case' 0 CA--C 1.509 -0.61 0 O-C-N 123.601 0.563 . . . . 0.0 110.734 178.641 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 95.9 mttt -58.74 -39.76 81.84 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.213 -177.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 13.2 tpt -69.9 -47.73 61.37 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.663 -179.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 62' ' ' THR . 35.8 m -77.85 -34.68 19.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 -175.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -76.47 -19.49 57.97 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-O 121.027 0.442 . . . . 0.0 110.693 -179.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -89.93 -10.02 46.69 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.287 176.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -78.8 133.68 37.04 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 120.904 0.383 . . . . 0.0 111.767 -175.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -73.31 -34.13 65.55 Favored 'General case' 0 CA--C 1.502 -0.874 0 CA-C-O 121.439 0.637 . . . . 0.0 111.219 176.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -131.66 123.1 27.11 Favored 'General case' 0 C--N 1.292 -1.899 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 4.4 mp -101.71 121.54 52.79 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.314 0 N-CA-C 104.983 -2.228 . . . . 0.0 104.983 173.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.524 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 24.4 mt-10 -119.08 145.51 45.85 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-O 120.793 0.33 . . . . 0.0 110.904 -173.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.433 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 11.0 m -120.96 133.39 67.77 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.759 179.119 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -135.64 134.42 39.23 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.487 ' HB3' ' HG2' ' A' ' 81' ' ' ARG . 89.9 m-85 -95.28 148.03 22.85 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.469 -175.263 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -85.81 163.71 17.99 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 -179.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -73.1 -6.05 43.12 Favored 'General case' 0 C--O 1.246 0.887 0 C-N-CA 123.167 0.587 . . . . 0.0 111.955 -178.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -96.44 -99.28 1.89 Allowed Glycine 0 N--CA 1.433 -1.542 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 175.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 19.5 mp0 -93.52 134.93 35.27 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 121.041 0.448 . . . . 0.0 111.125 -176.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.487 ' HG2' ' HB3' ' A' ' 76' ' ' PHE . 55.8 mtt180 -111.67 -27.61 8.46 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.922 175.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 16.2 p -140.25 133.91 30.31 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.568 -176.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -97.86 146.41 25.46 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 176.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -68.0 -13.19 61.99 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -176.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -87.76 -0.85 57.48 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 178.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 89.85 54.81 2.12 Favored Glycine 0 N--CA 1.427 -1.92 0 C-N-CA 120.43 -0.891 . . . . 0.0 111.547 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -131.14 143.91 50.98 Favored 'General case' 0 C--N 1.307 -1.26 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 176.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -90.28 121.52 6.23 Favored Glycine 0 N--CA 1.422 -2.254 0 N-CA-C 108.172 -1.971 . . . . 0.0 108.172 173.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.4 mt -101.33 107.4 18.74 Favored 'General case' 0 C--N 1.289 -2.023 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 -177.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -153.92 167.33 30.09 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.463 -176.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.4 ' OH ' ' HB ' ' B' ' 133' ' ' THR . 41.1 m-85 -87.31 142.33 27.97 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 173.581 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 50.0 mm -108.31 123.32 63.83 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 178.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.524 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 17.4 m-85 -115.44 150.5 36.35 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 177.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -120.59 99.93 6.83 Favored 'General case' 0 C--N 1.291 -1.956 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 176.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.315 4.4 p-10 44.08 57.91 3.96 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 125.07 1.348 . . . . 0.0 113.638 -177.303 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.16 -23.34 27.45 Favored Glycine 0 N--CA 1.432 -1.601 0 CA-C-N 114.884 -1.053 . . . . 0.0 114.176 178.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -93.16 123.84 36.72 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -177.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' MET . . . . . 0.406 ' HB3' ' CE2' ' A' ' 93' ' ' TYR . 25.7 ptp -79.0 116.38 19.27 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-O 121.971 0.891 . . . . 0.0 111.125 -179.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 56.3 t -65.17 -31.37 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.599 -175.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 25.2 p-10 -65.11 -31.15 72.2 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.871 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -63.8 -51.47 64.62 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 173.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.46 -45.57 84.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.9 -177.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.2 mt -61.66 -41.15 97.13 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.747 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 96.7 t -70.66 -43.18 77.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.749 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 -67.29 -26.63 66.63 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 86.7 mm-40 -93.65 -4.23 51.04 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 120.829 0.347 . . . . 0.0 111.196 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.444 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 66.35 44.13 91.21 Favored Glycine 0 C--O 1.215 -1.082 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.741 -179.051 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 90.9 mt -113.16 7.85 18.05 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-O 121.511 0.672 . . . . 0.0 109.779 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -159.38 171.04 20.51 Favored 'General case' 0 N--CA 1.427 -1.588 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.56 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 95.3 mttt -120.97 161.47 21.55 Favored 'General case' 0 N--CA 1.424 -1.734 0 N-CA-C 104.921 -2.251 . . . . 0.0 104.921 177.045 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.6 p -76.56 150.73 6.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.701 0 C-N-CA 118.739 -1.184 . . . . 0.0 109.159 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -86.89 126.89 34.97 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 175.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -71.04 107.39 4.09 Favored 'General case' 0 C--N 1.291 -1.944 0 CA-C-N 114.718 -1.128 . . . . 0.0 110.394 -171.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.4 HG11 ' HA ' ' B' ' 132' ' ' ASN . 47.7 t -97.0 152.15 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.579 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.138 177.613 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -85.07 133.41 34.23 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 123.414 0.686 . . . . 0.0 111.04 -175.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -95.28 159.05 33.68 Favored Pre-proline 0 C--N 1.305 -1.326 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 176.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -58.35 -36.85 97.17 Favored 'Trans proline' 0 C--O 1.245 0.873 0 C-N-CA 121.945 1.763 . . . . 0.0 111.324 176.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 7.7 t30 71.38 -58.91 0.56 Allowed 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 125.977 1.711 . . . . 0.0 110.188 178.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -106.55 -83.05 0.53 Allowed 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 106.014 -1.847 . . . . 0.0 106.014 175.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -168.61 74.87 0.11 Allowed 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 125.144 1.378 . . . . 0.0 108.874 172.649 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 . . . . . 0 C--O 1.246 0.893 0 CA-C-N 113.964 -1.471 . . . . 0.0 109.837 -179.481 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -0.986 0 N-CA-C 110.634 -0.987 . . . . 0.0 110.634 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 123' ' ' SER . . . . . 0.442 ' HB3' ' O ' ' B' ' 126' ' ' TYR . 34.7 t -147.85 147.16 29.49 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 179.061 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 33.7 m -100.54 -12.99 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.003 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 175.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -75.27 -48.83 21.44 Favored 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 175.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 126' ' ' TYR . . . . . 0.442 ' O ' ' HB3' ' B' ' 123' ' ' SER . 74.0 t80 -131.34 104.95 7.31 Favored 'General case' 0 N--CA 1.426 -1.631 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 170.64 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 21.2 t -72.49 115.41 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.676 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 -179.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -74.17 -28.99 61.56 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.396 -177.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -79.69 126.15 81.02 Favored Pre-proline 0 N--CA 1.432 -1.342 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.012 177.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -59.68 -171.74 0.06 OUTLIER 'Trans proline' 0 C--N 1.358 1.077 0 C-N-CA 123.534 2.823 . . . . 0.0 114.431 -178.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -99.55 155.99 17.29 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.036 -0.984 . . . . 0.0 109.377 -174.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 132' ' ' ASN . . . . . 0.4 ' HA ' HG11 ' A' ' 114' ' ' VAL . 10.5 p30 179.42 -39.73 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.691 0 C-N-CA 125.555 1.542 . . . . 0.0 107.538 175.575 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 133' ' ' THR . . . . . 0.4 ' HB ' ' OH ' ' A' ' 91' ' ' TYR . 2.9 m 56.64 -73.69 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.226 0 C-N-CA 125.977 1.711 . . . . 0.0 113.245 177.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -138.48 21.38 2.73 Favored 'General case' 0 C--N 1.312 -1.063 0 O-C-N 121.876 -0.515 . . . . 0.0 112.236 177.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -53.56 -50.47 65.47 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.873 175.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -48.77 -37.99 20.58 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.621 1.168 . . . . 0.0 112.977 -176.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 95.2 mt -70.41 -50.08 42.24 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.974 0.416 . . . . 0.0 110.599 -179.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 19.8 mt -69.58 -41.24 76.06 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-O 121.563 0.697 . . . . 0.0 111.361 -178.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 139' ' ' ARG . . . . . 0.457 ' O ' ' HB3' ' B' ' 142' ' ' GLU . 64.4 ttt180 -67.32 -31.91 72.51 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.431 -175.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -78.74 -24.43 44.82 Favored 'General case' 0 N--CA 1.432 -1.326 0 C-N-CA 119.654 -0.819 . . . . 0.0 111.116 176.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 51.0 m -69.03 -36.97 78.34 Favored 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 171.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 142' ' ' GLU . . . . . 0.619 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 28.1 tt0 -56.62 -49.25 75.53 Favored 'General case' 0 C--O 1.204 -1.324 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.358 174.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.81 -45.47 59.4 Favored 'General case' 0 C--O 1.255 1.379 0 CA-C-O 121.44 0.638 . . . . 0.0 111.512 -178.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 144' ' ' GLN . . . . . 0.486 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 29.0 tt0 -67.1 -47.78 70.16 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.586 178.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -60.06 -34.0 72.81 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 123.532 0.733 . . . . 0.0 112.17 -178.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 146' ' ' LYS . . . . . 0.619 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 60.2 mttm -55.15 -51.37 66.67 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 175.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -71.77 -27.42 62.95 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.252 -178.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 148' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 9.5 mm-40 -73.25 -16.19 61.4 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.931 176.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt 51.92 55.63 9.0 Favored 'General case' 0 CA--C 1.505 -0.754 0 C-N-CA 125.052 1.341 . . . . 0.0 110.838 -178.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 95.0 mt -86.37 114.06 22.85 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.211 -178.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 151' ' ' ASN . . . . . 0.444 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 44.3 m-80 48.23 -87.53 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.314 1.846 . . . . 0.0 114.257 177.4 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 10.7 tt -72.01 -24.89 23.1 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-O 120.932 0.396 . . . . 0.0 110.286 -175.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 153' ' ' TRP . . . . . 0.61 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 52.6 m95 -80.64 -10.43 59.73 Favored 'General case' 0 CA--C 1.506 -0.731 0 CA-C-O 121.771 0.796 . . . . 0.0 110.288 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 22.6 t -87.33 12.82 11.05 Favored 'General case' 0 N--CA 1.419 -1.993 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.001 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -66.62 -31.24 71.81 Favored 'General case' 0 C--N 1.356 0.871 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 172.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 20.9 t70 . . . . . 0 C--O 1.254 1.318 0 C-N-CA 125.007 1.323 . . . . 0.0 113.261 173.266 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 37.5 m80 . . . . . 0 N--CA 1.433 -1.286 0 CA-C-O 121.529 0.68 . . . . 0.0 112.072 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.453 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 37.0 ttmt -115.73 134.37 55.09 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 114.093 -1.412 . . . . 0.0 108.554 177.441 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -138.19 146.34 51.31 Favored Pre-proline 0 C--N 1.3 -1.558 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 176.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -69.22 150.59 71.67 Favored 'Trans proline' 0 C--O 1.246 0.891 0 C-N-CA 122.228 1.952 . . . . 0.0 112.388 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -141.45 165.04 28.61 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.142 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.547 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 8.4 m -100.23 133.81 44.08 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.636 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.4 tp -81.84 124.76 29.97 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 178.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.453 HD11 ' HB2' ' A' ' 26' ' ' MET . 59.4 mt -95.78 -54.87 6.63 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 176.521 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -162.68 153.83 17.49 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.197 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.459 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -111.32 107.47 16.75 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 176.305 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.4 mt -81.04 -63.53 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.237 0 CA-C-O 121.59 0.71 . . . . 0.0 109.357 -173.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -112.77 -171.37 1.85 Allowed 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.186 -0.916 . . . . 0.0 109.856 -176.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -92.29 40.18 2.92 Favored Glycine 0 C--O 1.202 -1.884 0 N-CA-C 109.779 -1.328 . . . . 0.0 109.779 177.335 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.612 ' OD1' ' HG2' ' A' ' 35' ' ' ARG . 2.5 t0 -174.9 -57.46 0.01 OUTLIER 'General case' 0 CA--C 1.505 -0.761 0 N-CA-C 106.534 -1.654 . . . . 0.0 106.534 -174.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.3 111.37 18.92 Favored 'General case' 0 N--CA 1.425 -1.704 0 CA-C-N 113.826 -1.534 . . . . 0.0 109.103 -176.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.425 HG12 ' HA ' ' A' ' 17' ' ' ALA . 22.2 m -134.6 163.16 37.48 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.892 0 C-N-CA 123.499 0.72 . . . . 0.0 109.058 -176.525 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -116.26 116.26 27.44 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.619 -0.676 . . . . 0.0 110.107 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.8 mp -121.92 159.44 26.88 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 121.409 0.623 . . . . 0.0 111.001 178.193 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.547 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 26.9 ttt -120.08 105.93 11.48 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -178.704 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.425 ' CD1' ' HZ ' ' A' ' 34' ' ' PHE . 11.3 p90 -106.74 120.61 42.46 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -177.773 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 60.9 mttp 55.79 28.71 12.72 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.438 0.637 . . . . 0.0 111.916 -178.174 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.402 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 93.43 6.08 62.96 Favored Glycine 0 N--CA 1.434 -1.464 0 C-N-CA 120.513 -0.851 . . . . 0.0 113.197 178.565 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.465 ' O ' ' HA ' ' A' ' 26' ' ' MET . 84.0 mm-40 -105.62 104.01 46.29 Favored Pre-proline 0 C--N 1.311 -1.081 0 CA-C-N 117.122 0.461 . . . . 0.0 110.938 178.453 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.402 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 6.2 Cg_exo -76.77 117.09 4.4 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.682 2.254 . . . . 0.0 110.703 176.025 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 25.8 mmt -137.42 147.58 45.5 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 90.3 m -85.59 116.73 24.05 Favored 'General case' 0 N--CA 1.425 -1.685 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 173.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.425 ' HZ ' ' CD1' ' A' ' 27' ' ' TYR . 90.5 m-85 -102.53 157.59 16.82 Favored 'General case' 0 C--N 1.291 -1.962 0 C-N-CA 123.686 0.794 . . . . 0.0 109.847 -177.53 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.612 ' HG2' ' OD1' ' A' ' 21' ' ' ASP . 11.9 ttt-85 -132.66 156.44 46.96 Favored 'General case' 0 C--N 1.286 -2.157 0 N-CA-C 104.127 -2.546 . . . . 0.0 104.127 172.609 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.467 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 84.1 mt -89.88 116.88 28.28 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -170.413 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.485 HD21 ' HB3' ' A' ' 89' ' ' LEU . 37.3 mt -55.71 135.82 51.21 Favored 'General case' 0 C--O 1.245 0.816 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.009 178.494 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.499 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 95.6 mt 72.24 13.14 5.73 Favored 'General case' 0 C--O 1.209 -1.031 0 O-C-N 124.872 1.357 . . . . 0.0 112.132 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 57.3 t -125.88 143.38 39.59 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.433 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -140.08 107.8 5.64 Favored 'General case' 0 C--O 1.249 1.052 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 175.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.441 HG23 ' O ' ' A' ' 108' ' ' LEU . 2.6 m . . . . . 0 CA--C 1.571 1.785 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 -173.634 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 1.552 0 N-CA-C 116.328 1.291 . . . . 0.0 116.328 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo -49.06 -52.0 9.55 Favored 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 123.059 2.506 . . . . 0.0 113.774 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -70.45 -48.57 55.25 Favored 'General case' 0 C--O 1.206 -1.197 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.5 -48.1 72.28 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -177.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.517 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 46.0 p -69.08 -33.77 74.07 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-O 121.146 0.498 . . . . 0.0 111.876 -178.358 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.605 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -71.04 -38.62 72.56 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 175.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -61.51 -43.13 99.41 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 124.917 1.287 . . . . 0.0 111.509 -176.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.527 ' O ' HG22 ' A' ' 66' ' ' VAL . 5.0 p -64.28 -41.47 96.88 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.951 177.374 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.517 ' HG3' ' O ' ' A' ' 59' ' ' SER . 57.7 mttp -57.11 -39.12 74.47 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 123.541 0.526 . . . . 0.0 111.096 177.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.605 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 82.1 mttt -59.51 -54.27 48.52 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -179.278 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -67.35 -39.56 85.77 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -177.409 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.527 HG22 ' O ' ' A' ' 62' ' ' THR . 34.5 m -82.32 -39.02 15.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 113.634 0.975 . . . . 0.0 113.634 -176.22 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -75.55 -22.85 56.68 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -177.118 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -83.94 -9.44 58.69 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.766 0.793 . . . . 0.0 109.766 178.007 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.45 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -86.17 140.35 30.25 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.476 0.655 . . . . 0.0 112.436 -177.113 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -87.04 -38.52 16.48 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.042 -0.981 . . . . 0.0 108.977 175.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -119.11 119.78 35.21 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.522 -176.665 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 74.6 mt -118.23 121.37 67.04 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.475 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 22.8 mt-10 -115.9 137.95 51.63 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.199 -173.655 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.8 m -110.7 118.67 57.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 174.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.453 ' HA ' ' HA ' ' A' ' 9' ' ' LYS . 39.6 tt0 -111.71 133.76 53.73 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.484 ' CE1' ' HG3' ' A' ' 81' ' ' ARG . 60.8 m-85 -108.65 147.3 32.09 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -175.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.415 ' HB2' ' HE2' ' A' ' 91' ' ' TYR . 1.3 t70 -97.33 -174.54 2.96 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 120.939 0.4 . . . . 0.0 110.816 -176.437 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.0 mtpm? -76.82 -8.41 57.26 Favored 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 123.787 0.835 . . . . 0.0 110.79 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -69.13 -93.65 0.05 OUTLIER Glycine 0 C--N 1.335 0.508 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 26.4 mp0 -145.97 158.74 43.86 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 176.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.484 ' HG3' ' CE1' ' A' ' 76' ' ' PHE . 37.0 ttm180 -88.52 -35.37 17.0 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 173.694 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 8.4 p . . . . . 0 C--N 1.313 -1.021 0 CA-C-N 115.285 -0.87 . . . . 0.0 112.119 -175.351 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.412 -2.339 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -87.9 157.47 28.49 Favored Glycine 0 N--CA 1.427 -1.966 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.412 -175.089 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.485 ' HB3' HD21 ' A' ' 37' ' ' LEU . 72.7 mt -122.39 108.55 13.34 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 -178.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.436 ' O ' ' HA ' ' A' ' 36' ' ' LEU . . . -150.66 167.61 26.82 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 119.992 -0.683 . . . . 0.0 112.543 -175.562 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.415 ' HE2' ' HB2' ' A' ' 77' ' ' ASP . 78.8 m-85 -106.22 127.93 53.58 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 171.374 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 65.5 mt -103.14 126.7 57.42 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.978 0 C-N-CA 119.503 -0.879 . . . . 0.0 111.608 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.475 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 35.4 m-85 -112.45 133.94 54.26 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.278 178.552 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.45 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -105.34 105.83 16.04 Favored 'General case' 0 C--N 1.283 -2.306 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 174.603 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.2 p30 46.96 26.53 0.61 Allowed 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 125.201 1.4 . . . . 0.0 113.866 -172.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.46 -6.94 36.46 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.694 -0.765 . . . . 0.0 113.396 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -89.07 115.38 26.57 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 175.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 51.8 ttp -76.11 112.55 12.68 Favored 'General case' 0 C--N 1.294 -1.846 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 -178.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 57.5 t -62.41 -32.77 56.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.245 0.545 . . . . 0.0 110.138 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.467 ' ND2' ' HB3' ' A' ' 36' ' ' LEU . 1.3 m-20 -57.79 -37.95 74.63 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.073 178.588 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -66.3 -46.01 78.4 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.758 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.36 -39.77 88.38 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.662 -178.006 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 97.2 mt -62.19 -53.46 54.94 Favored 'General case' 0 C--O 1.244 0.795 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 19.3 m -69.54 -37.88 75.6 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 116.222 -0.444 . . . . 0.0 112.156 -177.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 53.2 ttp180 -68.26 -24.64 64.91 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 123.405 0.682 . . . . 0.0 111.16 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 50.7 tp60 -92.01 -5.74 52.43 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.547 0.689 . . . . 0.0 109.375 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.497 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 73.23 27.19 68.69 Favored Glycine 0 N--CA 1.441 -0.976 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.766 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.441 ' O ' HG23 ' A' ' 41' ' ' THR . 83.3 mt -97.63 -7.04 31.93 Favored 'General case' 0 CA--C 1.495 -1.138 0 O-C-N 122.864 -0.198 . . . . 0.0 111.186 -179.104 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -150.61 164.67 35.47 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 -177.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -112.66 156.92 21.91 Favored 'General case' 0 CA--C 1.488 -1.421 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 174.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 75.2 t -73.77 136.13 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.755 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 174.04 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.424 -1.766 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -177.741 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 65.8 m80 . . . . . 0 N--CA 1.467 0.398 0 CA-C-O 118.706 -0.664 . . . . 0.0 112.377 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.4 ' HA ' HD13 ' A' ' 38' ' ' LEU . 33.9 tt0 -60.98 -41.75 97.05 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 118.889 0.768 . . . . 0.0 110.628 -176.021 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -65.9 -33.6 76.21 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.319 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 95.0 mt -68.52 -49.73 57.41 Favored 'General case' 0 C--O 1.246 0.871 0 CA-C-O 121.657 0.741 . . . . 0.0 109.136 178.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -63.55 -44.56 93.81 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.288 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 139' ' ' ARG . . . . . 0.433 ' HA ' ' HB3' ' B' ' 142' ' ' GLU 0.436 48.6 mtt180 -75.13 -18.39 60.24 Favored 'General case' 0 N--CA 1.436 -1.159 0 N-CA-C 117.62 2.452 . . . . 0.0 117.62 -175.767 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -72.68 -42.78 63.91 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 169.847 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 15.0 m -66.4 -37.12 84.51 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 114.651 -1.159 . . . . 0.0 110.275 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.606 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 39.0 tt0 -63.39 -51.17 66.92 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.694 175.143 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.61 -39.21 70.47 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.65 0.78 . . . . 0.0 111.65 -176.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -60.17 -47.54 85.53 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.432 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -74.45 -34.29 63.13 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.423 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 146' ' ' LYS . . . . . 0.606 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 39.6 mtpt -59.82 -47.71 84.63 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-O 121.131 0.491 . . . . 0.0 110.208 179.402 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -67.98 -26.95 66.18 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.541 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -82.85 -8.54 59.57 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 149' ' ' LYS . . . . . 0.54 ' O ' ' HB2' ' B' ' 154' ' ' SER . 29.8 mmmt 58.35 42.72 21.07 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 36.3 mt -79.13 112.28 16.18 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.19 -176.697 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 151' ' ' ASN . . . . . 0.497 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 85.6 m-20 54.16 -92.85 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.084 1.354 . . . . 0.0 112.671 174.425 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 52.1 mt -67.69 -32.73 58.06 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.948 0 CA-C-O 121.206 0.527 . . . . 0.0 110.387 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 52.8 m95 -75.69 -5.43 45.56 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-O 121.765 0.793 . . . . 0.0 111.473 -177.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 154' ' ' SER . . . . . 0.54 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 23.2 t -93.72 12.66 24.81 Favored 'General case' 0 N--CA 1.423 -1.787 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.604 173.423 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -70.79 -24.3 62.55 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.615 0.722 . . . . 0.0 109.08 175.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 30.2 t70 . . . . . 0 N--CA 1.429 -1.488 0 CA-C-N 114.356 -1.293 . . . . 0.0 109.295 -178.351 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 14.9 p-80 . . . . . 0 N--CA 1.444 -0.728 0 CA-C-O 120.733 0.302 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.485 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 21.4 pttp -111.46 145.9 38.17 Favored 'General case' 0 C--N 1.291 -1.951 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 173.521 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -138.85 147.6 54.81 Favored Pre-proline 0 C--N 1.259 -3.34 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -74.96 149.76 37.39 Favored 'Trans proline' 0 C--O 1.244 0.804 0 C-N-CA 122.212 1.941 . . . . 0.0 113.193 -177.06 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -138.12 155.05 49.13 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.542 -0.753 . . . . 0.0 109.448 178.216 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.474 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 21.6 m -100.59 137.02 39.55 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.442 ' HB2' HD12 ' A' ' 72' ' ' ILE . 62.2 tp -83.36 132.97 34.97 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.979 -0.451 . . . . 0.0 111.594 -176.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 51.0 mm -95.92 -59.47 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.481 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 172.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.24 142.3 0.8 Allowed 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 -178.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.428 ' HA ' HG23 ' A' ' 23' ' ' VAL . . . -92.04 122.53 34.63 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 171.779 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.4 mt -90.15 -64.8 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -175.039 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -134.83 -178.82 5.25 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.643 -178.458 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.7 56.01 4.9 Favored Glycine 0 C--O 1.238 0.379 0 C-N-CA 121.732 -0.27 . . . . 0.0 112.95 -176.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.572 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 3.2 p-10 177.71 -34.06 0.01 OUTLIER 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 124.546 1.139 . . . . 0.0 108.259 179.261 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -110.12 109.89 20.58 Favored 'General case' 0 N--CA 1.419 -2.002 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.953 -177.157 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.428 HG23 ' HA ' ' A' ' 17' ' ' ALA . 7.3 p -129.33 139.2 52.39 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.881 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 178.5 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -106.0 119.48 39.31 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -175.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 31' ' ' PRO . 4.7 mp -127.24 156.28 42.13 Favored 'General case' 0 CA--C 1.496 -1.119 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.958 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.474 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 49.3 ttm -110.83 99.94 8.77 Favored 'General case' 0 C--N 1.29 -2.019 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 175.079 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -98.29 113.26 25.14 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.329 -0.949 . . . . 0.0 108.717 -177.289 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 96.8 mttt 56.71 31.62 19.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.878 0.847 . . . . 0.0 111.563 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 95.52 4.2 60.86 Favored Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 114.815 -1.084 . . . . 0.0 113.938 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 33.5 mm-40 -105.97 103.46 44.64 Favored Pre-proline 0 C--N 1.309 -1.173 0 CA-C-N 117.403 0.601 . . . . 0.0 111.163 175.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.48 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 1.9 Cg_endo -82.69 107.69 1.6 Allowed 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 122.798 2.332 . . . . 0.0 111.124 177.328 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 92.0 mtp -131.52 156.49 45.62 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-O 121.081 0.467 . . . . 0.0 111.463 -177.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.8 m -78.31 108.95 12.02 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 175.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -95.1 142.7 27.25 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-O 121.291 0.567 . . . . 0.0 111.572 -178.304 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.572 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 8.2 tpt180 -110.88 112.25 23.96 Favored 'General case' 0 N--CA 1.417 -2.105 0 N-CA-C 105.443 -2.058 . . . . 0.0 105.443 172.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.569 HD12 ' H ' ' A' ' 36' ' ' LEU . 3.9 mp -62.93 122.08 15.11 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -177.815 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 78.9 mt -69.09 146.58 52.46 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.306 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.487 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 70.3 mt 75.47 4.27 4.02 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 124.935 1.294 . . . . 0.0 112.265 177.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 94.1 t -120.3 125.79 74.57 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.223 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.599 -178.306 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.472 ' HA ' ' NH2' ' A' ' 35' ' ' ARG . 31.9 t70 -121.89 134.9 54.87 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 173.225 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.561 ' OG1' ' HB3' ' A' ' 21' ' ' ASP . 1.7 m . . . . . 0 C--N 1.307 -1.242 0 C-N-CA 123.741 0.816 . . . . 0.0 109.547 -177.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.598 0 CA-C-O 118.836 -0.98 . . . . 0.0 114.395 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.477 ' HA ' ' OG ' ' A' ' 59' ' ' SER . 32.4 Cg_exo -64.12 -21.48 67.85 Favored 'Trans proline' 0 C--N 1.364 1.381 0 C-N-CA 122.842 2.362 . . . . 0.0 112.357 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -68.8 -47.38 66.25 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 177.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.88 -46.47 68.34 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.078 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.501 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 12.9 p -65.88 -45.16 83.07 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -177.4 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.38 -39.46 90.73 Favored 'General case' 0 CA--C 1.51 -0.58 0 C-N-CA 121.255 -0.178 . . . . 0.0 110.864 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -63.92 -45.19 90.38 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.496 ' O ' HG22 ' A' ' 66' ' ' VAL . 44.8 m -56.84 -49.86 74.17 Favored 'General case' 0 N--CA 1.445 -0.708 0 O-C-N 124.181 0.926 . . . . 0.0 109.425 177.815 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.501 ' HG3' ' O ' ' A' ' 59' ' ' SER . 59.7 mtpt -56.83 -54.59 44.66 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.821 179.482 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -57.48 -42.01 81.8 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.69 0.618 . . . . 0.0 111.89 -177.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.8 ttt -72.35 -44.87 61.99 Favored 'General case' 0 N--CA 1.441 -0.911 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.854 -177.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.496 HG22 ' O ' ' A' ' 62' ' ' THR . 33.2 m -74.88 -30.91 24.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -70.8 -31.56 68.36 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.338 0.589 . . . . 0.0 109.774 176.088 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -84.23 -13.44 52.64 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.384 -178.681 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.57 132.43 46.91 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.025 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -79.51 -38.27 34.75 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-O 122.004 0.906 . . . . 0.0 109.226 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.458 ' H ' ' HB3' ' A' ' 95' ' ' ASP . 44.5 mtmt -133.18 150.44 52.0 Favored 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 106.02 -1.845 . . . . 0.0 106.02 178.01 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.442 HD12 ' HB2' ' A' ' 14' ' ' LEU . 53.3 mt -119.1 130.69 73.53 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.744 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 171.732 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.585 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 14.2 mm-40 -111.49 133.11 54.01 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 106.222 -1.77 . . . . 0.0 106.222 -178.364 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 m -112.64 122.81 67.54 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.916 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 174.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.485 ' HA ' ' HA ' ' A' ' 9' ' ' LYS . 33.7 tt0 -106.51 135.16 48.51 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 120.902 0.382 . . . . 0.0 110.526 -177.217 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -79.13 116.6 19.51 Favored 'General case' 0 N--CA 1.415 -2.215 0 CA-C-N 114.919 -1.037 . . . . 0.0 108.882 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.451 ' CG ' ' H ' ' A' ' 78' ' ' LYS . 25.9 t70 -96.8 -175.2 3.21 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 123.926 0.766 . . . . 0.0 109.924 -177.488 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.451 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 43.1 tptt -73.05 -9.4 58.69 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 124.443 1.097 . . . . 0.0 112.353 -173.009 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -81.05 -113.54 0.33 Allowed Glycine 0 C--N 1.314 -0.675 0 C-N-CA 120.337 -0.935 . . . . 0.0 110.927 174.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -130.21 175.01 9.27 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 176.169 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 40.4 ttt180 -96.15 -32.75 12.34 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 43.0 p . . . . . 0 N--CA 1.441 -0.923 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.834 177.654 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 27.8 mmt85 . . . . . 0 N--CA 1.439 -0.98 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -89.19 141.58 16.34 Favored Glycine 0 C--N 1.291 -1.919 0 N-CA-C 109.105 -1.598 . . . . 0.0 109.105 175.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.6 mt -124.4 105.84 9.75 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -178.34 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.54 164.18 38.51 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-O 120.631 0.253 . . . . 0.0 110.434 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.413 ' CZ ' ' HB2' ' A' ' 100' ' ' ASN . 13.1 t80 -89.21 130.77 35.57 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 173.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 45.2 mm -99.99 123.94 53.13 Favored 'Isoleucine or valine' 0 C--O 1.251 1.14 0 CA-C-O 120.954 0.407 . . . . 0.0 111.623 -175.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.585 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 50.1 m-85 -113.94 145.65 41.21 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 173.481 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.19 100.4 9.99 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 175.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.458 ' HB3' ' H ' ' A' ' 71' ' ' LYS 0.338 4.2 p-10 43.83 42.5 4.51 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 125.46 1.504 . . . . 0.0 114.256 -176.864 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.25 -17.84 39.99 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-N 114.687 -1.142 . . . . 0.0 113.52 177.06 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.2 mtmt -97.97 132.29 43.66 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 120.937 0.398 . . . . 0.0 110.908 -177.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' MET . . . . . 0.446 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 1.9 mpt? -70.39 109.99 5.06 Favored 'General case' 0 C--N 1.305 -1.334 0 C-N-CA 123.999 0.92 . . . . 0.0 112.95 -173.702 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 58.7 t -73.41 -43.78 55.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 121.441 0.639 . . . . 0.0 109.941 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.506 HD21 ' HB3' ' A' ' 36' ' ' LEU . 14.3 m120 -60.65 -45.16 95.15 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.247 -176.467 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -61.91 -38.0 86.76 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.05 178.147 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.557 ' O ' ' HG2' ' A' ' 106' ' ' GLN . . . -65.33 -46.69 79.25 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.265 179.585 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 97.2 mt -53.57 -48.66 68.95 Favored 'General case' 0 C--O 1.244 0.777 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -179.279 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 12.7 m -70.81 -36.97 66.76 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.514 ' HB2' ' HB3' ' B' ' 141' ' ' SER . 29.2 ttp180 -72.26 -21.81 61.32 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.557 ' HG2' ' O ' ' A' ' 102' ' ' ALA . 82.0 mm-40 -87.54 -2.67 58.78 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.32 0.581 . . . . 0.0 109.508 176.326 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.436 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 69.75 28.7 71.76 Favored Glycine 0 N--CA 1.444 -0.833 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.993 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.4 mt -94.98 -13.98 24.79 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-O 121.189 0.518 . . . . 0.0 110.577 -177.436 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -151.22 167.41 27.9 Favored 'General case' 0 N--CA 1.428 -1.569 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.231 -176.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -112.57 153.11 28.04 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 175.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.508 HG11 ' HG2' ' B' ' 139' ' ' ARG . 11.7 p -76.9 125.55 36.8 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-O 121.516 0.674 . . . . 0.0 110.475 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.455 ' CB ' ' HB2' ' A' ' 40' ' ' ASP . . . . . . . . 0 C--N 1.305 -1.368 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.867 176.325 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 . . . . . 0 N--CA 1.47 0.552 0 CA-C-O 120.994 0.426 . . . . 0.0 110.49 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -54.82 -55.35 31.22 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.926 -1.033 . . . . 0.0 112.892 -175.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 56.9 mm-40 -56.74 -45.92 81.69 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.043 -171.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.0 mt -62.9 -51.1 68.25 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 123.78 0.675 . . . . 0.0 111.019 -176.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 7.6 mp -70.04 -32.95 71.33 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 139' ' ' ARG . . . . . 0.508 ' HG2' HG11 ' A' ' 111' ' ' VAL . 34.1 mtp180 -68.25 -34.26 75.89 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.378 176.399 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 19.4 mmmt -70.46 -32.04 69.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.875 0.369 . . . . 0.0 110.941 173.253 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 141' ' ' SER . . . . . 0.514 ' HB3' ' HB2' ' A' ' 105' ' ' ARG . 43.3 m -65.82 -41.96 91.2 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.807 177.106 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.552 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 48.0 mt-10 -63.65 -46.96 83.27 Favored 'General case' 0 C--O 1.198 -1.612 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.455 172.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 143' ' ' ALA . . . . . 0.548 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -51.04 -44.41 61.08 Favored 'General case' 0 CA--C 1.509 -0.617 0 O-C-N 123.899 0.749 . . . . 0.0 111.608 -176.178 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -61.31 -47.41 86.09 Favored 'General case' 0 N--CA 1.441 -0.876 0 O-C-N 123.864 0.728 . . . . 0.0 109.503 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.1 -40.79 91.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.055 -178.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 146' ' ' LYS . . . . . 0.552 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 56.0 mttm -54.55 -45.09 73.4 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.102 0.477 . . . . 0.0 110.52 177.247 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 147' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 31.1 mmtp -79.9 -24.01 41.43 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.772 -174.161 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -87.23 -9.86 54.01 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.584 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 149' ' ' LYS . . . . . 0.552 ' O ' ' HB2' ' B' ' 154' ' ' SER . 27.4 mmmt 61.97 55.91 2.45 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.387 1.075 . . . . 0.0 108.428 -178.735 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 88.7 mt -95.06 123.25 38.44 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.038 -177.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 151' ' ' ASN . . . . . 0.436 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 54.2 m-80 46.26 -97.11 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.766 1.626 . . . . 0.0 113.574 -179.185 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 152' ' ' ILE . . . . . 0.563 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 64.4 mt -60.98 -36.01 69.22 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.632 0 CA-C-O 121.767 0.794 . . . . 0.0 110.401 -178.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -80.61 1.0 31.63 Favored 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.6 -175.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 154' ' ' SER . . . . . 0.552 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 25.0 t -99.72 -6.73 26.59 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.49 177.627 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 155' ' ' GLU . . . . . 0.563 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 12.5 pt-20 -79.94 -19.67 47.46 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 119.939 -0.704 . . . . 0.0 109.24 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 18.4 t70 . . . . . 0 CA--C 1.487 -1.473 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -178.027 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 28.9 t-80 . . . . . 0 N--CA 1.433 -1.277 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -96.33 125.02 40.54 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 115.32 -0.854 . . . . 0.0 108.926 179.25 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.473 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 7.5 pt-20 -135.38 143.4 45.2 Favored Pre-proline 0 C--N 1.303 -1.454 0 CA-C-N 116.78 -0.191 . . . . 0.0 110.489 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 6.0 Cg_exo -79.97 147.36 18.91 Favored 'Trans proline' 0 C--O 1.249 1.046 0 C-N-CA 122.472 2.115 . . . . 0.0 113.903 -176.763 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -129.86 171.26 12.91 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.208 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.423 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 28.1 m -117.13 145.6 43.7 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 107.081 -1.452 . . . . 0.0 107.081 178.529 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.1 tp -88.28 127.93 35.47 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 118.721 0.691 . . . . 0.0 110.381 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.483 HD11 ' HB2' ' A' ' 26' ' ' MET . 46.6 mm -93.13 -51.47 11.2 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 176.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -169.48 134.12 1.41 Allowed 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.347 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -84.79 131.51 34.53 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 172.519 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.436 ' HB ' ' O ' ' A' ' 22' ' ' THR . 59.7 mt -105.89 -64.45 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 C-N-CA 120.544 -0.463 . . . . 0.0 111.016 -175.09 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.457 ' HB2' ' OG1' ' A' ' 22' ' ' THR . 36.9 m-20 -122.71 -152.71 0.52 Allowed 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.051 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -101.69 44.43 1.54 Allowed Glycine 0 CA--C 1.498 -0.971 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 -178.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.455 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 33.0 t0 -179.73 -56.12 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 -178.177 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.457 ' OG1' ' HB2' ' A' ' 19' ' ' ASP . 1.0 OUTLIER -76.4 106.34 7.98 Favored 'General case' 0 N--CA 1.411 -2.377 0 CA-C-N 114.627 -1.169 . . . . 0.0 110.059 -178.296 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.5 m -130.68 151.04 35.27 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.451 -178.035 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 45.7 tttp -108.49 114.48 28.35 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 -176.14 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.7 mp -121.5 159.69 25.77 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 121.382 0.611 . . . . 0.0 111.416 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.513 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 64.0 ttp -119.46 116.24 25.71 Favored 'General case' 0 C--N 1.294 -1.83 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 177.47 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.2 p90 -119.66 119.53 33.98 Favored 'General case' 0 C--N 1.286 -2.154 0 C-N-CA 119.368 -0.933 . . . . 0.0 109.272 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 98.0 mttt 60.85 27.52 17.33 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.266 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.434 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 94.31 3.67 63.11 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-N 115.232 -0.895 . . . . 0.0 113.034 -179.589 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.513 ' O ' ' HA ' ' A' ' 26' ' ' MET . 1.7 mp0 -100.47 102.39 18.59 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.95 0.375 . . . . 0.0 110.446 177.217 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.434 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 1.5 Cg_endo -83.34 101.96 1.01 Allowed 'Trans proline' 0 N--CA 1.443 -1.45 0 C-N-CA 122.31 2.007 . . . . 0.0 109.856 176.264 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 66.7 mtt -124.98 147.47 48.91 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.492 -176.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.54 ' O ' ' HD3' ' A' ' 87' ' ' ARG . 23.7 m -85.91 121.37 28.45 Favored 'General case' 0 N--CA 1.422 -1.839 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 177.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -99.57 161.58 13.53 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-O 122.256 1.026 . . . . 0.0 113.532 -174.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.455 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 9.0 tpt180 -134.51 131.02 37.52 Favored 'General case' 0 N--CA 1.412 -2.327 0 N-CA-C 105.037 -2.208 . . . . 0.0 105.037 173.755 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.1 mp -69.94 129.3 39.13 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 119.658 -0.817 . . . . 0.0 111.859 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.453 HD21 ' HB3' ' A' ' 89' ' ' LEU . 50.2 mt -57.42 126.07 25.67 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 115.047 -0.979 . . . . 0.0 112.629 177.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 40.2 mt 72.03 23.4 3.47 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-N 113.485 -1.688 . . . . 0.0 112.562 173.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 51.1 t -111.41 135.57 50.2 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.033 0 CA-C-O 121.113 0.482 . . . . 0.0 110.596 177.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.539 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 35.8 t70 -122.36 106.79 11.39 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 174.364 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.455 HG21 ' HB2' ' A' ' 21' ' ' ASP . 1.8 p . . . . . 0 N--CA 1.421 -1.925 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.774 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.616 0 CA-C-O 118.803 -0.998 . . . . 0.0 114.758 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.47 -25.2 70.46 Favored 'Trans proline' 0 C--N 1.366 1.47 0 C-N-CA 122.409 2.073 . . . . 0.0 112.899 -178.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -70.3 -50.46 39.07 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 178.388 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.3 -43.06 98.91 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.296 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.7 p -64.91 -49.41 70.54 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.444 -178.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.33 -39.12 93.27 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 120.52 0.2 . . . . 0.0 110.853 -178.453 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -59.74 -52.73 64.21 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 123.435 0.694 . . . . 0.0 109.562 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 25.6 m -61.72 -47.15 86.56 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.313 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -58.36 -48.05 81.85 Favored 'General case' 0 CA--C 1.503 -0.839 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.191 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -60.7 -39.86 90.11 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.426 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 84.9 mtp -66.8 -47.71 71.22 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 120.141 -0.624 . . . . 0.0 111.633 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.9 m -75.09 -29.9 22.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -176.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -85.62 -29.52 24.01 Favored 'General case' 0 C--N 1.315 -0.933 0 O-C-N 121.83 -0.543 . . . . 0.0 112.182 -179.324 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -84.99 -11.71 54.87 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.296 0.57 . . . . 0.0 109.92 178.004 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.31 123.26 11.41 Favored 'General case' 0 C--O 1.244 0.791 0 C-N-CA 123.7 0.8 . . . . 0.0 112.069 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -74.54 -40.82 61.48 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 177.356 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -126.57 122.59 35.52 Favored 'General case' 0 N--CA 1.416 -2.169 0 CA-C-N 113.513 -1.676 . . . . 0.0 107.915 -179.043 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 63.5 mt -97.44 112.5 29.62 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.251 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 177.262 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.546 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 30.2 mt-10 -113.07 133.8 54.83 Favored 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 120.525 -0.47 . . . . 0.0 109.925 -175.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.0 m -110.93 127.01 68.33 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.693 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 171.629 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -115.33 128.85 56.37 Favored 'General case' 0 C--N 1.279 -2.495 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -175.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.455 ' CE1' ' HB2' ' A' ' 81' ' ' ARG . 32.2 t80 -97.41 131.86 43.67 Favored 'General case' 0 N--CA 1.414 -2.228 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.458 -175.149 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -85.66 -174.95 5.42 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -75.79 -14.95 60.32 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -175.629 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -97.93 -116.52 3.57 Favored Glycine 0 C--N 1.313 -0.742 0 C-N-CA 120.19 -1.005 . . . . 0.0 115.586 -172.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 16.4 mp0 -96.07 141.22 29.72 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -175.071 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.455 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . 19.3 ttm180 -96.82 -22.4 16.95 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 124.145 0.903 . . . . 0.0 108.859 176.668 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.4 p . . . . . 0 C--N 1.3 -1.583 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.985 -177.263 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.54 ' HD3' ' O ' ' A' ' 33' ' ' THR . 10.8 tpp85 . . . . . 0 N--CA 1.433 -1.316 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -76.62 141.17 26.18 Favored Glycine 0 N--CA 1.441 -0.967 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.453 ' HB3' HD21 ' A' ' 37' ' ' LEU . 88.2 mt -122.95 102.04 7.78 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -178.163 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -153.13 167.75 28.24 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 -178.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -88.28 141.99 28.11 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 174.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 46.5 mm -111.62 123.42 67.42 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.546 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 13.4 m-85 -118.91 139.0 52.37 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 176.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.63 98.85 8.49 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 174.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.276 4.3 p-10 42.91 43.34 3.48 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.749 1.22 . . . . 0.0 113.714 -175.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.3 -19.48 37.08 Favored Glycine 0 N--CA 1.443 -0.878 0 C-N-CA 120.858 -0.686 . . . . 0.0 113.412 178.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.3 mttp -82.85 113.15 20.28 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 179.131 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' MET . . . . . 0.483 ' CE ' ' HB2' ' A' ' 101' ' ' GLU . 44.7 ttp -77.48 106.85 9.52 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 45.4 t -59.73 -44.32 93.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.424 -173.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -65.62 -30.05 70.72 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.483 ' HB2' ' CE ' ' A' ' 98' ' ' MET . 7.9 tp10 -62.24 -53.82 49.76 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 173.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.76 -44.5 96.65 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.047 -0.979 . . . . 0.0 112.061 -177.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 90.3 mt -56.64 -51.7 67.7 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.1 t -73.17 -38.02 53.81 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.204 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.586 -177.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 101' ' ' GLU . 3.9 tpt180 -69.46 -25.95 64.34 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.164 0.586 . . . . 0.0 111.415 -176.287 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.2 tp60 -95.67 -1.84 49.29 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.265 0.555 . . . . 0.0 109.565 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.451 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 73.23 39.71 51.63 Favored Glycine 0 N--CA 1.442 -0.953 0 CA-C-N 115.316 -0.856 . . . . 0.0 113.597 177.662 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 78.8 mt -104.24 -10.09 18.14 Favored 'General case' 0 C--N 1.296 -1.756 0 O-C-N 122.431 -0.452 . . . . 0.0 110.337 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -153.17 168.21 26.72 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.824 -177.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.561 ' HG3' ' CZ3' ' B' ' 153' ' ' TRP . 0.9 OUTLIER -99.87 168.07 10.12 Favored 'General case' 0 CA--C 1.492 -1.268 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 176.024 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 12.7 p -93.08 138.12 20.89 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.475 0 N-CA-C 106.576 -1.638 . . . . 0.0 106.576 173.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.282 -2.353 0 N-CA-C 104.458 -2.423 . . . . 0.0 104.458 174.685 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 73.5 m80 . . . . . 0 N--CA 1.472 0.627 0 CA-C-O 119.749 -0.167 . . . . 0.0 111.277 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -51.07 -65.72 0.51 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.789 1.236 . . . . 0.0 109.523 -178.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 136' ' ' GLN . . . . . 0.56 ' O ' ' HG3' ' B' ' 140' ' ' LYS . 14.6 mm100 -60.86 -47.55 85.88 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.038 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 84.4 mt -58.65 -49.4 77.65 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -175.292 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 138' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' B' ' 138' ' ' LEU . 28.6 mt -70.03 -26.61 64.13 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 178.101 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -71.48 -25.39 62.26 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 119.831 -0.747 . . . . 0.0 110.532 173.106 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 140' ' ' LYS . . . . . 0.56 ' HG3' ' O ' ' B' ' 136' ' ' GLN . 29.5 mtpp -72.89 -38.07 67.09 Favored 'General case' 0 C--O 1.243 0.745 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 175.644 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 15.7 m -60.88 -45.53 94.19 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.322 -0.854 . . . . 0.0 108.805 175.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.454 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 5.0 tt0 -57.9 -58.54 7.92 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.828 176.323 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -51.58 -50.73 59.57 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.614 0.766 . . . . 0.0 112.537 -176.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 144' ' ' GLN . . . . . 0.438 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 50.5 tt0 -61.37 -47.11 87.35 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.945 -178.228 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -71.69 -33.04 68.47 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.713 -176.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 146' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 77.3 mttt -64.0 -43.33 96.0 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 175.031 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -60.11 -38.46 83.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.146 178.574 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 148' ' ' GLU . . . . . 0.459 ' HB2' ' HG ' ' B' ' 150' ' ' LEU . 13.3 mm-40 -81.58 -17.93 46.61 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.592 -179.378 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 31.2 mtpt 54.48 60.99 3.21 Favored 'General case' 0 C--O 1.244 0.78 0 C-N-CA 124.987 1.315 . . . . 0.0 109.342 -174.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 150' ' ' LEU . . . . . 0.459 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 53.4 mt -82.78 116.86 22.31 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 113.591 -1.64 . . . . 0.0 110.841 -176.696 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 151' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 93.6 m-20 47.44 -89.97 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 125.371 1.469 . . . . 0.0 114.616 174.107 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 152' ' ' ILE . . . . . 0.452 HG12 ' HE3' ' A' ' 110' ' ' LYS . 6.8 tt -70.46 -27.24 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -175.6 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 153' ' ' TRP . . . . . 0.561 ' CZ3' ' HG3' ' A' ' 110' ' ' LYS . 56.2 m95 -74.18 -18.41 60.77 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-O 121.646 0.736 . . . . 0.0 110.612 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 8.4 t -87.19 61.66 6.84 Favored 'General case' 0 N--CA 1.426 -1.646 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 176.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -97.3 -4.64 38.33 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 114.795 -1.093 . . . . 0.0 111.688 -179.135 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 . . . . . 0 C--N 1.295 -1.774 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 179.935 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' HIS . . . . . 0.569 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 17.2 m-70 . . . . . 0 CA--C 1.493 -1.24 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.439 ' HG3' ' OE1' ' A' ' 75' ' ' GLU . 18.2 mtmm -93.9 117.92 30.76 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 172.707 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.505 ' CD ' HH22 ' A' ' 81' ' ' ARG . 9.3 pt-20 -127.85 139.14 34.5 Favored Pre-proline 0 C--N 1.28 -2.44 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.479 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 17.0 Cg_exo -67.76 142.98 59.8 Favored 'Trans proline' 0 C--O 1.25 1.096 0 C-N-CA 122.443 2.095 . . . . 0.0 113.309 -178.02 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -134.43 159.27 41.61 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.439 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 7.0 m -96.91 138.62 34.17 Favored 'General case' 0 N--CA 1.423 -1.818 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 179.235 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 49.8 tp -84.97 124.01 31.19 Favored 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 120.164 -0.614 . . . . 0.0 109.5 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 75.1 mt -84.72 -52.69 12.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.532 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 174.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -179.02 163.6 1.35 Allowed 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 115.177 -0.919 . . . . 0.0 108.993 175.663 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.559 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -107.28 126.08 51.98 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 174.166 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.443 ' HB ' ' HB ' ' A' ' 22' ' ' THR . 44.8 mm -78.44 -64.13 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -175.582 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -113.25 -161.62 0.77 Allowed 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 178.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -97.47 27.27 19.44 Favored Glycine 0 C--N 1.296 -1.649 0 N-CA-C 108.863 -1.695 . . . . 0.0 108.863 169.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.709 ' OD2' ' HD2' ' A' ' 35' ' ' ARG . 4.9 t70 -143.78 -62.19 0.39 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 -171.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.443 ' HB ' ' HB ' ' A' ' 18' ' ' ILE . 1.8 m -83.77 128.22 34.38 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 114.631 -1.168 . . . . 0.0 108.75 178.498 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.4 m -133.23 155.65 41.07 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 C-N-CA 122.78 0.432 . . . . 0.0 110.656 -177.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -119.61 112.11 18.91 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 -176.006 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.1 mp -126.0 159.5 32.54 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.519 0.676 . . . . 0.0 112.532 -176.269 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.439 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 25.3 ttt -127.62 102.78 6.99 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.464 -1.244 . . . . 0.0 108.741 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -105.1 119.1 38.21 Favored 'General case' 0 C--N 1.287 -2.127 0 C-N-CA 118.931 -1.108 . . . . 0.0 109.867 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 88.2 mttt 59.43 27.92 17.17 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 122.092 0.948 . . . . 0.0 110.754 175.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.444 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 93.07 7.04 62.75 Favored Glycine 0 N--CA 1.439 -1.114 0 CA-C-N 114.619 -1.173 . . . . 0.0 113.245 179.013 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -105.57 101.42 32.02 Favored Pre-proline 0 C--N 1.31 -1.127 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 5.5 Cg_exo -79.67 118.3 3.82 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 122.628 2.219 . . . . 0.0 110.47 177.55 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 63.7 mtt -136.1 149.0 48.52 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.092 0.472 . . . . 0.0 110.819 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.6 m -83.87 107.48 16.28 Favored 'General case' 0 N--CA 1.427 -1.579 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 176.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -101.99 163.78 12.06 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-O 121.602 0.715 . . . . 0.0 110.246 -177.023 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.709 ' HD2' ' OD2' ' A' ' 21' ' ' ASP . 25.3 ttp85 -137.46 141.79 41.58 Favored 'General case' 0 C--N 1.27 -2.88 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 169.317 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.542 ' HB2' ' HB ' ' A' ' 39' ' ' VAL . 28.6 mt -60.94 109.43 1.07 Allowed 'General case' 0 C--N 1.307 -1.261 0 O-C-N 124.115 0.884 . . . . 0.0 109.213 -177.572 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.4 tt -63.71 126.29 27.1 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 -179.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.45 ' C ' ' H ' ' A' ' 112' ' ' ALA . 91.0 mt 85.99 8.48 0.31 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.16 1.784 . . . . 0.0 113.85 -178.037 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.542 ' HB ' ' HB2' ' A' ' 36' ' ' LEU . 99.7 t -118.33 130.93 72.48 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.15 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 176.257 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -133.53 107.86 8.27 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 177.593 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.8 m . . . . . 0 CA--C 1.569 1.68 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -177.002 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.365 0 N-CA-C 115.186 0.834 . . . . 0.0 115.186 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -56.49 -32.08 88.24 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 123.035 2.49 . . . . 0.0 113.984 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -68.21 -57.1 6.55 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.918 0.39 . . . . 0.0 111.616 -176.212 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.3 -41.41 98.95 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.559 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 37.0 m -63.96 -35.69 81.5 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.137 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.94 -37.86 88.71 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.023 0.44 . . . . 0.0 110.333 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -68.91 -53.09 22.98 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.774 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 28.5 m -57.11 -48.11 79.45 Favored 'General case' 0 C--N 1.318 -0.79 0 O-C-N 124.101 0.876 . . . . 0.0 112.306 -178.009 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.559 ' HG2' ' HB3' ' A' ' 17' ' ' ALA . 51.8 mttp -60.61 -54.54 44.16 Favored 'General case' 0 C--N 1.344 0.359 0 C-N-CA 120.962 -0.295 . . . . 0.0 110.963 -178.609 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.6 mtmp? -67.5 -23.24 65.45 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.194 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 15.5 tpt -67.05 -45.11 78.4 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.21 0.529 . . . . 0.0 109.629 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.0 m -86.93 -26.13 6.06 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.438 -178.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 63' ' ' LYS . 51.0 mt-10 -73.9 -34.15 64.29 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.368 177.608 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -83.96 -16.34 44.47 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 121.01 0.433 . . . . 0.0 110.415 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.74 143.12 48.03 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.018 -178.163 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 44.2 mttp -74.44 -44.31 52.34 Favored 'General case' 0 CA--C 1.493 -1.236 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.408 ' HB2' ' HE3' ' A' ' 71' ' ' LYS . 42.2 mtmt -133.78 147.35 51.26 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-N 113.846 -1.524 . . . . 0.0 107.047 -179.43 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.448 ' O ' ' HA ' ' A' ' 11' ' ' PRO . 4.0 mp -105.9 120.99 57.67 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.719 0 N-CA-C 105.106 -2.183 . . . . 0.0 105.106 173.467 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.627 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 23.9 mm-40 -111.83 132.95 54.36 Favored 'General case' 0 C--N 1.292 -1.908 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 -175.104 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.6 m -112.3 129.72 67.32 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.989 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 175.304 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.569 ' HA ' ' O ' ' A' ' 8' ' ' HIS . 28.4 tt0 -106.52 118.97 38.04 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 119.525 -0.87 . . . . 0.0 111.229 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -87.24 124.24 33.1 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-N 113.395 -1.729 . . . . 0.0 109.232 177.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -88.31 -175.58 5.06 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 177.393 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.55 -3.81 56.08 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -173.834 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -93.2 -87.67 1.59 Allowed Glycine 0 N--CA 1.435 -1.421 0 C-N-CA 119.913 -1.137 . . . . 0.0 112.473 -177.426 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -125.59 139.24 53.75 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -175.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.505 HH22 ' CD ' ' A' ' 10' ' ' GLU . 25.6 ttt180 -98.96 -13.35 19.99 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.648 0.737 . . . . 0.0 109.129 178.012 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 13.6 p . . . . . 0 C--N 1.311 -1.101 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.333 177.255 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 12.2 mmt85 . . . . . 0 N--CA 1.433 -1.298 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -74.78 121.22 6.62 Favored Glycine 0 N--CA 1.425 -2.033 0 O-C-N 123.712 0.632 . . . . 0.0 111.575 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.3 mt -103.58 93.05 4.72 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 178.266 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -145.13 155.08 43.1 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -179.37 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -85.25 132.04 34.33 Favored 'General case' 0 C--N 1.29 -2.02 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 48.3 mm -99.5 126.38 52.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 C-N-CA 119.247 -0.981 . . . . 0.0 110.073 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.627 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 27.0 m-85 -120.3 144.07 48.01 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 114.682 -1.145 . . . . 0.0 109.125 179.078 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -106.67 99.54 9.11 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 176.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.5 p30 42.79 38.31 1.32 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 125.146 1.378 . . . . 0.0 113.907 -176.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.78 -11.4 38.35 Favored Glycine 0 N--CA 1.444 -0.785 0 CA-C-N 115.449 -0.796 . . . . 0.0 114.131 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -87.63 135.27 33.43 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 176.063 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' MET . . . . . 0.602 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 3.6 mpp? -80.4 111.69 17.04 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 177.801 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 82.8 t -70.14 -45.63 75.28 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 19.1 m-20 -55.35 -50.13 70.46 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.421 -179.193 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' A' ' 105' ' ' ARG . 9.3 tp10 -55.8 -51.01 68.94 Favored 'General case' 0 C--O 1.211 -0.96 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.226 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.93 -43.29 95.04 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.829 -176.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 79.0 mt -60.29 -48.98 79.42 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 179.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 52.1 t -73.06 -31.5 35.47 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.47 -178.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.454 ' HB2' ' O ' ' A' ' 101' ' ' GLU . 1.8 tpt180 -72.57 -28.02 62.55 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.997 -178.654 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -87.51 -8.7 56.06 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.239 0.543 . . . . 0.0 109.76 175.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.97 41.52 87.48 Favored Glycine 0 N--CA 1.431 -1.695 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.186 -176.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 90.7 mt -96.89 -18.21 19.66 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.063 0.459 . . . . 0.0 110.768 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -149.7 171.32 16.88 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -176.058 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -110.2 171.55 7.38 Favored 'General case' 0 N--CA 1.425 -1.678 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.415 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 8.0 p -84.01 133.35 29.39 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.782 0 CA-C-O 121.066 0.46 . . . . 0.0 110.359 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.45 ' H ' ' C ' ' A' ' 38' ' ' LEU . . . . . . . . 0 CA--C 1.486 -1.503 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 176.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 63.0 m80 . . . . . 0 N--CA 1.448 -0.53 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -66.66 -38.03 86.01 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.902 -176.112 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -58.52 -37.93 76.65 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.153 -178.663 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.1 mt -64.83 -51.09 64.01 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.811 -178.115 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 8.2 mp -70.25 -23.26 62.87 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 178.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 84.9 mtt-85 -66.03 -31.24 72.02 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.278 -0.569 . . . . 0.0 110.537 174.051 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 140' ' ' LYS . . . . . 0.561 ' HE2' ' HA ' ' B' ' 140' ' ' LYS . 10.8 mmpt? -71.35 -39.7 71.15 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 176.022 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 3.5 m -59.99 -49.73 76.52 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.672 177.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.498 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 0.8 OUTLIER -64.22 -43.17 95.79 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.838 179.04 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 143' ' ' ALA . . . . . 0.403 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -61.66 -40.93 96.68 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.995 0.426 . . . . 0.0 110.888 179.125 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -69.21 -48.02 63.19 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.453 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.55 -32.49 73.87 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.564 -0.743 . . . . 0.0 112.081 -175.066 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 146' ' ' LYS . . . . . 0.498 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 84.0 mttt -65.33 -40.38 93.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.498 0.19 . . . . 0.0 110.648 174.009 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 147' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 48.4 mmtm -64.79 -37.88 89.11 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.501 0.667 . . . . 0.0 109.582 178.078 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 148' ' ' GLU . . . . . 0.407 ' HB2' ' HG ' ' B' ' 150' ' ' LEU . 49.3 mm-40 -79.24 -13.87 59.41 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 114.709 -1.132 . . . . 0.0 113.043 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm 54.32 47.49 22.86 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.54 0.736 . . . . 0.0 109.834 -178.283 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 150' ' ' LEU . . . . . 0.407 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 96.3 mt -74.98 95.59 3.02 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 114.943 -1.026 . . . . 0.0 112.0 -174.454 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 51.9 t30 53.92 -69.84 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 127.775 2.43 . . . . 0.0 114.154 173.088 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 12.0 tt -75.84 -28.74 19.48 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.075 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -78.13 -15.58 58.73 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.365 0.602 . . . . 0.0 111.407 -178.225 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 22.9 t -88.8 11.09 18.77 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.548 177.185 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -66.79 -28.73 68.62 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.147 0.579 . . . . 0.0 112.41 -178.209 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.1 t70 . . . . . 0 C--N 1.299 -1.592 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 -170.577 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' HIS . . . . . 0.426 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 7.7 m-70 . . . . . 0 CA--C 1.494 -1.209 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.52 107.48 15.21 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 105.022 -2.214 . . . . 0.0 105.022 175.691 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -138.99 159.0 68.73 Favored Pre-proline 0 C--N 1.3 -1.582 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.454 -173.415 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -78.94 147.17 21.06 Favored 'Trans proline' 0 C--O 1.25 1.075 0 C-N-CA 122.729 2.286 . . . . 0.0 114.123 -174.424 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -144.14 155.59 43.99 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.343 177.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.437 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 9.1 m -104.35 142.67 34.16 Favored 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 179.108 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -84.22 142.9 29.95 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 118.109 -1.437 . . . . 0.0 109.538 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 70.4 mt -103.0 -57.59 4.4 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.055 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 171.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 51.1 mttm -152.57 154.14 34.81 Favored 'General case' 0 N--CA 1.428 -1.536 0 C-N-CA 124.013 0.925 . . . . 0.0 110.552 -178.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.516 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -108.8 95.97 6.01 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 105.824 -1.917 . . . . 0.0 105.824 169.647 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 60.5 mt -68.4 -37.67 78.21 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.923 -171.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -152.44 -165.03 2.09 Favored 'General case' 0 C--N 1.291 -1.97 0 N-CA-C 106.366 -1.716 . . . . 0.0 106.366 -176.12 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -90.96 -25.76 23.82 Favored Glycine 0 C--N 1.286 -2.206 0 N-CA-C 109.029 -1.628 . . . . 0.0 109.029 176.546 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.698 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 10.5 t70 -92.87 -36.32 12.88 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 122.035 0.922 . . . . 0.0 109.504 -177.818 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.8 m -114.13 127.29 55.85 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 114.902 -1.045 . . . . 0.0 111.294 -173.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.9 p -132.79 153.75 38.54 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.629 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -178.164 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -112.85 112.96 24.82 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 -175.514 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -115.75 159.1 21.86 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.764 0.792 . . . . 0.0 111.737 -178.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.437 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 46.7 ttm -123.01 104.85 9.49 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 175.358 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -109.87 118.13 35.67 Favored 'General case' 0 C--N 1.286 -2.158 0 C-N-CA 118.147 -1.421 . . . . 0.0 109.626 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 78.9 mttt 62.41 27.69 16.46 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.222 1.009 . . . . 0.0 110.199 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.08 1.86 64.74 Favored Glycine 0 CA--C 1.524 0.598 0 CA-C-N 115.365 -0.834 . . . . 0.0 113.164 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.411 ' HA ' ' HD3' ' A' ' 31' ' ' PRO . 53.7 tt0 -104.11 107.55 57.5 Favored Pre-proline 0 C--N 1.32 -0.68 0 O-C-N 122.462 -0.434 . . . . 0.0 110.48 -179.108 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 30' ' ' GLN . 2.7 Cg_endo -83.23 120.31 2.9 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.119 2.546 . . . . 0.0 111.992 178.772 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' MET . . . . . 0.49 ' HB2' ' CE2' ' A' ' 34' ' ' PHE . 90.4 mtp -134.82 156.35 49.04 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 120.892 0.377 . . . . 0.0 110.273 178.381 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.2 m -92.98 119.5 32.31 Favored 'General case' 0 C--N 1.295 -1.786 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.49 ' CE2' ' HB2' ' A' ' 32' ' ' MET . 86.0 m-85 -116.78 142.57 46.75 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -176.149 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.698 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 31.6 mtm105 -106.3 153.89 21.54 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 166.119 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.527 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 73.9 mt -83.82 129.4 34.94 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-O 121.651 0.738 . . . . 0.0 112.464 -175.027 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.429 HD13 ' HB2' ' A' ' 77' ' ' ASP . 52.5 mt -57.04 130.29 45.45 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.452 176.107 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.602 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 78.5 mt 73.55 11.27 4.79 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 124.551 1.157 . . . . 0.0 112.481 177.603 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 86.3 t -110.84 131.05 63.08 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 CA-C-O 121.252 0.548 . . . . 0.0 110.646 -179.015 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.404 ' HB2' ' HB2' ' A' ' 112' ' ' ALA . 22.0 t70 -128.31 107.17 9.54 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 174.623 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.57 ' HB ' ' HB2' ' A' ' 21' ' ' ASP . 1.3 m . . . . . 0 C--N 1.287 -2.11 0 CA-C-O 118.139 -0.934 . . . . 0.0 112.357 175.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 1.643 0 CA-C-O 119.141 -0.811 . . . . 0.0 113.451 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo -56.26 -36.34 96.73 Favored 'Trans proline' 0 C--N 1.373 1.837 0 C-N-CA 122.911 2.407 . . . . 0.0 112.517 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.8 mp0 -62.36 -51.77 66.3 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 122.973 0.509 . . . . 0.0 110.406 178.669 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.29 -41.64 85.07 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.841 -178.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.0 m -67.83 -33.97 75.81 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.395 0.617 . . . . 0.0 111.357 -177.133 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -70.95 -39.07 72.8 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.042 175.508 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -62.8 -41.95 99.5 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.318 -176.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.537 ' O ' HG22 ' A' ' 66' ' ' VAL . 7.5 p -63.47 -44.61 93.92 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.85 178.331 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.516 ' HG2' ' HB3' ' A' ' 17' ' ' ALA . 9.1 mtpm? -57.67 -49.03 77.84 Favored 'General case' 0 CA--C 1.513 -0.475 0 O-C-N 123.385 0.428 . . . . 0.0 110.472 176.323 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 97.1 mttt -57.36 -39.89 76.92 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.139 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.6 mmt -72.19 -51.38 21.44 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.537 HG22 ' O ' ' A' ' 62' ' ' THR . 34.6 m -74.33 -27.21 21.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 -174.018 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -86.19 -20.15 28.98 Favored 'General case' 0 C--N 1.314 -0.953 0 O-C-N 121.847 -0.533 . . . . 0.0 110.577 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -83.59 -24.66 31.4 Favored 'General case' 0 C--O 1.245 0.856 0 CA-C-O 121.158 0.504 . . . . 0.0 109.822 174.204 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.57 131.25 38.32 Favored 'General case' 0 C--O 1.248 1.013 0 CA-C-N 114.819 -1.082 . . . . 0.0 112.027 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -82.99 -37.49 23.94 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 115.117 -0.947 . . . . 0.0 108.69 177.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -133.09 119.8 20.46 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.781 -1.1 . . . . 0.0 108.182 -178.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 63.4 mt -99.51 112.56 32.17 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.658 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -114.31 142.14 46.7 Favored 'General case' 0 C--N 1.289 -2.023 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.083 -177.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -110.34 124.95 67.53 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.756 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.426 ' HA ' ' O ' ' A' ' 8' ' ' HIS . 34.2 tt0 -115.28 125.62 53.51 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -96.55 129.18 43.98 Favored 'General case' 0 N--CA 1.406 -2.627 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.851 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.429 ' HB2' HD13 ' A' ' 37' ' ' LEU . 17.2 t70 -85.51 -174.37 5.14 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 125.117 1.367 . . . . 0.0 110.031 -176.462 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.655 ' NZ ' ' HA ' ' A' ' 78' ' ' LYS . 1.1 mmpm? -94.78 7.85 44.52 Favored 'General case' 0 C--N 1.313 -0.993 0 O-C-N 121.458 -0.776 . . . . 0.0 112.144 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -84.15 -137.2 3.43 Favored Glycine 0 N--CA 1.428 -1.867 0 C-N-CA 120.775 -0.726 . . . . 0.0 111.899 175.281 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -95.23 144.22 26.01 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.6 ttm180 -87.07 -29.18 22.09 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.162 0.506 . . . . 0.0 110.528 178.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.0 p . . . . . 0 C--N 1.294 -1.829 0 CA-C-O 121.353 0.597 . . . . 0.0 111.561 -178.152 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.504 ' HG2' ' HG3' ' A' ' 35' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.509 -0.598 0 CA-C-O 121.326 0.584 . . . . 0.0 110.176 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -103.76 152.28 17.79 Favored Glycine 0 N--CA 1.42 -2.374 0 N-CA-C 106.859 -2.496 . . . . 0.0 106.859 168.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 93.6 mt -109.03 122.5 47.39 Favored 'General case' 0 C--N 1.282 -2.333 0 CA-C-N 117.972 0.886 . . . . 0.0 110.442 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -144.16 157.85 44.06 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.116 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.487 ' CZ ' ' HB2' ' A' ' 100' ' ' ASN . 4.3 t80 -103.83 129.73 51.32 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 105.546 -2.02 . . . . 0.0 105.546 174.838 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 41.6 mm -99.32 125.73 52.8 Favored 'Isoleucine or valine' 0 C--O 1.249 1.042 0 C-N-CA 119.731 -0.788 . . . . 0.0 111.892 -178.038 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -110.79 131.6 54.91 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.983 173.474 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.67 98.26 8.03 Favored 'General case' 0 C--N 1.289 -2.052 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 175.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.251 4.1 p30 44.92 32.12 0.79 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.209 1.404 . . . . 0.0 114.137 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.21 2.16 35.77 Favored Glycine 0 CA--C 1.521 0.442 0 CA-C-N 115.676 -0.693 . . . . 0.0 113.445 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.7 mttp -99.78 126.88 45.92 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 175.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -78.13 105.5 9.39 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 122.815 0.446 . . . . 0.0 110.401 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 57.6 t -71.51 -43.05 72.46 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.332 -178.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.527 ' ND2' ' HB3' ' A' ' 36' ' ' LEU . 1.7 m-20 -58.76 -49.82 76.2 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.957 -178.719 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -63.84 -37.16 86.34 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.542 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.55 -44.6 93.19 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.898 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.13 -52.75 64.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.747 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.1 t -65.05 -41.45 92.02 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.276 -177.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 34.4 ttp85 -64.23 -31.98 73.39 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.922 0.391 . . . . 0.0 111.291 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -87.99 -1.05 57.75 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.954 0.354 . . . . 0.0 111.954 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.433 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 74.44 22.14 77.85 Favored Glycine 0 N--CA 1.441 -0.997 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.428 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.3 mt -91.67 -6.24 52.44 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -151.85 162.95 40.22 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.005 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt -120.34 154.74 34.62 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 178.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.6 p -76.98 127.97 37.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 C-N-CA 118.656 -1.218 . . . . 0.0 112.28 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.602 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . . . . . . 0 C--N 1.299 -1.603 0 N-CA-C 105.225 -2.139 . . . . 0.0 105.225 171.083 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 69.9 m80 . . . . . 0 C--O 1.223 -0.309 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -60.64 -59.84 4.75 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.467 -174.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 136' ' ' GLN . . . . . 0.464 ' O ' ' HG2' ' B' ' 140' ' ' LYS . 13.7 mm100 -54.99 -44.57 74.6 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 123.946 0.779 . . . . 0.0 111.885 -176.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 91.2 mt -60.24 -47.4 86.14 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.652 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.58 -35.5 75.4 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 178.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -60.62 -45.21 94.89 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 120.759 0.314 . . . . 0.0 110.296 176.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 140' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' B' ' 136' ' ' GLN . 2.8 mmmp? -63.43 -44.91 93.21 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.436 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 8.1 p -70.2 -41.07 74.17 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.327 -178.193 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.529 ' HG3' ' CZ2' ' B' ' 153' ' ' TRP . 39.3 tt0 -65.94 -44.84 83.86 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.516 177.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -54.29 -43.4 71.03 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 120.999 0.428 . . . . 0.0 110.591 -179.555 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -64.73 -46.85 80.47 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.526 178.219 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.13 -35.73 80.36 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.915 -178.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 146' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 88.8 mttt -62.33 -38.77 90.76 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.971 0.415 . . . . 0.0 110.334 176.187 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 9.9 mtpm? -63.99 -40.63 96.79 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.226 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -86.35 -8.12 57.94 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.337 -175.175 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 149' ' ' LYS . . . . . 0.515 ' O ' ' HB2' ' B' ' 154' ' ' SER . 51.0 mtpt 49.7 58.83 5.0 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 124.092 0.957 . . . . 0.0 111.119 -177.571 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 90.8 mt -88.52 119.51 29.04 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.299 -178.555 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 151' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 90.9 m-20 52.5 -93.46 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.163 1.385 . . . . 0.0 113.885 176.021 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 35.3 mt -65.64 -31.4 53.61 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.593 0 CA-C-O 121.087 0.47 . . . . 0.0 110.569 178.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 153' ' ' TRP . . . . . 0.529 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 58.8 m95 -77.94 -6.49 54.54 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-O 122.101 0.953 . . . . 0.0 111.117 -178.792 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 154' ' ' SER . . . . . 0.515 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 19.9 t -99.87 18.62 17.87 Favored 'General case' 0 N--CA 1.411 -2.4 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.14 175.082 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -71.25 -17.62 62.48 Favored 'General case' 0 C--N 1.356 0.86 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 173.518 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.1 t70 . . . . . 0 CA--C 1.5 -0.966 0 CA-C-N 113.339 -1.755 . . . . 0.0 112.1 175.08 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 25.5 p80 . . . . . 0 C--O 1.232 0.148 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.579 ' H ' ' HD3' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -94.49 132.23 39.37 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 174.7 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.48 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 3.9 pt-20 -117.38 144.37 33.85 Favored Pre-proline 0 C--N 1.262 -3.217 0 CA-C-N 114.423 -1.262 . . . . 0.0 110.847 -175.592 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.48 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 23.5 Cg_exo -63.92 138.91 65.34 Favored 'Trans proline' 0 C--N 1.359 1.098 0 C-N-CA 123.07 2.514 . . . . 0.0 114.301 -174.214 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.587 ' O ' ' HB ' ' A' ' 72' ' ' ILE . . . -136.08 151.68 50.08 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.488 178.257 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.418 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 86.7 m -98.94 133.2 43.55 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 178.158 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.489 ' H ' HD23 ' A' ' 14' ' ' LEU . 2.2 pt? -80.93 141.31 34.64 Favored 'General case' 0 C--N 1.306 -1.292 0 C-N-CA 118.498 -1.281 . . . . 0.0 109.255 177.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 74.1 mt -101.36 -53.56 7.51 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 175.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -161.67 156.99 23.82 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.489 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.473 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -112.54 119.11 37.06 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 174.64 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 59.8 mt -85.71 -64.03 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 CA-C-O 121.192 0.52 . . . . 0.0 109.747 -175.069 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -135.93 -168.79 2.28 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.172 -0.922 . . . . 0.0 108.526 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -74.11 -22.54 77.69 Favored Glycine 0 C--N 1.314 -0.661 0 C-N-CA 120.657 -0.783 . . . . 0.0 112.615 -177.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.438 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 9.6 p-10 -100.63 -20.36 15.69 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 122.304 0.242 . . . . 0.0 110.756 -176.628 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 p -127.73 118.8 24.46 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.3 m -128.11 157.45 40.33 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.916 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 176.781 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -119.89 119.22 32.87 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -178.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.9 mp -125.25 159.57 31.33 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.501 0.667 . . . . 0.0 112.2 -175.706 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.455 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 48.0 ttm -122.8 107.09 11.51 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 124.177 0.991 . . . . 0.0 108.497 177.66 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -113.18 126.89 55.93 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.9 mttt 59.0 27.66 16.66 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 121.613 0.721 . . . . 0.0 111.0 178.137 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 88.03 7.05 74.49 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.749 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.455 ' O ' ' HA ' ' A' ' 26' ' ' MET . 17.6 mm-40 -103.88 104.11 41.11 Favored Pre-proline 0 C--N 1.319 -0.74 0 O-C-N 122.422 -0.457 . . . . 0.0 110.511 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -81.07 113.83 2.77 Favored 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.623 2.215 . . . . 0.0 110.685 176.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 65.6 mtt -135.14 149.85 50.07 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.6 m -87.75 129.68 35.09 Favored 'General case' 0 C--N 1.295 -1.804 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 175.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -113.51 138.9 49.47 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -173.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.438 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 10.6 tpp85 -107.99 129.46 55.12 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 106.324 -1.732 . . . . 0.0 106.324 168.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.406 HD22 HD12 ' A' ' 103' ' ' LEU . 6.9 mp -64.94 122.02 16.02 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.5 0.667 . . . . 0.0 111.066 178.886 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.4 tt -66.35 130.18 42.33 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.98 -1.009 . . . . 0.0 108.699 -177.426 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 70.3 mt 79.5 8.16 1.76 Allowed 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 124.938 1.295 . . . . 0.0 111.611 -177.281 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 54.2 t -115.41 126.44 72.97 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 CA-C-O 121.175 0.512 . . . . 0.0 110.543 179.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -141.68 108.01 5.27 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.325 175.121 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.3 m . . . . . 0 C--N 1.282 -2.351 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.143 173.159 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.863 0 CA-C-O 119.121 -0.821 . . . . 0.0 113.157 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -54.44 -38.74 89.66 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 122.776 2.317 . . . . 0.0 111.852 176.28 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -63.25 -56.82 13.35 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.737 178.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.48 -51.07 69.85 Favored 'General case' 0 CA--C 1.516 -0.351 0 O-C-N 124.018 0.824 . . . . 0.0 111.943 -176.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.515 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 13.9 p -64.8 -44.46 89.87 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.846 -0.616 . . . . 0.0 112.661 -177.099 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -69.98 -34.81 73.84 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -59.66 -49.22 78.58 Favored 'General case' 0 C--O 1.244 0.767 0 C-N-CA 123.116 0.566 . . . . 0.0 110.758 -177.137 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.9 m -61.6 -42.02 98.27 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.138 178.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.515 ' HG3' ' O ' ' A' ' 59' ' ' SER . 29.7 mtpp -57.28 -46.79 82.79 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.646 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 97.6 mttt -65.89 -42.43 90.29 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.641 -0.708 . . . . 0.0 111.331 -178.314 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.1 mmt -64.05 -44.71 91.66 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 123.557 0.536 . . . . 0.0 112.373 -179.12 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.5 m -72.38 -29.23 30.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -176.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -82.65 -26.97 31.66 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 119.915 -0.714 . . . . 0.0 110.979 178.381 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -73.08 -27.87 61.97 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.009 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.533 ' HA ' ' OD1' ' A' ' 95' ' ' ASP . . . -55.09 121.02 7.85 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 114.63 -1.168 . . . . 0.0 112.481 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.47 ' HD2' ' N ' ' A' ' 70' ' ' LYS . 9.3 mptt -82.88 -31.09 28.07 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 174.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.6 mtpp -127.21 126.97 43.71 Favored 'General case' 0 N--CA 1.426 -1.64 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.587 ' HB ' ' O ' ' A' ' 12' ' ' ALA . 3.7 mp -113.64 113.15 43.1 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.194 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 178.272 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.521 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 24.8 mt-10 -113.01 137.46 51.37 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 -177.091 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.1 m -110.29 127.04 67.53 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 177.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -114.11 140.45 48.48 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.717 -175.138 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -109.92 116.82 32.31 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 124.204 1.002 . . . . 0.0 110.963 -177.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -88.36 -174.28 4.55 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 176.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -60.1 -13.08 10.12 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -175.079 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -76.6 -151.08 3.73 Favored Glycine 0 C--N 1.313 -0.706 0 CA-C-O 121.497 0.499 . . . . 0.0 114.155 -173.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -89.81 155.86 18.88 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 42.4 ttt180 -91.75 -3.51 56.12 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 122.357 1.075 . . . . 0.0 108.615 178.542 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.8 p . . . . . 0 N--CA 1.438 -1.058 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.566 179.331 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.443 -0.787 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -112.79 144.64 18.02 Favored Glycine 0 N--CA 1.42 -2.403 0 N-CA-C 108.789 -1.724 . . . . 0.0 108.789 171.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 59.4 mt -101.64 110.48 22.48 Favored 'General case' 0 CA--C 1.491 -1.307 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 178.552 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.12 155.47 32.6 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 177.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . 0.302 54.2 p90 -110.06 140.84 43.68 Favored 'General case' 0 N--CA 1.424 -1.746 0 C-N-CA 119.241 -0.983 . . . . 0.0 112.456 176.205 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 34.4 mm -98.92 131.0 46.96 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 CA-C-N 115.551 -0.749 . . . . 0.0 112.695 -166.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.521 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 82.8 m-85 -107.66 127.67 53.87 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 168.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.426 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -105.15 99.4 9.02 Favored 'General case' 0 C--N 1.289 -2.05 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 176.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.533 ' OD1' ' HA ' ' A' ' 69' ' ' ALA . 6.2 p-10 45.01 41.72 5.68 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.09 1.356 . . . . 0.0 113.191 -178.438 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.95 -23.39 27.74 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.293 -0.867 . . . . 0.0 113.337 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -87.52 113.65 23.4 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' MET . . . . . 0.484 ' HE3' ' HB2' ' A' ' 101' ' ' GLU . 52.2 ttp -74.99 105.42 6.0 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 45.2 t -64.12 -29.82 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-O 121.679 0.752 . . . . 0.0 109.665 -175.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -61.08 -40.07 92.32 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.067 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.506 ' OE2' ' HD3' ' A' ' 105' ' ' ARG . 11.4 tp10 -64.94 -54.05 36.75 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 114.883 -1.053 . . . . 0.0 108.338 176.638 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -53.1 -48.38 67.84 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.112 -0.949 . . . . 0.0 113.129 -176.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.406 HD12 HD22 ' A' ' 36' ' ' LEU . 85.1 mt -59.87 -48.14 82.89 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 78.7 t -73.01 -35.06 47.57 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 CA-C-O 120.981 0.42 . . . . 0.0 110.292 -178.419 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.506 ' HD3' ' OE2' ' A' ' 101' ' ' GLU . 4.0 tpt180 -65.5 -41.05 93.65 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 123.388 0.675 . . . . 0.0 110.174 -178.622 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -83.99 -3.1 57.75 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.887 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.98 39.05 85.31 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 121.077 -0.582 . . . . 0.0 112.744 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 92.3 mt -102.17 4.4 39.43 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-O 121.938 0.875 . . . . 0.0 109.586 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -165.18 165.36 19.8 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 114.513 -1.221 . . . . 0.0 107.862 178.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.4 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 83.1 mttt -111.53 165.75 11.73 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 174.764 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.457 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 78.1 t -76.76 136.46 24.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.631 177.759 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.379 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.976 179.971 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 . . . . . 0 CA--C 1.504 -0.804 0 CA-C-O 120.973 0.416 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.548 ' OE2' ' HD2' ' B' ' 139' ' ' ARG . 2.4 tm-20 -69.15 -47.92 63.72 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.373 -178.527 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -63.84 -33.32 75.43 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.354 0.597 . . . . 0.0 110.516 176.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 78.8 mt -70.41 -50.57 37.19 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.729 -177.253 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.21 -33.6 75.71 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.713 0.292 . . . . 0.0 111.586 177.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 139' ' ' ARG . . . . . 0.548 ' HD2' ' OE2' ' B' ' 135' ' ' GLU . 84.2 mtt180 -66.81 -27.92 67.95 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 177.203 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 28.5 ttpp -71.37 -39.88 70.96 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 177.177 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 15.2 m -62.39 -45.66 92.15 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 114.832 -1.076 . . . . 0.0 109.249 175.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.525 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 40.2 tt0 -59.44 -48.08 83.01 Favored 'General case' 0 C--O 1.204 -1.291 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.652 177.383 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -56.65 -40.97 76.42 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 122.693 0.397 . . . . 0.0 110.993 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -67.78 -47.37 69.34 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.04 178.303 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -64.15 -34.06 77.21 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.707 -178.069 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 146' ' ' LYS . . . . . 0.525 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 89.8 mttt -61.87 -46.88 87.48 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 177.248 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -69.85 -35.41 74.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.222 -177.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 59.7 mm-40 -74.36 -17.25 60.85 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.195 177.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt 57.03 56.51 5.25 Favored 'General case' 0 CA--C 1.514 -0.424 0 C-N-CA 124.785 1.234 . . . . 0.0 110.49 -178.306 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 91.8 mt -91.55 121.37 33.18 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.76 -176.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 51.24 -92.51 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 125.481 1.513 . . . . 0.0 113.898 178.207 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 24.5 mt -65.2 -33.98 67.37 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.899 0 CA-C-O 121.058 0.456 . . . . 0.0 110.979 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 153' ' ' TRP . . . . . 0.518 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 63.7 m95 -75.96 -6.09 49.31 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.573 0.701 . . . . 0.0 111.465 -177.317 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 42.3 t -92.72 16.31 12.57 Favored 'General case' 0 N--CA 1.425 -1.704 0 CA-C-N 115.433 -0.803 . . . . 0.0 108.916 174.718 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -63.03 -21.79 66.41 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.494 0.664 . . . . 0.0 110.11 174.427 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 . . . . . 0 N--CA 1.427 -1.592 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 176.989 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 83.8 t60 . . . . . 0 N--CA 1.435 -1.192 0 CA-C-O 121.277 0.56 . . . . 0.0 112.035 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.408 ' HB3' ' HB2' ' A' ' 75' ' ' GLU . 62.2 pttt -116.13 159.62 21.5 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.042 176.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -134.71 159.8 70.81 Favored Pre-proline 0 C--N 1.3 -1.551 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 178.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -81.68 140.51 11.75 Favored 'Trans proline' 0 C--O 1.244 0.824 0 C-N-CA 123.007 2.472 . . . . 0.0 111.138 175.04 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -127.64 162.87 25.51 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.805 178.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.501 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 36.5 m -98.16 131.47 44.51 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.6 tp -84.28 122.19 28.55 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 -179.235 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 72.4 mt -93.0 -59.74 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.501 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -161.22 143.58 12.24 Favored 'General case' 0 N--CA 1.416 -2.128 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.055 -178.327 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.478 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -96.25 108.31 20.77 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 105.966 -1.864 . . . . 0.0 105.966 171.56 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 70.6 mt -81.85 -53.87 11.08 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.417 0 CA-C-O 121.345 0.593 . . . . 0.0 110.795 -173.177 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.534 ' HB2' ' H ' ' A' ' 22' ' ' THR . 11.8 m-20 -128.55 -175.35 3.5 Favored 'General case' 0 C--N 1.295 -1.803 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 -179.131 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -94.98 46.43 2.06 Favored Glycine 0 C--N 1.304 -1.218 0 N-CA-C 108.571 -1.812 . . . . 0.0 108.571 173.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.586 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 9.6 t70 -171.48 -52.74 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 105.926 -1.879 . . . . 0.0 105.926 -172.23 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.534 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 1.3 m -91.54 118.49 30.64 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 113.868 -1.514 . . . . 0.0 110.56 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.4 m -133.16 151.04 33.27 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.931 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 177.092 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -116.03 116.04 27.18 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 -177.144 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.9 mp -123.93 159.06 30.55 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.274 0.559 . . . . 0.0 111.028 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.501 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 57.2 ttp -120.67 111.83 18.12 Favored 'General case' 0 C--N 1.293 -1.862 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 175.127 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 44.1 p90 -106.93 110.34 22.46 Favored 'General case' 0 CA--C 1.485 -1.523 0 C-N-CA 119.163 -1.015 . . . . 0.0 110.748 -178.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 97.2 mttt 53.43 38.99 29.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.716 -178.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.497 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 95.26 2.18 62.25 Favored Glycine 0 N--CA 1.448 -0.535 0 CA-C-N 113.796 -1.547 . . . . 0.0 113.766 177.121 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.438 ' O ' ' HA ' ' A' ' 26' ' ' MET . 2.4 mp0 -100.48 97.56 6.69 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 117.0 0.4 . . . . 0.0 110.545 177.457 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.497 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 1.8 Cg_endo -83.39 105.51 1.27 Allowed 'Trans proline' 0 C--O 1.243 0.743 0 C-N-CA 122.964 2.443 . . . . 0.0 111.192 179.196 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 66.3 mtt -129.32 153.18 48.1 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.082 0.467 . . . . 0.0 110.385 -177.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.8 m -89.67 119.72 30.32 Favored 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 107.646 -1.242 . . . . 0.0 107.646 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -101.52 150.18 23.33 Favored 'General case' 0 C--N 1.282 -2.357 0 CA-C-O 121.654 0.74 . . . . 0.0 111.629 -176.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.615 ' HB2' ' NH1' ' A' ' 87' ' ' ARG . 9.7 mmt85 -127.43 127.07 43.51 Favored 'General case' 0 C--N 1.283 -2.295 0 N-CA-C 103.541 -2.763 . . . . 0.0 103.541 171.263 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.426 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 9.3 mt -68.72 133.08 47.89 Favored 'General case' 0 C--N 1.289 -2.038 0 O-C-N 123.709 0.631 . . . . 0.0 109.995 -173.444 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.4 mt -61.4 137.03 58.23 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.891 176.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 67.5 mt 73.92 14.35 4.02 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 124.391 1.057 . . . . 0.0 113.056 175.325 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 85.3 t -110.74 126.46 68.08 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.569 0 CA-C-O 121.109 0.48 . . . . 0.0 110.662 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -125.01 108.24 11.63 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 115.421 -0.808 . . . . 0.0 109.549 175.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 p . . . . . 0 C--N 1.29 -1.985 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.935 176.916 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.492 0 CA-C-O 119.077 -0.846 . . . . 0.0 114.844 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -60.09 -38.99 73.65 Favored 'Trans proline' 0 C--N 1.366 1.462 0 C-N-CA 122.65 2.233 . . . . 0.0 112.663 -179.656 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -62.43 -47.9 82.03 Favored 'General case' 0 C--O 1.245 0.868 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.624 -177.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.93 -43.79 87.05 Favored 'General case' 0 C--O 1.242 0.709 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.772 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.407 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 22.7 p -64.8 -46.07 83.6 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -67.86 -36.04 79.6 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 120.589 0.233 . . . . 0.0 111.421 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -61.49 -47.37 85.93 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.076 178.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.443 ' O ' HG22 ' A' ' 66' ' ' VAL . 40.8 m -60.47 -44.93 95.39 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.688 -178.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.478 ' HG2' ' HB3' ' A' ' 17' ' ' ALA . 44.4 mtpt -59.22 -49.79 76.51 Favored 'General case' 0 C--N 1.345 0.402 0 O-C-N 123.23 0.331 . . . . 0.0 110.468 178.652 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -55.42 -44.48 76.29 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.986 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.9 mmt -71.02 -38.38 72.6 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -177.557 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.443 HG22 ' O ' ' A' ' 62' ' ' THR . 35.3 m -80.67 -31.83 12.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 -178.345 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -76.09 -27.71 57.28 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 121.4 0.619 . . . . 0.0 110.36 177.31 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -67.42 -31.39 71.56 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.905 176.056 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.539 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -69.89 131.31 44.25 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.737 -177.031 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -78.95 -41.34 29.56 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 171.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.3 mtmt -113.96 131.42 56.33 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 114.832 -1.076 . . . . 0.0 108.664 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 3.9 mp -111.43 117.92 56.24 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.364 0 N-CA-C 105.221 -2.14 . . . . 0.0 105.221 174.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.536 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 23.2 mt-10 -112.75 140.01 47.89 Favored 'General case' 0 C--N 1.295 -1.776 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.875 -172.283 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.48 HG12 ' CD1' ' A' ' 92' ' ' ILE . 10.1 m -116.38 117.66 56.23 Favored 'Isoleucine or valine' 0 C--O 1.25 1.092 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.398 178.659 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.408 ' HB2' ' HB3' ' A' ' 9' ' ' LYS . 23.8 tt0 -109.14 143.5 38.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.842 0.353 . . . . 0.0 111.188 -176.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -94.14 147.81 22.79 Favored 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 124.7 1.2 . . . . 0.0 110.31 -176.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -116.29 -175.81 2.82 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 176.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.52 -26.73 68.03 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.409 0.684 . . . . 0.0 112.16 -175.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -72.64 -115.43 0.06 OUTLIER Glycine 0 N--CA 1.445 -0.719 0 CA-C-N 115.888 -0.596 . . . . 0.0 113.436 -177.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -124.64 165.09 18.51 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 122.28 -0.541 . . . . 0.0 109.761 -178.266 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 44.2 ttt85 -104.65 -13.18 16.04 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-O 121.783 0.801 . . . . 0.0 108.987 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.8 p . . . . . 0 N--CA 1.436 -1.14 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.176 178.19 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.615 ' NH1' ' HB2' ' A' ' 35' ' ' ARG . 0.8 OUTLIER . . . . . 0 N--CA 1.442 -0.842 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -80.82 144.89 25.54 Favored Glycine 0 C--N 1.305 -1.185 0 C-N-CA 121.031 -0.604 . . . . 0.0 113.281 -177.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.0 mt -117.48 97.9 6.12 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.172 -1.048 . . . . 0.0 108.172 177.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.63 161.64 39.89 Favored 'General case' 0 C--N 1.313 -0.999 0 C-N-CA 120.223 -0.591 . . . . 0.0 111.414 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -88.86 127.4 35.63 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 105.951 -1.87 . . . . 0.0 105.951 170.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.48 ' CD1' HG12 ' A' ' 74' ' ' VAL . 45.7 mm -99.55 123.75 52.48 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.072 -179.405 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.536 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 77.5 m-85 -109.18 132.51 54.05 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 175.399 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.539 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -105.35 100.54 10.11 Favored 'General case' 0 C--N 1.285 -2.234 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 176.704 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.498 ' OD2' ' HA ' ' A' ' 69' ' ' ALA . 3.0 p30 46.32 29.97 0.95 Allowed 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 124.928 1.291 . . . . 0.0 113.472 -174.089 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.44 -9.8 38.67 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.852 -0.613 . . . . 0.0 113.435 -179.201 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -83.53 121.87 27.79 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 175.274 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 34.2 ttp -80.68 99.47 8.2 Favored 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 179.185 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 48.7 t -58.36 -43.62 86.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 114.781 -1.1 . . . . 0.0 112.795 -169.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.426 ' HB3' ' HB3' ' A' ' 36' ' ' LEU . 24.7 p-10 -66.5 -31.4 72.1 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.499 -176.745 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -77.61 -40.64 41.35 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.94 -39.25 77.58 Favored 'General case' 0 C--O 1.222 -0.351 0 O-C-N 123.741 0.651 . . . . 0.0 110.737 179.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.17 -44.66 94.83 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.915 177.088 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 95.0 t -70.26 -47.57 66.19 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.302 -178.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 11.5 ttp85 -60.45 -37.82 82.2 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 177.507 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -82.3 0.93 39.31 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-O 120.678 0.275 . . . . 0.0 111.575 177.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.85 38.06 93.95 Favored Glycine 0 C--O 1.221 -0.712 0 CA-C-N 116.276 -0.42 . . . . 0.0 113.688 177.658 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.4 mt -100.62 -13.66 18.48 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.377 0.608 . . . . 0.0 110.22 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -152.13 160.19 43.47 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -105.56 164.15 12.11 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 106.759 -1.571 . . . . 0.0 106.759 177.082 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.457 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 82.5 t -71.38 128.39 34.44 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.507 177.331 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -1.034 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 176.243 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 . . . . . 0 N--CA 1.448 -0.57 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.3 -38.7 91.02 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.988 -1.005 . . . . 0.0 109.689 -175.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -61.79 -33.92 74.96 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.981 178.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 88.4 mt -66.12 -46.43 77.57 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.618 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 7.8 mp -65.98 -29.13 69.46 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.367 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -61.85 -41.41 97.79 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.334 0.587 . . . . 0.0 109.866 175.166 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -70.65 -39.73 73.46 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.32 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 50.3 m -63.88 -46.18 86.05 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.487 177.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.586 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 41.7 tt0 -61.73 -50.75 71.18 Favored 'General case' 0 C--O 1.204 -1.326 0 O-C-N 123.469 0.481 . . . . 0.0 109.825 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.15 -38.15 73.12 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 123.48 0.488 . . . . 0.0 111.243 -179.156 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 144' ' ' GLN . . . . . 0.499 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 14.6 tt0 -66.47 -48.81 68.72 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -65.34 -33.61 76.39 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.483 -176.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 146' ' ' LYS . . . . . 0.586 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 88.1 mttt -59.33 -51.33 70.38 Favored 'General case' 0 C--N 1.345 0.409 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 176.82 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -69.7 -34.41 73.88 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.375 -0.83 . . . . 0.0 112.052 -177.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 148' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 57.6 mm-40 -74.08 -18.63 60.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.644 177.643 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 23.4 mtpp 59.28 48.17 10.55 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 125.234 1.414 . . . . 0.0 110.437 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 99.4 mt -84.45 119.99 25.78 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.233 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 53.9 -93.43 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.229 0 O-C-N 124.781 1.3 . . . . 0.0 112.6 176.3 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 152' ' ' ILE . . . . . 0.509 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 29.5 mt -60.34 -43.8 94.5 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.654 0 C-N-CA 122.121 0.168 . . . . 0.0 111.331 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -71.48 -4.03 24.36 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.987 0.899 . . . . 0.0 112.774 -172.189 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 27.9 t -80.35 -5.23 56.05 Favored 'General case' 0 C--N 1.291 -1.942 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.45 171.605 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 155' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 21.4 pt-20 -69.93 -25.08 63.49 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 121.543 0.687 . . . . 0.0 109.704 175.36 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.5 t70 . . . . . 0 C--N 1.309 -1.166 0 CA-C-N 114.843 -1.072 . . . . 0.0 109.654 -178.175 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 45.3 m80 . . . . . 0 CA--C 1.516 -0.351 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.7 ttmt -105.14 127.1 52.75 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 172.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -114.0 149.35 41.76 Favored Pre-proline 0 C--N 1.296 -1.749 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 173.027 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -80.16 141.1 14.41 Favored 'Trans proline' 0 C--N 1.311 -1.408 0 C-N-CA 121.928 1.752 . . . . 0.0 110.399 174.17 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.447 ' HB1' ' HB3' ' A' ' 25' ' ' LEU . . . -136.19 155.98 49.35 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 121.103 0.477 . . . . 0.0 112.156 -178.696 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.415 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 72.7 m -111.86 140.76 46.25 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 176.639 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.446 ' HB2' ' CD1' ' A' ' 72' ' ' ILE . 52.3 tp -83.14 125.48 31.56 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 118.312 0.505 . . . . 0.0 110.424 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 44.5 mm -89.18 -53.18 9.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 174.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -164.36 145.83 8.44 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -105.99 119.44 39.19 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 49.5 mm -90.56 -55.77 5.88 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -177.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.497 ' HB2' ' H ' ' A' ' 22' ' ' THR . 32.4 m-20 -125.83 -166.56 1.58 Allowed 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -85.2 -13.61 70.88 Favored Glycine 0 C--O 1.21 -1.397 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 173.038 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.579 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 0.4 OUTLIER -101.29 -54.03 2.87 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 122.485 1.136 . . . . 0.0 108.099 -178.864 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.497 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 6.8 m -82.49 105.81 13.85 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 114.268 -1.333 . . . . 0.0 111.334 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.3 m -129.27 137.27 57.46 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.609 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 177.62 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.505 ' HA ' ' HA ' ' A' ' 33' ' ' THR . 46.6 tttp -101.19 119.1 38.24 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.61 -0.682 . . . . 0.0 110.144 -176.851 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.447 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 3.3 mm? -116.25 146.73 42.13 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 121.453 0.644 . . . . 0.0 110.765 -177.464 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.484 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 26.5 ttt -107.01 108.59 20.17 Favored 'General case' 0 C--N 1.286 -2.17 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 175.019 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 10.8 p90 -115.55 116.88 28.91 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 -177.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 99.3 mttt 57.51 32.59 22.04 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 124.131 0.895 . . . . 0.0 110.921 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.96 3.76 61.87 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 114.738 -1.119 . . . . 0.0 114.142 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.484 ' O ' ' HA ' ' A' ' 26' ' ' MET . 69.8 mt-30 -107.53 103.86 50.53 Favored Pre-proline 0 C--N 1.311 -1.08 0 O-C-N 122.401 -0.47 . . . . 0.0 111.224 -179.544 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -80.85 95.26 0.97 Allowed 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 122.757 2.304 . . . . 0.0 111.268 177.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 26.5 mmt -119.78 145.49 46.53 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.745 -176.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.505 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 11.4 m -86.52 118.76 26.15 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -109.21 162.07 14.64 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 123.551 0.74 . . . . 0.0 111.071 -176.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.579 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 20.7 mtp180 -133.23 142.6 48.65 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 169.63 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.6 mp -61.48 119.55 8.8 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -175.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.1 mt -55.36 128.08 32.52 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.767 176.294 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.0 mt 68.17 23.2 8.0 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 124.829 1.331 . . . . 0.0 112.211 174.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 90.6 t -128.75 131.53 68.42 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.155 0 O-C-N 122.101 -0.374 . . . . 0.0 110.301 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -107.33 106.87 17.51 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 105.634 -1.987 . . . . 0.0 105.634 168.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.5 m . . . . . 0 CA--C 1.567 1.612 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 175.617 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.45 ' N ' ' HD2' ' A' ' 56' ' ' PRO . . . . . . . . 0 CA--C 1.534 1.254 0 CA-C-O 119.412 -0.66 . . . . 0.0 113.322 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' ' 55' ' ' GLY . 4.7 Cg_endo -49.64 -34.31 34.3 Favored 'Trans proline' 0 CA--C 1.553 1.427 0 C-N-CA 123.44 2.76 . . . . 0.0 114.016 175.628 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -83.39 -39.4 20.7 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 121.864 -0.523 . . . . 0.0 110.921 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.95 -40.25 94.74 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.929 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.437 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 9.0 p -65.33 -43.53 90.65 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.461 179.089 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.92 -47.38 85.24 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 123.614 0.571 . . . . 0.0 109.885 177.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -57.26 -49.83 74.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.14 178.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 36.8 m -59.94 -50.83 72.2 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.827 -177.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.518 ' HE3' ' OE1' ' A' ' 67' ' ' GLU 0.339 0.1 OUTLIER -64.38 -38.23 90.3 Favored 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -179.482 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.411 ' HG3' ' HD3' ' A' ' 63' ' ' LYS . 28.9 mtpp -66.45 -40.67 89.55 Favored 'General case' 0 N--CA 1.436 -1.169 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 177.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 14.7 tpt -62.68 -45.85 90.87 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.266 -178.401 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.8 m -80.71 -31.44 12.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -176.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.518 ' OE1' ' HE3' ' A' ' 63' ' ' LYS . 45.1 mt-10 -77.66 -33.42 53.41 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.146 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -78.1 -20.81 51.46 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.461 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -64.22 147.74 51.68 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.793 179.143 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -71.12 -61.34 1.8 Allowed 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.853 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.0 mtmm -125.55 150.91 47.04 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 178.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.446 ' CD1' ' HB2' ' A' ' 14' ' ' LEU . 69.2 mt -105.58 134.26 47.6 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.231 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 175.009 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.547 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 1.5 mm-40 -111.92 133.24 54.24 Favored 'General case' 0 N--CA 1.424 -1.771 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -178.177 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 31.4 m -111.52 118.19 56.91 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 174.605 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -114.22 137.33 51.91 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.153 0.501 . . . . 0.0 109.756 -178.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -106.86 138.99 41.99 Favored 'General case' 0 C--N 1.282 -2.338 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.176 -178.605 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -86.51 -174.27 4.92 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -76.31 -2.5 31.9 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -176.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.59 -119.25 1.15 Allowed Glycine 0 N--CA 1.442 -0.927 0 C-N-CA 121.576 -0.345 . . . . 0.0 112.857 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 70.6 mm-40 -99.75 164.04 12.21 Favored 'General case' 0 C--N 1.293 -1.869 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -175.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -108.89 -37.96 5.72 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.6 p . . . . . 0 C--N 1.312 -1.051 0 CA-C-N 115.363 -0.835 . . . . 0.0 108.827 179.604 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.416 ' HD3' ' O ' ' A' ' 33' ' ' THR . 3.3 tpp180 . . . . . 0 N--CA 1.415 -2.176 0 N-CA-C 106.759 -1.571 . . . . 0.0 106.759 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -78.66 151.58 36.11 Favored Glycine 0 N--CA 1.428 -1.867 0 N-CA-C 111.209 -0.757 . . . . 0.0 111.209 -179.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 85.6 mt -119.94 105.04 10.68 Favored 'General case' 0 C--N 1.288 -2.093 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -138.76 152.48 47.98 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-O 121.279 0.561 . . . . 0.0 111.689 -176.021 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -95.21 123.57 38.79 Favored 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 105.078 -2.193 . . . . 0.0 105.078 175.289 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 47.4 mm -99.27 129.06 50.29 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-O 121.452 0.644 . . . . 0.0 112.131 -171.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.547 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 26.1 m-85 -114.83 142.94 45.87 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 172.292 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.461 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -105.38 98.85 8.49 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 175.411 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.4 t70 45.71 40.04 5.79 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.179 1.392 . . . . 0.0 110.544 -173.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.69 -22.07 31.02 Favored Glycine 0 N--CA 1.444 -0.811 0 CA-C-N 115.182 -0.917 . . . . 0.0 114.509 178.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -80.83 132.98 35.52 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 117.975 0.888 . . . . 0.0 110.772 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 51.9 mtm -77.78 100.86 6.45 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -175.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 57.9 t -66.83 -48.02 81.02 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.618 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -56.63 -44.75 81.54 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.659 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -68.2 -42.53 79.74 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.3 -179.045 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.74 -45.13 86.26 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.066 0.546 . . . . 0.0 111.407 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 89.3 mt -57.82 -50.25 73.91 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.95 0.405 . . . . 0.0 111.297 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.6 t -69.89 -36.55 69.77 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.778 -178.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 14.3 tpp85 -62.69 -37.93 88.4 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.96 0.904 . . . . 0.0 111.18 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -91.07 3.9 53.54 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.976 -177.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.1 36.21 92.69 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 121.278 -0.487 . . . . 0.0 112.16 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 97.8 mt -102.28 -11.36 18.77 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 120.896 0.379 . . . . 0.0 110.031 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -153.19 161.13 42.77 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -107.15 152.4 24.11 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 177.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.3 p -82.88 130.17 36.19 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.439 0 CA-C-O 121.106 0.479 . . . . 0.0 109.932 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.298 -1.633 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.082 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 72.9 m80 . . . . . 0 N--CA 1.47 0.562 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.422 ' O ' ' HG2' ' B' ' 139' ' ' ARG . 13.0 tm-20 -67.27 -47.48 70.54 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.411 -172.737 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 2.9 tm0? -72.51 -33.6 67.03 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -176.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 72.4 mt -57.6 -49.68 75.61 Favored 'General case' 0 C--O 1.254 1.338 0 CA-C-O 121.824 0.821 . . . . 0.0 109.256 177.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 11.2 mp -69.14 -28.89 66.85 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.591 177.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 139' ' ' ARG . . . . . 0.422 ' HG2' ' O ' ' B' ' 135' ' ' GLU . 31.2 mmt180 -60.8 -42.76 98.27 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.443 0.535 . . . . 0.0 112.443 176.287 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -64.08 -35.29 80.28 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.639 0.733 . . . . 0.0 110.028 178.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.3 m -70.12 -43.17 71.54 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.149 178.05 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.605 ' O ' ' HG2' ' B' ' 146' ' ' LYS . 34.5 tt0 -60.47 -45.29 94.26 Favored 'General case' 0 C--O 1.22 -0.467 0 O-C-N 123.862 0.726 . . . . 0.0 109.677 177.675 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.75 -46.26 77.89 Favored 'General case' 0 CA--C 1.514 -0.419 0 O-C-N 124.007 0.817 . . . . 0.0 111.41 -177.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -70.51 -41.7 72.28 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.454 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -62.87 -39.98 96.12 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.709 -179.184 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 146' ' ' LYS . . . . . 0.605 ' HG2' ' O ' ' B' ' 142' ' ' GLU . 18.4 ptpt -73.28 -35.69 66.2 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 176.509 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -59.77 -47.58 85.12 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 122.023 0.916 . . . . 0.0 109.599 176.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -89.33 -3.2 58.57 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 113.88 -1.509 . . . . 0.0 112.123 -173.478 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 149' ' ' LYS . . . . . 0.446 ' O ' ' HB2' ' B' ' 154' ' ' SER . 34.1 mmtp 54.24 47.54 22.87 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.048 0.939 . . . . 0.0 111.113 178.132 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 90.5 mt -78.96 117.64 20.22 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.201 -176.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 48.7 -89.8 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.303 1.841 . . . . 0.0 113.646 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 41.6 mt -59.38 -49.18 84.49 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.989 0 C-N-CA 122.988 0.515 . . . . 0.0 111.764 -177.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -69.33 -10.41 57.75 Favored 'General case' 0 CA--C 1.495 -1.139 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -171.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 154' ' ' SER . . . . . 0.446 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 23.0 t -72.52 2.33 6.54 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.037 174.382 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -60.5 -32.86 71.85 Favored 'General case' 0 C--N 1.355 0.809 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 168.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.6 t70 . . . . . 0 C--O 1.24 0.566 0 C-N-CA 125.593 1.557 . . . . 0.0 111.241 178.05 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 32.8 m170 . . . . . 0 N--CA 1.429 -1.495 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -110.24 150.97 27.92 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-O 121.317 0.579 . . . . 0.0 110.481 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.435 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 11.5 pt-20 -138.86 143.97 39.58 Favored Pre-proline 0 C--N 1.277 -2.558 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.823 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 10.8 Cg_exo -73.75 138.81 26.9 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.788 2.326 . . . . 0.0 113.625 -177.16 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.416 ' O ' ' HB ' ' A' ' 72' ' ' ILE . . . -125.68 153.94 43.13 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.191 -178.838 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.419 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 42.8 m -105.34 135.5 46.59 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 177.389 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.1 tp -80.35 137.9 36.62 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 118.143 0.429 . . . . 0.0 110.711 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 72.6 mt -107.11 -49.81 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 172.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -161.67 138.01 8.11 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.289 -177.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -101.93 107.46 18.62 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 174.123 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 56.3 mt -89.5 -52.64 10.52 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-O 120.778 0.323 . . . . 0.0 111.367 -173.026 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.497 ' HA ' ' HB3' ' A' ' 59' ' ' SER . 28.1 m-20 -138.15 -176.22 4.37 Favored 'General case' 0 CA--C 1.499 -0.997 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -178.741 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -92.95 54.38 2.58 Favored Glycine 0 CA--C 1.489 -1.543 0 N-CA-C 107.348 -2.301 . . . . 0.0 107.348 178.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -177.59 -54.67 0.01 OUTLIER 'General case' 0 CA--C 1.486 -1.502 0 C-N-CA 125.271 1.428 . . . . 0.0 107.222 -171.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.673 ' HA ' ' O ' ' A' ' 34' ' ' PHE . 1.9 m -101.88 113.06 25.94 Favored 'General case' 0 N--CA 1.407 -2.597 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.465 -173.147 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 35.4 m -124.71 167.05 19.27 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.803 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 173.093 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -121.47 114.13 20.82 Favored 'General case' 0 C--N 1.27 -2.855 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 176.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.493 ' O ' ' HA ' ' A' ' 31' ' ' PRO . 2.4 pp -136.11 159.41 41.8 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -176.294 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.441 ' HA ' ' HA ' ' A' ' 31' ' ' PRO . 47.4 ttm -117.51 114.98 24.25 Favored 'General case' 0 C--N 1.295 -1.775 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.536 -176.462 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -119.14 126.71 52.25 Favored 'General case' 0 C--N 1.281 -2.392 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 176.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt 59.97 27.21 16.56 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 123.804 0.69 . . . . 0.0 110.67 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.46 9.11 82.24 Favored Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.9 -178.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -111.7 102.2 52.91 Favored Pre-proline 0 C--N 1.312 -1.043 0 O-C-N 122.57 -0.37 . . . . 0.0 110.411 178.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.493 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 4.9 Cg_exo -81.47 134.77 8.99 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.379 2.72 . . . . 0.0 111.834 178.168 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 48.1 mtt -140.83 156.09 46.21 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 178.491 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 85.4 m -85.13 118.29 24.6 Favored 'General case' 0 N--CA 1.423 -1.819 0 N-CA-C 103.047 -2.946 . . . . 0.0 103.047 170.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.673 ' O ' ' HA ' ' A' ' 22' ' ' THR . 34.0 t80 -112.22 151.78 29.18 Favored 'General case' 0 C--N 1.271 -2.83 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -162.297 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.1 mmt180 -117.76 131.57 56.58 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 127.494 2.317 . . . . 0.0 106.186 172.362 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.621 ' HB2' HG21 ' A' ' 39' ' ' VAL . 32.6 mt -80.75 140.16 35.68 Favored 'General case' 0 C--N 1.289 -2.024 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 177.494 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.461 ' HB3' HD12 ' A' ' 38' ' ' LEU . 41.2 mt -65.68 133.45 51.12 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 178.061 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.52 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 2.9 mp 66.44 48.92 1.46 Allowed 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 125.674 1.59 . . . . 0.0 111.821 177.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.621 HG21 ' HB2' ' A' ' 36' ' ' LEU . 96.4 t -122.73 125.29 72.24 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.063 0 CA-C-O 121.035 0.445 . . . . 0.0 110.461 177.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.652 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 12.2 t70 -102.25 107.13 18.07 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.702 -1.222 . . . . 0.0 107.702 175.23 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 30.0 p . . . . . 0 C--N 1.307 -1.249 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.267 172.574 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.843 0 CA-C-O 118.754 -1.026 . . . . 0.0 114.663 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.408 ' HA ' ' OG ' ' A' ' 59' ' ' SER . 34.8 Cg_exo -64.8 -12.77 35.72 Favored 'Trans proline' 0 C--N 1.371 1.737 0 C-N-CA 123.006 2.471 . . . . 0.0 113.164 -178.438 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -89.92 -43.45 10.58 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.86 -43.62 87.89 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.753 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.497 ' HB3' ' HA ' ' A' ' 19' ' ' ASP . 35.3 p -66.56 -36.11 81.85 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.824 -179.307 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.82 -44.51 96.83 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -66.27 -46.89 75.46 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.531 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.496 ' O ' HG23 ' A' ' 66' ' ' VAL . 60.3 m -55.37 -51.68 66.01 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 123.684 0.615 . . . . 0.0 111.394 -178.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 39.4 mttp -53.69 -51.87 61.85 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 120.926 0.393 . . . . 0.0 111.432 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -64.62 -40.9 96.31 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.535 -177.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.92 -47.02 61.38 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.964 -176.077 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 62' ' ' THR . 36.3 t -66.52 -38.07 80.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 120.965 0.412 . . . . 0.0 110.669 -177.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -75.0 -22.99 58.18 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.374 -0.531 . . . . 0.0 111.571 178.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -83.11 -24.42 32.64 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 121.204 0.526 . . . . 0.0 110.199 177.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.18 151.89 30.17 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.16 179.078 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -84.49 -65.35 1.02 Allowed 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.158 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -118.15 136.5 53.57 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 -176.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.416 ' HB ' ' O ' ' A' ' 12' ' ' ALA . 69.8 mt -104.84 112.96 40.61 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.508 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 22.1 mt-10 -112.8 133.48 54.78 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -177.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.439 HG12 ' CD1' ' A' ' 92' ' ' ILE . 29.2 m -110.82 123.1 66.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 178.17 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -120.1 122.31 40.76 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -92.99 145.77 24.12 Favored 'General case' 0 N--CA 1.422 -1.868 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -87.04 -175.35 5.31 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.1 mtpm? -78.13 14.07 1.27 Allowed 'General case' 0 C--N 1.313 -0.99 0 O-C-N 121.935 -0.478 . . . . 0.0 111.915 -176.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -95.69 -130.67 6.34 Favored Glycine 0 N--CA 1.436 -1.331 0 N-CA-C 112.247 -0.341 . . . . 0.0 112.247 -179.14 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -97.23 145.79 25.73 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 -177.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.451 HH11 ' HG2' ' A' ' 81' ' ' ARG . 11.8 ttt-85 -90.15 -13.71 35.11 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 119.09 -1.044 . . . . 0.0 109.472 -178.621 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 23.2 p . . . . . 0 N--CA 1.432 -1.331 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.523 176.303 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 . . . . . 0 C--O 1.213 -0.854 0 N-CA-C 105.755 -1.943 . . . . 0.0 105.755 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -75.72 134.64 16.64 Favored Glycine 0 C--O 1.206 -1.594 0 C-N-CA 120.539 -0.839 . . . . 0.0 113.777 -173.658 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 62.7 mt -112.22 110.66 21.04 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 123.26 0.624 . . . . 0.0 111.741 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.471 ' HB3' ' HZ ' ' A' ' 34' ' ' PHE . . . -157.58 163.44 38.33 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 171.672 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.46 ' OH ' ' HB3' ' A' ' 98' ' ' MET . 35.6 t80 -95.14 141.73 28.42 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.439 ' CD1' HG12 ' A' ' 74' ' ' VAL . 49.5 mm -99.69 123.57 52.54 Favored 'Isoleucine or valine' 0 C--O 1.252 1.198 0 CA-C-O 121.206 0.526 . . . . 0.0 111.096 -179.475 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.508 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 96.2 m-85 -111.05 131.35 55.13 Favored 'General case' 0 C--N 1.29 -1.999 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 172.287 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.29 100.42 10.01 Favored 'General case' 0 C--N 1.286 -2.177 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 177.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.6 t70 47.57 57.32 6.02 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 122.474 1.131 . . . . 0.0 110.526 -177.341 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 77.27 -5.15 52.13 Favored Glycine 0 CA--C 1.53 0.989 0 CA-C-N 114.605 -1.18 . . . . 0.0 114.86 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 32.7 mtmm -104.37 124.25 48.86 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 117.625 0.712 . . . . 0.0 111.144 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' MET . . . . . 0.46 ' HB3' ' OH ' ' A' ' 91' ' ' TYR . 2.1 mpt? -63.23 112.82 2.84 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 123.907 0.883 . . . . 0.0 112.059 -176.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 91.9 t -73.2 -46.16 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.23 -177.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.457 ' O ' HG22 ' A' ' 104' ' ' VAL . 46.2 t30 -63.93 -37.23 86.65 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.121 -178.167 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -54.94 -44.13 74.0 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.157 176.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.91 -44.22 93.6 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.504 179.26 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 97.2 mt -58.03 -52.22 66.45 Favored 'General case' 0 C--O 1.244 0.779 0 CA-C-O 121.389 0.614 . . . . 0.0 111.209 178.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.475 HG11 ' CG1' ' A' ' 111' ' ' VAL . 27.2 m -70.78 -38.0 71.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.496 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -176.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.414 ' HG3' ' HB3' ' B' ' 141' ' ' SER . 82.4 mtp180 -65.0 -16.22 63.18 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 175.663 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -93.62 -5.6 48.38 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.766 174.333 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.29 25.1 69.27 Favored Glycine 0 CA--C 1.507 -0.438 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.68 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 90.4 mt -88.87 -15.97 33.13 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.744 0.307 . . . . 0.0 111.047 -178.443 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -157.26 174.3 15.66 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -178.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.652 ' HB2' ' HB3' ' A' ' 40' ' ' ASP . 18.4 mttt -119.28 170.98 8.63 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 176.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.52 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 32.8 m -108.05 107.32 22.53 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -177.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.702 0 C-N-CA 119.599 -0.84 . . . . 0.0 112.92 176.55 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 . . . . . 0 CA--C 1.539 0.522 0 N-CA-C 111.289 0.107 . . . . 0.0 111.289 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -37.76 -61.68 0.61 Allowed 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 126.731 2.012 . . . . 0.0 113.087 -178.073 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -47.58 -54.32 12.13 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.475 1.11 . . . . 0.0 113.883 -173.273 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.1 mt -60.54 -43.75 96.85 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.815 -177.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 138' ' ' LEU . . . . . 0.437 ' HB3' HG11 ' A' ' 111' ' ' VAL . 4.1 mm? -69.36 -38.03 77.88 Favored 'General case' 0 N--CA 1.432 -1.355 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.477 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -57.16 -45.6 83.48 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-O 120.859 0.361 . . . . 0.0 110.39 176.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -62.48 -43.4 98.92 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.931 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 141' ' ' SER . . . . . 0.414 ' HB3' ' HG3' ' A' ' 105' ' ' ARG . 25.2 m -65.24 -41.24 94.56 Favored 'General case' 0 N--CA 1.438 -1.03 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.539 -178.531 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.438 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 34.4 tt0 -67.06 -50.77 60.78 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.198 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.88 -34.78 70.13 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.819 0.699 . . . . 0.0 111.908 -177.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 144' ' ' GLN . . . . . 0.453 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 57.8 tt0 -61.94 -48.01 82.31 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.841 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -70.56 -32.66 70.16 Favored 'General case' 0 C--O 1.245 0.853 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.771 -178.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 146' ' ' LYS . . . . . 0.438 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 81.6 mttt -57.9 -51.21 70.56 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 123.661 0.601 . . . . 0.0 109.645 176.692 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -71.07 -22.87 62.06 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.548 -176.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 148' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 22.8 mm-40 -87.24 -4.35 59.09 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 121.073 -0.251 . . . . 0.0 111.588 178.586 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 149' ' ' LYS . . . . . 0.596 ' O ' ' HB3' ' B' ' 154' ' ' SER . 10.0 mmpt? 54.71 57.36 5.78 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.076 0.95 . . . . 0.0 108.855 -176.049 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 98.2 mt -95.49 119.3 33.74 Favored 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 120.084 -0.646 . . . . 0.0 112.539 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 50.9 -84.41 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 127.633 2.373 . . . . 0.0 114.181 175.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 152' ' ' ILE . . . . . 0.568 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 58.5 mt -68.56 -34.06 63.27 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.41 0 CA-C-O 121.764 0.792 . . . . 0.0 109.784 178.118 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 60.0 m95 -81.53 -11.1 59.3 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.767 -172.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 154' ' ' SER . . . . . 0.596 ' HB3' ' O ' ' B' ' 149' ' ' LYS . 79.6 p -91.14 0.86 57.45 Favored 'General case' 0 N--CA 1.423 -1.803 0 C-N-CA 119.73 -0.788 . . . . 0.0 112.438 -178.682 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 155' ' ' GLU . . . . . 0.568 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 5.6 pt-20 -93.82 -17.76 22.74 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 174.307 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 13.7 t70 . . . . . 0 N--CA 1.431 -1.409 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.3 -170.984 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.6 m-70 . . . . . 0 N--CA 1.468 0.438 0 CA-C-O 119.882 -0.104 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 21.2 pttp -110.42 141.92 42.85 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 176.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -139.34 143.75 37.36 Favored Pre-proline 0 C--N 1.276 -2.607 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.29 177.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -62.04 147.91 94.2 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.825 2.35 . . . . 0.0 113.487 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.02 166.09 25.41 Favored 'General case' 0 C--N 1.307 -1.266 0 C-N-CA 124.499 1.12 . . . . 0.0 108.965 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.45 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 57.2 m -100.76 132.03 46.36 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 178.658 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.452 ' HA ' HD13 ' A' ' 25' ' ' LEU . 54.2 tp -79.98 126.23 30.77 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 120.995 0.426 . . . . 0.0 110.316 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.3 mm -92.07 -54.62 7.12 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.674 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 175.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -166.42 149.08 6.88 Favored 'General case' 0 N--CA 1.425 -1.702 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.809 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -82.45 128.84 34.66 Favored 'General case' 0 N--CA 1.438 -1.075 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 171.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 47.5 mm -102.79 -51.8 8.71 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.719 0 CA-C-O 121.057 0.456 . . . . 0.0 109.961 -174.291 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -133.65 -176.8 4.28 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.66 50.54 4.01 Favored Glycine 0 C--O 1.222 -0.643 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 175.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.623 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 5.6 t70 -178.61 -59.91 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 -170.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.544 ' HA ' ' O ' ' A' ' 34' ' ' PHE . 21.5 m -82.32 120.14 25.03 Favored 'General case' 0 N--CA 1.409 -2.507 0 CA-C-N 113.597 -1.638 . . . . 0.0 111.246 -176.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.6 m -126.9 144.56 36.69 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.353 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 177.054 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -98.25 119.57 37.14 Favored 'General case' 0 C--N 1.292 -1.893 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -176.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.601 HD11 HG21 ' A' ' 72' ' ' ILE . 3.1 mm? -120.42 158.27 27.54 Favored 'General case' 0 CA--C 1.5 -0.963 0 CA-C-O 121.462 0.648 . . . . 0.0 111.985 -176.699 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.45 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 27.0 ttt -124.07 105.98 9.99 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 174.732 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -113.8 116.46 29.38 Favored 'General case' 0 C--N 1.292 -1.909 0 C-N-CA 119.191 -1.004 . . . . 0.0 110.086 -178.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 94.6 mttt 57.73 38.14 27.41 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.482 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 91.77 -1.52 75.11 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-N 114.354 -1.294 . . . . 0.0 113.83 175.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -107.74 106.22 57.97 Favored Pre-proline 0 C--N 1.314 -0.963 0 CA-C-N 117.183 0.492 . . . . 0.0 110.437 -177.342 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.558 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 33.9 Cg_endo -90.89 125.22 1.02 Allowed 'Trans proline' 0 N--CA 1.448 -1.149 0 C-N-CA 123.007 2.471 . . . . 0.0 112.908 178.8 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 63.6 mtt -141.32 156.23 45.87 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.016 178.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.3 m -90.67 103.83 16.48 Favored 'General case' 0 C--N 1.294 -1.844 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 178.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.544 ' O ' ' HA ' ' A' ' 22' ' ' THR . 73.5 m-85 -95.29 125.25 39.79 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 -170.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.623 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 6.7 mmm180 -95.68 146.12 24.75 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 125.417 1.487 . . . . 0.0 108.281 175.415 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.46 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 93.3 mt -82.65 125.21 30.95 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 121.631 0.729 . . . . 0.0 111.484 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 69.3 mt -79.0 139.38 38.21 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.333 174.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.555 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 87.9 mt 73.77 10.99 4.66 Favored 'General case' 0 C--O 1.218 -0.598 0 C-N-CA 125.158 1.383 . . . . 0.0 111.919 178.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.42 ' CG2' HD22 ' A' ' 100' ' ' ASN . 66.6 t -128.85 136.32 60.08 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.242 0 CA-C-O 121.084 0.468 . . . . 0.0 110.093 -179.497 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -121.68 107.87 12.87 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.0 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.42 ' HB ' ' HB2' ' A' ' 21' ' ' ASP . 8.7 m . . . . . 0 C--N 1.31 -1.122 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.778 176.136 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.857 0 CA-C-O 119.31 -0.717 . . . . 0.0 112.833 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -46.06 -54.84 4.19 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 124.006 3.137 . . . . 0.0 113.125 177.151 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -60.3 -46.59 89.33 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.04 -44.57 96.41 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.271 0.558 . . . . 0.0 110.853 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.6 m -69.17 -44.61 71.87 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.928 -178.414 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.503 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -65.19 -41.63 94.39 Favored 'General case' 0 C--O 1.209 -1.044 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.924 -178.772 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -59.96 -43.7 94.89 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 122.588 0.355 . . . . 0.0 110.315 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.2 m -60.7 -50.99 71.25 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.624 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.76 -36.83 85.59 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.837 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.503 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 98.2 mttt -56.96 -46.83 81.89 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 174.674 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.1 mmt -65.65 -51.5 59.02 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 32.9 m -74.36 -31.61 28.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -174.086 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -81.12 -28.22 35.23 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 119.536 -0.866 . . . . 0.0 110.944 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -82.01 -25.56 34.59 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.83 177.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.402 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -58.74 145.86 38.82 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 123.209 0.604 . . . . 0.0 111.683 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -79.46 -37.29 37.26 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.401 ' HE3' ' HB2' ' A' ' 71' ' ' LYS . 44.2 mtmt -133.59 145.48 50.09 Favored 'General case' 0 CA--C 1.484 -1.563 0 CA-C-N 114.625 -1.171 . . . . 0.0 108.85 -178.651 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.601 HG21 HD11 ' A' ' 25' ' ' LEU . 4.2 mp -117.52 118.54 58.84 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.612 0 N-CA-C 105.348 -2.094 . . . . 0.0 105.348 171.426 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.606 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 31.5 mt-10 -112.84 141.36 46.74 Favored 'General case' 0 C--N 1.28 -2.453 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -173.908 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.516 HG12 ' CD1' ' A' ' 92' ' ' ILE . 30.6 m -112.71 124.57 69.5 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.277 -178.179 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 91' ' ' TYR . 35.5 tt0 -109.75 115.56 30.07 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 175.53 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -87.94 127.46 35.37 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-O 121.397 0.617 . . . . 0.0 111.639 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -95.8 166.44 11.8 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.086 -0.961 . . . . 0.0 111.798 -174.519 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -62.31 -24.05 67.09 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 125.847 1.659 . . . . 0.0 110.904 -177.444 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -55.05 -84.07 0.04 OUTLIER Glycine 0 CA--C 1.493 -1.315 0 O-C-N 123.549 0.531 . . . . 0.0 114.309 -175.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.558 ' HB2' HD12 ' A' ' 89' ' ' LEU . 98.0 mt-30 -149.86 149.61 30.72 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 178.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -84.37 -34.64 23.57 Favored 'General case' 0 C--N 1.285 -2.205 0 CA-C-O 121.599 0.714 . . . . 0.0 109.092 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.446 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 6.9 p . . . . . 0 C--N 1.305 -1.348 0 CA-C-N 114.922 -1.035 . . . . 0.0 108.809 -179.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 . . . . . 0 CA--C 1.509 -0.604 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.446 ' HA2' ' HA ' ' A' ' 82' ' ' THR . . . -88.55 161.18 30.89 Favored Glycine 0 N--CA 1.427 -1.922 0 N-CA-C 109.118 -1.593 . . . . 0.0 109.118 177.235 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.558 HD12 ' HB2' ' A' ' 80' ' ' GLN . 91.1 mt -130.24 118.37 21.26 Favored 'General case' 0 C--N 1.286 -2.174 0 CA-C-N 117.38 0.59 . . . . 0.0 110.318 -177.485 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.17 168.01 28.63 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.239 0.543 . . . . 0.0 110.716 -178.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.459 ' HB3' ' HB3' ' A' ' 75' ' ' GLU . 18.2 t80 -97.79 126.47 43.16 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 105.363 -2.088 . . . . 0.0 105.363 173.509 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.516 ' CD1' HG12 ' A' ' 74' ' ' VAL . 47.8 mm -99.84 129.97 49.66 Favored 'Isoleucine or valine' 0 C--O 1.246 0.874 0 C-N-CA 119.75 -0.78 . . . . 0.0 112.912 -176.425 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.606 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 41.1 m-85 -110.62 145.32 38.1 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.434 173.567 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.402 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -109.41 99.35 8.6 Favored 'General case' 0 C--N 1.29 -1.982 0 N-CA-C 106.417 -1.697 . . . . 0.0 106.417 173.271 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.317 3.7 p30 42.13 57.42 3.28 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 114.228 1.196 . . . . 0.0 114.228 -176.509 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.62 -18.49 52.48 Favored Glycine 0 N--CA 1.432 -1.594 0 CA-C-N 114.948 -1.024 . . . . 0.0 113.992 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -90.47 147.35 23.46 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-N 117.114 0.457 . . . . 0.0 110.069 -177.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 57.4 mtt -92.4 108.1 19.71 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-O 121.471 0.653 . . . . 0.0 111.853 -177.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 62.4 t -67.67 -42.32 86.34 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 CA-C-N 114.51 -1.223 . . . . 0.0 109.763 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.46 ' ND2' ' HB3' ' A' ' 36' ' ' LEU . 11.8 m120 -54.13 -49.08 70.01 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.828 177.09 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -54.08 -56.08 21.42 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.377 175.179 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.83 -41.08 73.71 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.283 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 89.6 mt -65.06 -46.58 80.62 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 57.8 t -73.12 -38.26 54.66 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.158 0 CA-C-O 120.588 0.232 . . . . 0.0 110.866 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.513 ' CZ ' ' HA ' ' B' ' 141' ' ' SER . 12.7 tpp180 -65.33 -34.89 79.4 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.556 0.743 . . . . 0.0 110.898 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -84.94 -3.34 58.7 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.205 177.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.543 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 70.69 38.26 67.25 Favored Glycine 0 N--CA 1.432 -1.614 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.661 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 82.8 mt -103.79 -10.9 17.91 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 121.628 0.728 . . . . 0.0 109.287 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -150.18 169.9 20.23 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 114.475 -1.238 . . . . 0.0 108.923 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.432 ' HG3' HD13 ' B' ' 152' ' ' ILE . 93.4 mttt -123.21 159.01 29.57 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 176.86 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.5 p -83.79 124.24 39.52 Favored 'Isoleucine or valine' 0 C--O 1.246 0.913 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.846 177.274 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.555 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . . . . . . 0 C--N 1.305 -1.331 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 . . . . . 0 N--CA 1.471 0.598 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -47.01 -49.68 20.6 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.865 0.866 . . . . 0.0 111.967 -178.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 136' ' ' GLN . . . . . 0.496 ' O ' ' HG3' ' B' ' 140' ' ' LYS . 9.4 pt20 -51.48 -48.77 62.74 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.738 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 85.0 mt -70.35 -44.88 67.24 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.427 -177.092 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.65 -34.06 77.4 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.422 -178.169 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 139' ' ' ARG . . . . . 0.558 ' O ' ' HD3' ' B' ' 139' ' ' ARG . 0.0 OUTLIER -76.31 -36.35 58.35 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.574 -179.905 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 140' ' ' LYS . . . . . 0.496 ' HG3' ' O ' ' B' ' 136' ' ' GLN . 29.6 mtpp -69.24 -29.69 67.67 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-O 121.066 0.46 . . . . 0.0 110.132 177.722 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 141' ' ' SER . . . . . 0.513 ' HA ' ' CZ ' ' A' ' 105' ' ' ARG . 22.6 t -61.2 -55.05 36.58 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-N 114.806 -1.088 . . . . 0.0 108.342 175.273 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.481 ' HG3' ' CH2' ' B' ' 153' ' ' TRP . 33.2 tt0 -59.48 -53.15 61.39 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.63 -1.168 . . . . 0.0 111.087 178.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.6 -42.58 75.06 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -176.062 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -71.72 -46.97 56.95 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.052 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -65.0 -31.92 73.39 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.919 -177.209 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 146' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 87.7 mttt -59.62 -47.98 83.48 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.247 0.546 . . . . 0.0 110.363 175.014 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -70.52 -31.8 69.02 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.548 -176.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -76.25 -22.1 55.54 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.6 177.015 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 149' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' B' ' 154' ' ' SER . 51.0 mtpt 56.47 65.13 1.49 Allowed 'General case' 0 N--CA 1.441 -0.902 0 C-N-CA 124.434 1.093 . . . . 0.0 110.477 -174.281 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 89.5 mt -94.96 122.02 37.18 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.239 -179.041 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 151' ' ' ASN . . . . . 0.543 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 39.6 m-80 46.4 -89.16 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 126.25 1.82 . . . . 0.0 114.191 179.279 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 152' ' ' ILE . . . . . 0.432 HD13 ' HG3' ' A' ' 110' ' ' LYS . 13.3 tt -70.29 -30.94 45.28 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.751 0 CA-C-O 121.3 0.571 . . . . 0.0 110.027 -177.269 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 153' ' ' TRP . . . . . 0.481 ' CH2' ' HG3' ' B' ' 142' ' ' GLU . 65.9 m95 -78.26 -7.22 56.92 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 121.683 0.754 . . . . 0.0 110.172 -178.401 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 154' ' ' SER . . . . . 0.423 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 8.2 t -102.85 19.4 19.4 Favored 'General case' 0 N--CA 1.408 -2.542 0 CA-C-N 115.394 -0.821 . . . . 0.0 108.905 179.083 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -71.34 -16.38 62.43 Favored 'General case' 0 C--N 1.351 0.673 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 174.34 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 15.7 t70 . . . . . 0 N--CA 1.436 -1.139 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.362 176.169 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 54.6 m80 . . . . . 0 CA--C 1.503 -0.847 0 CA-C-O 121.181 0.515 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 74' ' ' VAL . 27.7 ttpp -115.32 131.38 56.95 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.012 179.267 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.59 163.83 46.94 Favored Pre-proline 0 C--N 1.296 -1.749 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -79.72 150.36 21.36 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.192 1.928 . . . . 0.0 112.185 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.25 156.84 46.79 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.109 177.67 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.468 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 18.0 m -101.32 138.41 38.38 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 177.507 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 61.7 tp -76.11 126.52 31.15 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 -179.246 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 48.2 mm -98.41 -55.11 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 175.215 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 58.5 pttt -175.12 148.09 0.97 Allowed 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 122.432 0.293 . . . . 0.0 111.198 178.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -104.32 115.64 30.75 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 174.074 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.6 mp -86.91 -47.31 16.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.195 0 CA-C-O 121.416 0.627 . . . . 0.0 109.744 -175.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -138.95 175.71 9.32 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.279 -176.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.03 52.96 4.45 Favored Glycine 0 C--N 1.316 -0.581 0 N-CA-C 108.572 -1.811 . . . . 0.0 108.572 172.439 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.478 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 7.7 t70 -172.53 -58.97 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 -172.406 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 23.8 m -98.41 117.46 32.88 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 114.438 -1.255 . . . . 0.0 110.89 -176.697 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.4 m -133.45 156.43 41.66 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.427 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -121.24 125.08 46.21 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.467 -0.77 . . . . 0.0 109.965 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.0 mp -131.16 159.11 38.63 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.093 0.473 . . . . 0.0 110.436 -178.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.468 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 49.0 ttm -116.09 115.92 26.94 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.105 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -121.92 132.45 54.56 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 59.3 mttp 60.83 26.34 16.19 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.958 0.903 . . . . 0.0 110.586 -176.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 82.62 3.41 90.52 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 121.148 -0.548 . . . . 0.0 112.047 -177.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -105.24 113.03 64.94 Favored Pre-proline 0 C--N 1.315 -0.918 0 O-C-N 122.541 -0.388 . . . . 0.0 110.914 -178.398 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -85.93 120.22 1.94 Allowed 'Trans proline' 0 N--CA 1.443 -1.472 0 C-N-CA 122.389 2.059 . . . . 0.0 112.047 177.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 49.7 mtt -132.35 156.09 47.25 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.021 176.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.4 m -88.48 115.97 26.38 Favored 'General case' 0 N--CA 1.418 -2.043 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.829 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -102.14 166.88 10.36 Favored 'General case' 0 N--CA 1.414 -2.225 0 CA-C-O 122.127 0.965 . . . . 0.0 111.157 -177.071 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.478 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 18.4 ttp180 -139.2 136.63 35.23 Favored 'General case' 0 N--CA 1.405 -2.714 0 N-CA-C 107.124 -1.435 . . . . 0.0 107.124 172.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.0 mp -69.8 119.08 13.49 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 123.997 0.811 . . . . 0.0 110.23 -176.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.0 mt -57.66 131.47 50.36 Favored 'General case' 0 CA--C 1.499 -0.991 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.145 177.643 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.467 ' HB2' HD22 ' B' ' 138' ' ' LEU . 87.5 mt 73.19 19.92 3.46 Favored 'General case' 0 C--O 1.217 -0.648 0 O-C-N 125.205 1.565 . . . . 0.0 112.696 175.839 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.7 t -111.15 125.9 68.51 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 177.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -125.47 110.13 13.54 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.9 p . . . . . 0 C--N 1.306 -1.297 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 169.491 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.241 0 CA-C-O 119.772 -0.46 . . . . 0.0 112.612 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.453 ' HA ' ' OG ' ' A' ' 59' ' ' SER . 20.2 Cg_exo -69.79 -12.45 32.85 Favored 'Trans proline' 0 C--N 1.369 1.651 0 C-N-CA 122.454 2.103 . . . . 0.0 111.755 176.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -78.48 -48.71 14.79 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 177.655 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.41 -37.68 80.55 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.862 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.453 ' OG ' ' HA ' ' A' ' 56' ' ' PRO . 26.1 p -68.17 -36.98 80.47 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.16 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -67.8 -43.63 79.23 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 176.099 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.29 -48.41 81.73 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.659 -179.439 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.453 HG23 HD21 ' A' ' 103' ' ' LEU . 12.2 p -62.94 -48.85 77.12 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.907 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -56.77 -46.92 81.16 Favored 'General case' 0 CA--C 1.509 -0.621 0 O-C-N 123.349 0.406 . . . . 0.0 111.8 179.289 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -56.76 -46.17 81.59 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.423 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 49.1 ttm -68.46 -46.47 69.69 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 123.366 0.416 . . . . 0.0 111.881 -177.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.8 m -70.33 -36.65 67.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -177.39 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -71.95 -34.88 69.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.733 0.302 . . . . 0.0 110.834 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -71.95 -37.77 69.91 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.152 0.501 . . . . 0.0 110.79 -178.409 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.68 153.73 40.87 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.304 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -86.22 -18.22 32.72 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-O 121.125 0.488 . . . . 0.0 110.766 179.039 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -130.46 125.74 35.16 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.382 -175.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 64.0 mt -106.86 112.74 41.13 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.84 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 170.04 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.6 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 26.8 mt-10 -115.42 137.23 52.27 Favored 'General case' 0 C--N 1.285 -2.229 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.365 -172.86 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.466 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 18.9 m -110.89 121.23 63.22 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 175.199 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.482 ' HB3' ' HB2' ' A' ' 91' ' ' TYR . 40.6 tt0 -110.76 121.09 44.47 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -95.84 147.0 24.11 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 178.161 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.529 ' OD1' ' HG2' ' A' ' 78' ' ' LYS . 10.8 t70 -85.0 -179.36 7.04 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 -177.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.529 ' HG2' ' OD1' ' A' ' 77' ' ' ASP . 21.2 pttp -73.05 -16.15 61.49 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 123.115 0.566 . . . . 0.0 112.084 -172.822 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -89.99 -107.15 1.25 Allowed Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.865 -179.373 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -110.9 165.06 12.16 Favored 'General case' 0 C--N 1.309 -1.193 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.826 -173.59 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 63.2 mtp180 -109.57 -21.4 12.47 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.83 -174.47 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 22.9 p . . . . . 0 C--N 1.3 -1.574 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.763 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.428 ' HG2' ' HB2' ' A' ' 35' ' ' ARG . 10.4 tpp85 . . . . . 0 N--CA 1.414 -2.268 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -95.63 133.49 11.51 Favored Glycine 0 N--CA 1.432 -1.591 0 N-CA-C 108.595 -1.802 . . . . 0.0 108.595 173.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.2 pp -112.84 125.66 54.59 Favored 'General case' 0 N--CA 1.411 -2.415 0 CA-C-N 118.138 0.969 . . . . 0.0 112.91 -177.471 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -152.63 162.29 41.43 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.313 -179.171 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.482 ' HB2' ' HB3' ' A' ' 75' ' ' GLU . 83.6 m-85 -87.49 128.6 35.23 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 105.58 -2.007 . . . . 0.0 105.58 174.057 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 48.4 mm -99.32 123.9 52.29 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.663 0 C-N-CA 120.029 -0.668 . . . . 0.0 109.241 -177.082 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.6 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 6.1 m-85 -116.84 143.56 45.54 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.536 178.522 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -121.55 100.24 6.91 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 175.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.1 t70 46.77 58.72 4.45 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 124.802 1.241 . . . . 0.0 111.323 -175.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.96 -22.5 11.73 Favored Glycine 0 N--CA 1.444 -0.829 0 CA-C-N 114.818 -1.083 . . . . 0.0 114.475 179.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -80.32 129.55 34.58 Favored 'General case' 0 CA--C 1.501 -0.92 0 CA-C-N 117.475 0.638 . . . . 0.0 111.309 -178.449 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -75.68 105.84 6.93 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.214 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 52.2 t -73.19 -39.18 56.1 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.09 0 CA-C-O 121.452 0.644 . . . . 0.0 109.554 -178.253 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -64.61 -44.41 90.68 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.689 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -66.42 -33.78 76.48 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.995 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.42 -37.81 84.82 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.09 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.453 HD21 HG23 ' A' ' 62' ' ' THR . 84.9 mt -63.13 -44.45 95.57 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.042 177.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 44.0 t -69.7 -37.78 74.71 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.156 0 CA-C-O 121.549 0.69 . . . . 0.0 109.591 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -61.72 -44.85 96.12 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 124.953 1.301 . . . . 0.0 111.693 179.344 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -83.59 2.12 38.83 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.27 -177.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.463 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 66.04 35.87 91.2 Favored Glycine 0 N--CA 1.43 -1.759 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 -179.042 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.6 mt -96.69 -18.61 19.56 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -151.19 164.85 35.6 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 115.232 -0.895 . . . . 0.0 108.816 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.415 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 94.5 mttt -104.39 168.79 8.87 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 176.409 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.443 HG12 ' OE2' ' B' ' 142' ' ' GLU . 7.4 p -79.12 132.54 31.9 Favored 'Isoleucine or valine' 0 C--O 1.251 1.173 0 C-N-CA 118.205 -1.398 . . . . 0.0 107.937 175.289 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.466 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.546 -178.409 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 14.0 p80 . . . . . 0 C--O 1.266 1.925 0 CA-C-O 121.76 0.791 . . . . 0.0 112.005 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.466 ' OE1' ' HG2' ' B' ' 136' ' ' GLN . 0.2 OUTLIER -65.44 -33.52 76.13 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.855 179.334 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 136' ' ' GLN . . . . . 0.566 ' O ' ' HG2' ' B' ' 140' ' ' LYS . 15.2 mm100 -57.8 -34.17 69.35 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.799 177.89 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 64.1 mt -66.24 -42.68 88.28 Favored 'General case' 0 C--O 1.242 0.689 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 138' ' ' LEU . . . . . 0.467 HD22 ' HB2' ' A' ' 38' ' ' LEU . 6.8 mp -69.54 -30.94 68.88 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 120.352 -0.539 . . . . 0.0 111.75 175.801 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -69.85 -28.19 65.47 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 176.037 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 140' ' ' LYS . . . . . 0.566 ' HG2' ' O ' ' B' ' 136' ' ' GLN . 3.9 mmmp? -61.63 -42.34 98.76 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 174.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 2.6 p -71.89 -41.17 68.28 Favored 'General case' 0 N--CA 1.426 -1.641 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.904 176.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.578 ' HG3' ' CZ2' ' B' ' 153' ' ' TRP . 39.4 tt0 -61.39 -58.02 9.91 Favored 'General case' 0 C--O 1.211 -0.931 0 O-C-N 123.244 0.34 . . . . 0.0 111.839 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 143' ' ' ALA . . . . . 0.423 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -56.34 -39.21 72.47 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 123.477 0.485 . . . . 0.0 111.435 -176.239 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 144' ' ' GLN . . . . . 0.415 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 52.0 tt0 -70.21 -45.25 66.96 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.179 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -69.48 -28.18 65.85 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.492 -178.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 146' ' ' LYS . . . . . 0.508 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 92.8 mttt -58.9 -44.31 91.18 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 174.338 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 147' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 74.7 mmtt -71.8 -35.27 69.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.898 -178.698 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 148' ' ' GLU . . . . . 0.445 ' HB2' ' HG ' ' B' ' 150' ' ' LEU . 20.4 mm-40 -66.61 -29.84 69.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.822 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 149' ' ' LYS . . . . . 0.438 ' O ' ' HB2' ' B' ' 154' ' ' SER . 46.5 mtpt 59.75 57.42 3.18 Favored 'General case' 0 CA--C 1.505 -0.757 0 C-N-CA 124.737 1.215 . . . . 0.0 109.03 -174.442 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 150' ' ' LEU . . . . . 0.445 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 87.9 mt -87.85 117.67 26.86 Favored 'General case' 0 CA--C 1.489 -1.392 0 CA-C-N 114.291 -1.322 . . . . 0.0 110.659 -178.593 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 151' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 88.3 m-20 52.52 -89.46 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.903 0 O-C-N 124.673 1.233 . . . . 0.0 114.127 172.744 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 13.0 tt -72.98 -25.8 22.38 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.222 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -178.862 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 153' ' ' TRP . . . . . 0.578 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 55.2 m95 -79.39 -7.94 58.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.892 0.853 . . . . 0.0 109.459 178.782 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 154' ' ' SER . . . . . 0.438 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 35.2 t -103.79 26.73 8.25 Favored 'General case' 0 N--CA 1.419 -1.988 0 CA-C-N 114.457 -1.247 . . . . 0.0 108.426 174.535 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -62.23 -34.11 75.87 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 174.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 5.6 t70 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 127.71 2.404 . . . . 0.0 114.17 170.756 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 . . . . . 0 N--CA 1.426 -1.642 0 CA-C-O 121.187 0.518 . . . . 0.0 109.871 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.415 ' HB3' ' HB2' ' A' ' 75' ' ' GLU . 21.3 pttp -111.48 153.58 25.96 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 115.26 -0.882 . . . . 0.0 108.869 177.634 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -138.68 162.18 54.4 Favored Pre-proline 0 C--N 1.278 -2.51 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 176.709 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.568 ' HA ' ' O ' ' A' ' 72' ' ' ILE . 19.5 Cg_exo -74.51 155.77 45.32 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 122.294 1.996 . . . . 0.0 111.629 178.028 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -138.83 166.64 23.91 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.477 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 30.6 m -104.32 139.79 38.81 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 177.81 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.4 tp -88.69 133.52 34.19 Favored 'General case' 0 C--N 1.306 -1.301 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.234 -177.798 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 66.6 mt -92.55 -59.22 3.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.549 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 175.094 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -174.49 161.6 3.34 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.949 -1.023 . . . . 0.0 108.562 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.466 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -97.75 151.23 20.38 Favored 'General case' 0 C--N 1.29 -2.004 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 174.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.0 mm -112.89 -56.56 4.21 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -135.3 -160.59 1.07 Allowed 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 -176.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -76.45 -38.04 34.27 Favored Glycine 0 C--N 1.303 -1.298 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.134 -179.366 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.509 ' OD2' HG22 ' A' ' 41' ' ' THR . 4.0 p30 -106.42 -12.33 15.68 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 120.788 0.327 . . . . 0.0 111.603 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.43 111.87 24.63 Favored 'General case' 0 N--CA 1.425 -1.676 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.521 -174.674 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.9 m -136.91 147.43 27.18 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 C-N-CA 122.66 0.384 . . . . 0.0 110.48 -177.316 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -103.14 118.39 36.68 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 121.426 0.631 . . . . 0.0 111.188 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.9 mp -127.44 156.29 42.32 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.949 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.477 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 26.2 ttt -118.01 98.92 6.57 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 178.447 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.406 ' CD1' ' HZ ' ' A' ' 34' ' ' PHE . 7.6 p90 -98.67 111.76 24.03 Favored 'General case' 0 C--N 1.308 -1.204 0 C-N-CA 119.896 -0.722 . . . . 0.0 111.159 -174.518 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 37.4 mtpt 57.96 37.75 26.78 Favored 'General case' 0 C--O 1.245 0.862 0 CA-C-N 114.106 -1.406 . . . . 0.0 109.871 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 90.83 6.63 67.18 Favored Glycine 0 N--CA 1.436 -1.36 0 CA-C-N 114.001 -1.454 . . . . 0.0 113.703 177.192 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -112.59 106.17 55.7 Favored Pre-proline 0 C--N 1.311 -1.077 0 O-C-N 122.112 -0.64 . . . . 0.0 110.772 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -77.38 124.86 7.35 Favored 'Trans proline' 0 CA--C 1.534 0.504 0 C-N-CA 123.243 2.629 . . . . 0.0 112.648 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 53.7 mtt -145.57 156.54 43.75 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 122.948 0.499 . . . . 0.0 110.734 176.529 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.6 m -89.53 117.5 28.48 Favored 'General case' 0 N--CA 1.422 -1.866 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 172.307 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.406 ' HZ ' ' CD1' ' A' ' 27' ' ' TYR . 39.2 m-85 -95.96 145.64 25.26 Favored 'General case' 0 C--N 1.281 -2.379 0 CA-C-O 121.645 0.736 . . . . 0.0 112.488 -175.722 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.451 HH11 ' HD2' ' A' ' 35' ' ' ARG . 3.1 tpp85 -115.13 125.11 53.08 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 170.206 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.449 ' HA ' ' O ' ' A' ' 90' ' ' ALA . 71.3 mt -71.98 119.2 15.83 Favored 'General case' 0 C--N 1.288 -2.078 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.192 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.489 HD21 ' HB3' ' A' ' 89' ' ' LEU . 74.1 mt -60.42 139.57 57.63 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.756 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.522 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 88.2 mt 74.0 -0.38 3.37 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.924 1.29 . . . . 0.0 112.684 -178.705 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.5 t -115.21 133.8 60.32 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -179.009 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.448 ' HB2' ' HB2' ' A' ' 112' ' ' ALA . 16.4 t70 -142.28 108.39 5.22 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 175.385 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.509 HG22 ' OD2' ' A' ' 21' ' ' ASP . 14.1 t . . . . . 0 CA--C 1.6 2.868 0 N-CA-C 115.009 1.485 . . . . 0.0 115.009 -178.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.732 0 CA-C-O 119.63 -0.539 . . . . 0.0 112.566 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -52.26 -36.57 68.24 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.805 2.336 . . . . 0.0 112.506 176.492 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -61.48 -50.54 72.32 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.84 -50.96 66.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.71 -177.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.5 m -59.89 -38.79 83.23 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 120.919 0.39 . . . . 0.0 111.463 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.42 -36.18 76.45 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.113 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -61.92 -50.03 73.81 Favored 'General case' 0 C--O 1.241 0.605 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.46 ' O ' HG22 ' A' ' 66' ' ' VAL . 27.9 m -57.49 -49.72 75.37 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 123.972 0.795 . . . . 0.0 110.03 177.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.466 ' HG2' ' HB3' ' A' ' 17' ' ' ALA . 25.1 mtpp -54.98 -52.99 61.37 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 178.659 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -59.23 -40.18 85.08 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 120.676 0.274 . . . . 0.0 111.601 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.6 mmt -72.45 -50.96 22.4 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 62' ' ' THR . 22.2 m -77.08 -28.89 16.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -174.289 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -77.86 -35.51 50.92 Favored 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 119.848 -0.741 . . . . 0.0 111.28 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -79.26 -14.7 58.87 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 121.267 0.556 . . . . 0.0 110.737 177.464 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.59 133.82 56.45 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.112 -178.028 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -80.25 -62.93 1.53 Allowed 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 176.049 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -106.42 118.86 37.76 Favored 'General case' 0 N--CA 1.425 -1.724 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.568 ' O ' ' HA ' ' A' ' 11' ' ' PRO . 64.9 mt -99.62 118.72 46.64 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.497 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 178.371 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.503 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 3.5 mm-40 -111.24 133.64 53.43 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -175.55 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.6 m -110.92 118.5 57.45 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.725 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 174.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.415 ' HB2' ' HB3' ' A' ' 9' ' ' LYS . 34.2 tt0 -107.76 121.24 44.31 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 120.638 0.256 . . . . 0.0 110.408 -177.203 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -98.59 129.7 45.12 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 -177.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.474 ' OD2' HD13 ' A' ' 37' ' ' LEU . 2.2 p30 -94.8 -173.86 3.11 Favored 'General case' 0 N--CA 1.426 -1.631 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -176.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -75.76 -8.02 55.84 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.573 0.749 . . . . 0.0 112.288 -174.646 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -79.88 -70.88 1.3 Allowed Glycine 0 N--CA 1.428 -1.885 0 N-CA-C 111.696 -0.562 . . . . 0.0 111.696 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -145.61 150.57 36.6 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 -176.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -102.36 -39.07 7.34 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 122.033 0.921 . . . . 0.0 109.048 176.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 15.2 p . . . . . 0 N--CA 1.429 -1.478 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.407 -178.075 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 48.4 ttp180 . . . . . 0 N--CA 1.45 -0.461 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -82.17 143.66 23.12 Favored Glycine 0 C--N 1.305 -1.191 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.489 ' HB3' HD21 ' A' ' 37' ' ' LEU . 91.5 mt -127.36 108.46 10.86 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -179.127 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.449 ' O ' ' HA ' ' A' ' 36' ' ' LEU . . . -156.63 166.19 34.11 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.851 -177.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -91.61 142.38 27.69 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 170.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 14.0 tt -113.3 135.7 51.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.453 0 C-N-CA 118.316 -1.354 . . . . 0.0 111.559 -178.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.503 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 8.5 m-85 -116.46 139.03 50.9 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.675 176.735 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -109.0 100.17 9.4 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.056 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.7 t70 46.35 57.88 5.0 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 124.725 1.21 . . . . 0.0 111.431 -177.41 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.63 -23.55 12.68 Favored Glycine 0 CA--C 1.52 0.393 0 CA-C-N 114.846 -1.07 . . . . 0.0 114.02 177.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.2 mtmm -90.57 119.39 30.78 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -177.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' MET . . . . . 0.45 ' HA ' ' HA ' ' A' ' 93' ' ' TYR . 41.7 ttp -83.98 103.68 13.43 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 121.951 0.881 . . . . 0.0 112.991 -175.108 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 43.7 t -67.02 -29.18 45.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.653 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.443 HD22 ' HB3' ' A' ' 36' ' ' LEU . 24.1 t-20 -53.54 -52.17 60.54 Favored 'General case' 0 C--O 1.258 1.517 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.106 -178.645 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.664 ' O ' ' HG2' ' A' ' 105' ' ' ARG . 6.9 pt-20 -77.31 -30.29 54.06 Favored 'General case' 0 N--CA 1.412 -2.365 0 C-N-CA 118.216 -1.394 . . . . 0.0 110.123 -179.344 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -56.83 -38.98 73.4 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 122.779 0.432 . . . . 0.0 110.904 -179.449 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 99.1 mt -60.84 -46.7 89.52 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.172 175.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.404 HG21 HD23 ' B' ' 138' ' ' LEU . 66.1 t -70.15 -37.35 71.51 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.186 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.492 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.664 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 33.9 mmm-85 -58.22 -41.62 84.46 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.23 0.612 . . . . 0.0 110.481 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -83.49 -4.68 58.74 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.719 -177.644 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.88 33.89 80.96 Favored Glycine 0 N--CA 1.439 -1.152 0 C-N-CA 120.156 -1.021 . . . . 0.0 111.092 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.3 mt -91.05 -6.24 54.11 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 122.16 0.981 . . . . 0.0 108.667 178.162 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -152.13 165.69 34.0 Favored 'General case' 0 N--CA 1.405 -2.701 0 CA-C-N 114.295 -1.321 . . . . 0.0 107.775 -179.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -103.82 152.09 22.31 Favored 'General case' 0 N--CA 1.409 -2.5 0 N-CA-C 105.136 -2.172 . . . . 0.0 105.136 176.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.7 p -77.28 128.99 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 118.384 -1.326 . . . . 0.0 109.601 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.522 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . . . . . . 0 C--N 1.293 -1.882 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 173.646 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 . . . . . 0 CA--C 1.497 -1.091 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -62.37 -45.43 93.21 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 114.23 -1.35 . . . . 0.0 113.005 -168.294 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -60.05 -42.94 95.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.033 0.444 . . . . 0.0 110.082 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.85 -50.17 73.32 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.623 -177.798 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 138' ' ' LEU . . . . . 0.404 HD23 HG21 ' A' ' 104' ' ' VAL . 9.1 mp -68.86 -38.49 79.76 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 -179.042 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -61.77 -41.73 98.08 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.977 0.417 . . . . 0.0 109.948 176.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 140' ' ' LYS . . . . . 0.482 ' HA ' ' HE3' ' B' ' 140' ' ' LYS . 1.4 tpmt? -71.2 -37.77 72.09 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.704 -179.137 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.4 m -65.78 -37.17 85.6 Favored 'General case' 0 C--O 1.244 0.811 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.488 178.238 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.658 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 29.8 tt0 -65.52 -41.86 92.65 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.445 175.558 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -54.24 -46.01 72.47 Favored 'General case' 0 CA--C 1.518 -0.281 0 O-C-N 123.555 0.534 . . . . 0.0 110.399 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 144' ' ' GLN . . . . . 0.475 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 2.6 mp0 -64.78 -46.19 83.14 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.172 175.236 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -58.31 -36.22 73.02 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 123.038 0.535 . . . . 0.0 112.369 -179.222 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 146' ' ' LYS . . . . . 0.658 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 50.8 mttm -59.76 -47.67 84.73 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 176.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -65.32 -41.91 93.5 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.636 -178.103 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 148' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 20.8 mm-40 -71.89 -18.27 62.05 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.914 -178.505 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 149' ' ' LYS . . . . . 0.581 ' O ' ' HB2' ' B' ' 154' ' ' SER . 29.6 mtpp 56.77 65.57 1.37 Allowed 'General case' 0 N--CA 1.437 -1.079 0 C-N-CA 124.098 0.959 . . . . 0.0 110.698 -176.313 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 94.4 mt -99.76 126.81 45.89 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.146 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 46.67 -93.96 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 125.549 1.54 . . . . 0.0 114.563 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 65.1 mt -63.88 -31.33 52.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 CA-C-O 121.586 0.708 . . . . 0.0 110.708 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 153' ' ' TRP . . . . . 0.443 ' CG ' ' HA ' ' B' ' 146' ' ' LYS . 49.1 m95 -83.98 -3.68 58.17 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.778 0.799 . . . . 0.0 110.247 -179.032 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 154' ' ' SER . . . . . 0.581 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 11.8 t -115.0 28.75 8.5 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 177.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -75.06 -25.48 58.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.043 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 9.8 t70 . . . . . 0 C--N 1.298 -1.656 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 -176.836 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.2 m170 . . . . . 0 CA--C 1.505 -0.756 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.494 ' HG2' ' HB2' ' A' ' 75' ' ' GLU . 46.4 mtmt -89.64 109.68 20.63 Favored 'General case' 0 N--CA 1.432 -1.362 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 170.413 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.476 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 7.2 pt-20 -112.73 138.24 22.02 Favored Pre-proline 0 C--N 1.273 -2.759 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.651 178.476 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 17.3 Cg_exo -67.37 136.65 40.73 Favored 'Trans proline' 0 C--O 1.24 0.605 0 C-N-CA 122.575 2.183 . . . . 0.0 113.199 -176.346 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -128.31 159.46 35.21 Favored 'General case' 0 N--CA 1.425 -1.676 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.753 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.415 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 72.9 m -110.93 128.7 55.91 Favored 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 177.722 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 57.4 tp -69.38 128.13 35.49 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 120.631 0.253 . . . . 0.0 110.638 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.4 mm -95.05 -55.1 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 173.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -171.54 137.91 1.1 Allowed 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.437 179.097 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.513 ' HA ' HG13 ' A' ' 23' ' ' VAL . . . -86.67 105.75 17.13 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 175.56 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.4 mm -74.41 -49.16 32.85 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.594 -175.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.479 ' HB3' ' H ' ' A' ' 22' ' ' THR . 5.3 t70 -142.91 -163.71 1.69 Allowed 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 106.851 -1.537 . . . . 0.0 106.851 -173.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -110.8 44.69 1.45 Allowed Glycine 0 C--N 1.293 -1.818 0 N-CA-C 107.555 -2.218 . . . . 0.0 107.555 176.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -167.21 -52.23 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 113.144 -1.528 . . . . 0.0 107.905 -170.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.479 ' H ' ' HB3' ' A' ' 19' ' ' ASP . 31.1 m -105.88 122.34 45.91 Favored 'General case' 0 N--CA 1.428 -1.567 0 CA-C-N 114.281 -1.327 . . . . 0.0 108.931 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.513 HG13 ' HA ' ' A' ' 17' ' ' ALA . 22.9 t -133.89 145.08 33.9 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.678 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 -178.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -107.19 125.21 50.81 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 119.589 1.086 . . . . 0.0 109.804 -179.449 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.431 ' O ' ' HA ' ' A' ' 31' ' ' PRO . 4.7 mp -136.12 158.41 44.47 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-O 121.076 0.465 . . . . 0.0 110.74 -178.859 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.416 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 59.4 ttp -110.31 106.05 15.29 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 11.1 p90 -111.94 121.33 44.73 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 178.123 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp 58.29 27.71 15.63 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 123.627 0.771 . . . . 0.0 111.002 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.439 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 94.1 3.25 63.75 Favored Glycine 0 N--CA 1.444 -0.772 0 CA-C-N 115.796 -0.638 . . . . 0.0 113.167 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.416 ' O ' ' HA ' ' A' ' 26' ' ' MET . 14.1 mm100 -103.67 101.39 23.93 Favored Pre-proline 0 C--N 1.313 -1.007 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 179.268 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.439 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 2.0 Cg_endo -81.85 85.08 1.76 Allowed 'Trans proline' 0 N--CA 1.448 -1.196 0 C-N-CA 122.532 2.155 . . . . 0.0 109.783 175.855 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 29.5 mmt -100.29 156.27 17.32 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.757 -175.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.401 ' O ' ' HB3' ' A' ' 87' ' ' ARG . 9.1 m -84.27 113.23 20.97 Favored 'General case' 0 N--CA 1.409 -2.493 0 N-CA-C 105.916 -1.883 . . . . 0.0 105.916 174.549 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -95.61 148.16 22.81 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-O 121.78 0.8 . . . . 0.0 111.842 -176.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.2 tpp85 -122.2 129.77 52.57 Favored 'General case' 0 C--N 1.278 -2.541 0 N-CA-C 105.758 -1.941 . . . . 0.0 105.758 173.713 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.422 ' HB3' HD22 ' A' ' 100' ' ' ASN . 86.0 mt -72.37 119.2 16.24 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 175.428 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.435 HD21 ' HB3' ' A' ' 89' ' ' LEU . 17.9 mt -55.89 129.03 37.93 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 -177.629 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 11.1 mt 69.77 33.45 2.92 Favored 'General case' 0 C--N 1.356 0.873 0 O-C-N 124.787 1.304 . . . . 0.0 112.424 164.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.417 HG13 ' HB1' ' A' ' 109' ' ' ALA . 69.2 t -110.56 128.93 66.52 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.185 0 CA-C-N 114.678 -1.146 . . . . 0.0 108.09 178.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.45 ' HB2' ' HB2' ' A' ' 112' ' ' ALA . 16.8 t70 -103.84 108.27 19.51 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -179.581 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 36.7 p . . . . . 0 CA--C 1.561 1.385 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 176.499 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.211 -1.302 0 CA-C-O 118.805 -0.997 . . . . 0.0 113.813 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -51.07 -45.45 36.62 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 122.755 2.304 . . . . 0.0 112.406 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -63.75 -48.1 78.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.854 -179.13 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.33 -41.65 66.26 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.276 -177.445 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.3 p -63.23 -43.6 97.62 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -178.553 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.99 -41.05 95.76 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-O 120.937 0.398 . . . . 0.0 110.519 179.067 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -64.98 -50.92 64.47 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.458 177.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.539 ' O ' HG22 ' A' ' 66' ' ' VAL . 61.5 m -55.87 -46.97 78.13 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 123.9 0.75 . . . . 0.0 110.975 -179.085 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -56.54 -53.97 51.29 Favored 'General case' 0 C--O 1.214 -0.775 0 O-C-N 123.395 0.435 . . . . 0.0 111.608 178.529 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -64.2 -32.31 73.84 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 120.91 0.386 . . . . 0.0 111.52 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 11.4 tpt -67.74 -45.83 73.87 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.706 -178.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.539 HG22 ' O ' ' A' ' 62' ' ' THR . 28.8 m -89.61 -31.77 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 -175.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -75.96 -20.42 57.93 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.987 0.423 . . . . 0.0 111.552 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -90.38 -15.21 31.46 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.327 0.584 . . . . 0.0 110.504 175.519 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.437 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -77.58 149.16 34.87 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.747 -176.575 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -76.66 -65.62 0.91 Allowed 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.626 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.4 mtmm -109.52 135.43 50.53 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 -178.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 69.6 mt -104.74 119.93 54.44 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.091 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 175.295 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.452 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 32.9 mt-10 -113.32 136.56 52.62 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -177.261 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.47 HG12 HG12 ' A' ' 92' ' ' ILE . 33.1 m -110.41 126.15 67.68 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.873 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 176.011 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.494 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 40.8 tt0 -115.62 115.55 26.61 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.845 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -92.2 148.98 21.73 Favored 'General case' 0 C--N 1.287 -2.126 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -84.63 -178.78 6.98 Favored 'General case' 0 C--O 1.245 0.817 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 -176.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -8.07 54.94 Favored 'General case' 0 N--CA 1.44 -0.946 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 -172.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -93.32 -98.75 1.49 Allowed Glycine 0 N--CA 1.421 -2.364 0 C-N-CA 120.213 -0.994 . . . . 0.0 112.148 178.686 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.43 ' HB3' ' O ' ' A' ' 82' ' ' THR . 21.9 mp0 -98.71 127.11 44.53 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.295 0.569 . . . . 0.0 112.378 -176.5 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -89.2 -27.9 20.34 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 174.126 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.43 ' O ' ' HB3' ' A' ' 80' ' ' GLN . 11.0 p . . . . . 0 N--CA 1.422 -1.825 0 CA-C-N 114.618 -1.174 . . . . 0.0 109.952 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.401 ' HB3' ' O ' ' A' ' 33' ' ' THR . 69.8 mtt180 . . . . . 0 N--CA 1.449 -0.508 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -104.21 128.96 9.67 Favored Glycine 0 N--CA 1.431 -1.65 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 174.735 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.435 ' HB3' HD21 ' A' ' 37' ' ' LEU . 76.6 mt -110.01 108.35 18.55 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 117.154 0.477 . . . . 0.0 109.754 -179.493 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.11 167.33 30.76 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-O 121.654 0.74 . . . . 0.0 111.913 -178.17 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -96.94 127.48 42.95 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 104.332 -2.47 . . . . 0.0 104.332 170.43 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.47 HG12 HG12 ' A' ' 74' ' ' VAL . 55.3 mt -98.55 126.83 51.58 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.108 0 C-N-CA 117.684 -1.607 . . . . 0.0 111.578 -178.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.452 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 6.2 m-85 -105.77 127.1 52.89 Favored 'General case' 0 N--CA 1.428 -1.555 0 N-CA-C 107.478 -1.305 . . . . 0.0 107.478 176.497 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.437 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -104.34 99.93 9.64 Favored 'General case' 0 C--N 1.28 -2.451 0 N-CA-C 106.676 -1.601 . . . . 0.0 106.676 179.119 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 12.5 t70 45.39 57.73 4.67 Favored 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 125.797 1.639 . . . . 0.0 110.725 -172.063 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.87 -25.73 7.29 Favored Glycine 0 CA--C 1.526 0.722 0 CA-C-N 114.475 -1.239 . . . . 0.0 113.952 179.174 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -81.33 114.38 20.07 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -178.093 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 33.3 ttm -73.99 108.88 7.07 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 120.519 -0.472 . . . . 0.0 110.163 -176.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.0 t -66.12 -34.85 72.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 -178.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.422 HD22 ' HB3' ' A' ' 36' ' ' LEU . 26.8 t-20 -57.76 -50.59 72.72 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.938 178.775 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.437 ' HG3' ' OG ' ' B' ' 141' ' ' SER . 22.4 tt0 -65.86 -42.74 90.03 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.647 175.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.74 -44.11 77.26 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 122.92 0.488 . . . . 0.0 112.286 -178.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 90.0 mt -62.93 -44.09 97.01 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.844 0.354 . . . . 0.0 110.865 178.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.449 ' HA ' ' O ' ' A' ' 109' ' ' ALA . 58.6 t -70.43 -37.4 70.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.25 -179.086 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 10.3 tpp180 -67.16 -25.78 66.33 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.803 0.841 . . . . 0.0 110.2 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.457 ' O ' ' HB3' ' B' ' 150' ' ' LEU . 25.5 mm-40 -95.42 0.1 53.04 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.501 178.521 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.467 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 65.09 22.99 69.35 Favored Glycine 0 C--O 1.218 -0.848 0 C-N-CA 121.245 -0.502 . . . . 0.0 112.523 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 82.2 mt -81.67 -21.07 38.35 Favored 'General case' 0 CA--C 1.495 -1.139 0 CA-C-O 121.743 0.782 . . . . 0.0 108.981 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.449 ' O ' ' HA ' ' A' ' 104' ' ' VAL . . . -154.86 159.15 40.32 Favored 'General case' 0 N--CA 1.409 -2.524 0 N-CA-C 106.673 -1.603 . . . . 0.0 106.673 -179.343 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.411 ' HG3' ' HB3' ' A' ' 40' ' ' ASP . 15.4 pttp -121.23 157.86 29.36 Favored 'General case' 0 N--CA 1.416 -2.126 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.7 p -92.77 120.81 42.74 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 119.725 -0.79 . . . . 0.0 112.099 -172.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.45 ' HB2' ' HB2' ' A' ' 40' ' ' ASP . . . . . . . . 0 N--CA 1.436 -1.148 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 72.7 m80 . . . . . 0 N--CA 1.443 -0.78 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' B' ' 139' ' ' ARG . 12.3 pt-20 -51.7 -46.33 63.87 Favored 'General case' 0 C--N 1.358 0.946 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -171.399 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -66.37 -38.52 87.75 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 123.091 0.244 . . . . 0.0 111.236 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 79.4 mt -60.93 -48.43 81.86 Favored 'General case' 0 C--O 1.246 0.871 0 CA-C-O 121.913 0.863 . . . . 0.0 109.616 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 44.7 mt -69.69 -37.28 76.55 Favored 'General case' 0 N--CA 1.42 -1.93 0 N-CA-C 113.888 1.069 . . . . 0.0 113.888 -178.204 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 139' ' ' ARG . . . . . 0.554 ' HG2' ' O ' ' B' ' 135' ' ' GLU . 16.7 ptt-85 -70.7 -28.01 64.43 Favored 'General case' 0 N--CA 1.435 -1.205 0 C-N-CA 119.333 -0.947 . . . . 0.0 112.392 177.05 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -67.57 -41.24 84.46 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 173.397 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 141' ' ' SER . . . . . 0.437 ' OG ' ' HG3' ' A' ' 101' ' ' GLU . 43.3 m -59.11 -44.78 92.0 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.418 177.742 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.668 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 40.8 tt0 -66.13 -45.43 81.1 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 115.043 -0.981 . . . . 0.0 109.994 179.385 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -51.46 -47.3 63.16 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.894 0.877 . . . . 0.0 112.692 -178.313 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -64.55 -46.68 81.78 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 123.225 0.328 . . . . 0.0 111.024 177.448 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -61.07 -37.3 82.2 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.101 -178.504 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 146' ' ' LYS . . . . . 0.668 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 86.7 mttt -57.71 -48.85 78.42 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.136 0.493 . . . . 0.0 109.819 177.482 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -72.53 -37.15 68.39 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.439 -174.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -72.64 -12.21 60.95 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.603 178.04 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 149' ' ' LYS . . . . . 0.622 ' O ' ' HB2' ' B' ' 154' ' ' SER . 29.0 mmmt 59.74 53.33 4.94 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 -178.112 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 150' ' ' LEU . . . . . 0.457 ' HB3' ' O ' ' A' ' 106' ' ' GLN . 79.7 mt -92.17 121.42 33.68 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.09 -177.116 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 151' ' ' ASN . . . . . 0.467 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 45.9 m-80 50.46 -90.55 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.236 1.815 . . . . 0.0 113.704 176.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 152' ' ' ILE . . . . . 0.521 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 55.1 mt -63.48 -38.0 81.04 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.945 0 CA-C-O 121.407 0.622 . . . . 0.0 109.957 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 153' ' ' TRP . . . . . 0.468 ' CG ' ' HA ' ' B' ' 146' ' ' LYS . 60.5 m95 -79.77 -4.91 54.07 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-O 121.225 0.536 . . . . 0.0 111.574 -176.22 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 154' ' ' SER . . . . . 0.622 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 32.5 t -95.62 9.54 39.88 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.724 175.405 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 155' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 9.2 pt-20 -70.19 -30.56 67.7 Favored 'General case' 0 C--N 1.35 0.59 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 173.26 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 18.0 t70 . . . . . 0 N--CA 1.447 -0.614 0 C-N-CA 126.153 1.781 . . . . 0.0 110.267 178.936 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 . . . . . 0 C--O 1.247 0.938 0 CA-C-O 120.451 0.167 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -71.39 154.91 41.21 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.65 176.123 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -139.41 152.52 69.3 Favored Pre-proline 0 C--N 1.277 -2.558 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.529 176.142 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -77.02 140.36 20.05 Favored 'Trans proline' 0 N--CA 1.447 -1.209 0 C-N-CA 121.989 1.793 . . . . 0.0 111.268 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -119.57 166.79 12.69 Favored 'General case' 0 C--N 1.288 -2.079 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.762 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.482 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 11.7 m -105.01 134.43 48.13 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 178.637 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.467 ' HB2' HD12 ' A' ' 72' ' ' ILE . 64.5 tp -72.99 133.61 44.36 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 120.931 0.396 . . . . 0.0 110.793 -179.131 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 64.8 mt -106.01 -59.11 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.751 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 172.439 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.4 pttt -170.95 134.02 0.94 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.162 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -95.5 106.25 18.31 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 107.759 -1.201 . . . . 0.0 107.759 174.32 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 48.3 mm -71.3 -50.13 43.16 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-O 121.399 0.619 . . . . 0.0 109.528 -176.41 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.498 ' HA ' ' CB ' ' A' ' 59' ' ' SER . 7.5 t70 -139.89 -162.33 1.32 Allowed 'General case' 0 C--N 1.294 -1.83 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 -178.928 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -91.84 -7.59 64.35 Favored Glycine 0 C--N 1.302 -1.314 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 177.196 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.456 ' HB2' ' OG1' ' A' ' 41' ' ' THR . 13.8 t70 -95.18 -56.97 2.55 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 113.813 -1.193 . . . . 0.0 110.117 -179.145 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -111.46 130.12 55.81 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.014 -176.467 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.3 p -137.92 138.35 43.96 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 C-N-CA 124.461 1.105 . . . . 0.0 108.281 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.8 tttp -100.11 122.5 43.06 Favored 'General case' 0 C--N 1.293 -1.878 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 -175.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.0 mp -125.71 159.4 32.39 Favored 'General case' 0 CA--C 1.497 -1.066 0 CA-C-O 121.358 0.599 . . . . 0.0 110.477 -178.69 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.482 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 43.6 ttm -118.0 120.03 36.58 Favored 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 114.737 -1.119 . . . . 0.0 108.368 177.159 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.8 p90 -120.41 114.13 21.36 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.46 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 59.1 mttp 60.95 27.45 17.31 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.821 0.848 . . . . 0.0 111.856 -177.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.13 2.76 64.01 Favored Glycine 0 C--N 1.314 -0.669 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.684 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 26' ' ' MET . 42.5 mt-30 -97.97 109.27 50.78 Favored Pre-proline 0 C--N 1.313 -0.983 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 177.578 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 30' ' ' GLN . 14.0 Cg_endo -88.86 106.4 0.45 Allowed 'Trans proline' 0 N--CA 1.443 -1.46 0 C-N-CA 122.732 2.288 . . . . 0.0 111.949 179.261 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -119.81 145.45 46.61 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.037 178.68 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 10.6 m -85.47 104.5 15.31 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 175.696 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -95.19 142.77 27.23 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-O 121.481 0.658 . . . . 0.0 111.155 -174.338 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.41 ' HD3' ' OD1' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -113.12 132.85 55.28 Favored 'General case' 0 C--N 1.275 -2.635 0 N-CA-C 104.416 -2.438 . . . . 0.0 104.416 174.016 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.511 ' HB2' ' HB ' ' A' ' 39' ' ' VAL . 6.6 mp -66.57 130.33 42.82 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -175.334 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.2 mt -62.11 127.36 30.98 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.787 174.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.404 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 74.4 mt 75.18 8.22 4.02 Favored 'General case' 0 C--O 1.221 -0.429 0 O-C-N 124.751 1.282 . . . . 0.0 113.062 176.665 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.511 ' HB ' ' HB2' ' A' ' 36' ' ' LEU . 84.9 t -118.12 125.8 74.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -135.56 123.57 22.79 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 178.359 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.456 ' OG1' ' HB2' ' A' ' 21' ' ' ASP . 73.8 p . . . . . 0 CA--C 1.569 1.701 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 1.577 0 CA-C-O 119.664 -0.52 . . . . 0.0 112.847 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -55.9 -22.99 40.39 Favored 'Trans proline' 0 C--N 1.37 1.675 0 C-N-CA 123.073 2.516 . . . . 0.0 114.237 176.219 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -86.3 -36.13 19.5 Favored 'General case' 0 C--O 1.209 -1.066 0 C-N-CA 120.113 -0.635 . . . . 0.0 109.817 178.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.35 -43.3 92.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.505 0.669 . . . . 0.0 110.16 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.498 ' CB ' ' HA ' ' A' ' 19' ' ' ASP . 8.8 p -68.05 -40.4 82.83 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.22 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.07 -46.63 64.55 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.13 -177.49 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -56.2 -44.78 79.77 Favored 'General case' 0 CA--C 1.507 -0.702 0 C-N-CA 123.795 0.838 . . . . 0.0 110.075 -179.575 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.442 ' O ' HG22 ' A' ' 66' ' ' VAL . 39.5 m -62.15 -45.17 94.61 Favored 'General case' 0 N--CA 1.439 -1.024 0 O-C-N 123.992 0.808 . . . . 0.0 110.591 179.091 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.533 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 49.1 mttp -58.0 -54.55 45.7 Favored 'General case' 0 C--O 1.212 -0.917 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 176.635 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -60.07 -33.86 72.65 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.509 -0.768 . . . . 0.0 112.046 -176.591 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.12 -51.44 21.39 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 179.741 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.442 HG22 ' O ' ' A' ' 62' ' ' THR . 32.8 m -71.5 -26.23 26.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -176.357 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.533 ' HG2' ' O ' ' A' ' 63' ' ' LYS . 79.9 mm-40 -71.9 -35.18 69.64 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.782 0.801 . . . . 0.0 109.191 174.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -73.59 -41.56 62.72 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.2 -178.007 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.13 146.64 54.05 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -177.59 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.8 mptt -78.09 -60.08 2.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.911 0.862 . . . . 0.0 108.714 179.177 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -107.06 128.08 54.05 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.521 -174.398 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.467 HD12 ' HB2' ' A' ' 14' ' ' LEU . 60.3 mt -100.56 124.11 53.91 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.345 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 170.382 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.568 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 21.5 mt-10 -112.34 133.38 54.47 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -173.465 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 28.9 m -111.97 129.51 67.3 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.187 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.969 179.431 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -128.93 142.58 50.89 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.121 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -110.13 116.29 31.28 Favored 'General case' 0 N--CA 1.423 -1.795 0 N-CA-C 110.552 -0.166 . . . . 0.0 110.552 177.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -102.29 -175.15 2.75 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 178.043 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.9 64.61 4.8 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 -172.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -128.27 -106.31 1.31 Allowed Glycine 0 C--N 1.292 -1.9 0 CA-C-N 114.779 -1.101 . . . . 0.0 110.477 174.156 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -137.91 145.94 42.71 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 -99.3 -10.06 22.81 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 120.356 -0.538 . . . . 0.0 109.736 178.805 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.448 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 40.1 p . . . . . 0 N--CA 1.435 -1.223 0 CA-C-O 120.857 0.36 . . . . 0.0 110.528 177.051 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 . . . . . 0 N--CA 1.442 -0.871 0 CA-C-O 121.163 0.506 . . . . 0.0 110.311 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.448 ' HA2' ' HA ' ' A' ' 82' ' ' THR . . . -119.01 162.5 13.47 Favored Glycine 0 N--CA 1.421 -2.351 0 N-CA-C 108.971 -1.652 . . . . 0.0 108.971 174.046 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 74.8 mt -134.16 129.51 35.93 Favored 'General case' 0 C--N 1.29 -1.993 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 176.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -153.16 157.66 40.64 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.078 0.466 . . . . 0.0 110.004 179.68 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -90.96 112.31 24.14 Favored 'General case' 0 C--N 1.294 -1.841 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 176.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 45.6 mm -98.81 126.56 51.97 Favored 'Isoleucine or valine' 0 C--O 1.257 1.451 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -170.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.568 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 4.4 m-85 -112.98 152.75 29.03 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 106.133 -1.803 . . . . 0.0 106.133 173.227 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -130.32 100.07 5.25 Favored 'General case' 0 C--N 1.28 -2.438 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 175.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.7 t70 45.63 58.02 4.57 Favored 'General case' 0 C--O 1.244 0.793 0 C-N-CA 125.017 1.327 . . . . 0.0 113.298 -179.643 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.86 -25.12 23.15 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.382 -0.913 . . . . 0.0 114.432 176.651 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -100.29 150.33 22.67 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 117.551 0.676 . . . . 0.0 109.304 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 58.6 mtm -97.13 119.87 36.43 Favored 'General case' 0 N--CA 1.414 -2.238 0 C-N-CA 120.336 -0.546 . . . . 0.0 111.429 178.624 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 38.4 t -63.38 -37.93 80.81 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.27 0 CA-C-N 114.621 -1.172 . . . . 0.0 108.404 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -59.24 -42.61 91.47 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 114.527 -1.215 . . . . 0.0 110.851 177.149 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -65.57 -56.09 14.17 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.034 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.85 -51.01 62.6 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.775 0.83 . . . . 0.0 112.636 -176.54 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 90.0 mt -58.15 -45.55 87.2 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 60.8 t -73.23 -36.81 50.66 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.04 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 30.0 mmt180 -65.97 -34.52 78.3 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 122.544 0.338 . . . . 0.0 111.541 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -87.14 2.16 50.73 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.645 178.271 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.04 33.19 86.51 Favored Glycine 0 C--O 1.226 -0.406 0 CA-C-N 116.34 -0.391 . . . . 0.0 112.995 177.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.3 mt -105.32 4.28 30.77 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 120.882 0.372 . . . . 0.0 110.559 -178.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -155.84 160.16 39.97 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.515 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -112.61 171.77 7.32 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 7.3 p -78.15 126.04 38.12 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.724 0 CA-C-O 121.476 0.655 . . . . 0.0 110.185 178.144 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.444 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.602 178.188 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 . . . . . 0 CA--C 1.504 -0.794 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.486 ' CG ' ' HE ' ' B' ' 139' ' ' ARG . 43.6 tt0 -62.28 -45.84 91.46 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.798 -177.823 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -57.86 -38.44 75.73 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.294 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 85.1 mt -67.02 -50.04 63.4 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.187 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.03 -26.51 65.91 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 139' ' ' ARG . . . . . 0.486 ' HE ' ' CG ' ' B' ' 135' ' ' GLU . 47.7 mtt180 -76.24 -22.25 55.4 Favored 'General case' 0 C--O 1.211 -0.971 0 C-N-CA 119.788 -0.765 . . . . 0.0 110.733 175.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -74.08 -32.0 63.06 Favored 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 172.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 13.6 m -65.85 -44.8 84.39 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.253 -0.885 . . . . 0.0 108.629 174.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.466 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 0.0 OUTLIER -64.99 -38.86 92.37 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.047 176.75 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -58.59 -39.79 81.36 Favored 'General case' 0 C--O 1.243 0.76 0 C-N-CA 122.7 0.4 . . . . 0.0 110.937 177.348 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 144' ' ' GLN . . . . . 0.445 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 53.8 tt0 -69.18 -48.56 61.86 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.836 179.022 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -64.25 -34.35 77.91 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.223 -175.67 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 146' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 80.7 mttt -58.32 -50.22 74.4 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.065 0.459 . . . . 0.0 111.124 174.35 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -70.46 -22.76 62.65 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.127 -177.259 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 148' ' ' GLU . . . . . 0.475 ' HB2' ' HG ' ' B' ' 150' ' ' LEU . 34.5 mm-40 -89.57 -7.71 54.25 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.31 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 149' ' ' LYS . . . . . 0.575 ' O ' ' HB2' ' B' ' 154' ' ' SER . 30.5 mmmt 52.08 52.51 14.23 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.543 1.137 . . . . 0.0 109.02 -177.024 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 150' ' ' LEU . . . . . 0.475 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 95.5 mt -88.36 113.38 23.9 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.23 -177.008 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 54.61 -89.26 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 125.841 1.656 . . . . 0.0 114.072 172.533 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 22.4 mt -65.01 -36.66 78.35 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.128 0 CA-C-O 121.049 0.452 . . . . 0.0 110.444 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 64.5 m95 -77.59 -9.25 58.84 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-O 121.523 0.678 . . . . 0.0 111.286 -177.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 154' ' ' SER . . . . . 0.575 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 32.9 t -92.66 10.59 29.95 Favored 'General case' 0 N--CA 1.428 -1.575 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.574 175.747 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 155' ' ' GLU . . . . . 0.413 ' HG3' ' N ' ' B' ' 156' ' ' ASP . 6.6 pt-20 -55.14 -37.7 67.29 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 121.24 0.543 . . . . 0.0 110.418 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 156' ' ' ASP . . . . . 0.413 ' N ' ' HG3' ' B' ' 155' ' ' GLU . 29.4 t70 . . . . . 0 N--CA 1.423 -1.805 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -177.048 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.45 -0.466 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.7 tptm -108.13 131.88 54.17 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 114.712 -1.131 . . . . 0.0 108.569 -177.693 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -128.38 144.76 53.15 Favored Pre-proline 0 C--N 1.303 -1.43 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.593 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_exo -81.09 138.48 11.36 Favored 'Trans proline' 0 N--CA 1.447 -1.215 0 C-N-CA 121.89 1.726 . . . . 0.0 108.762 170.148 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -130.36 141.0 50.58 Favored 'General case' 0 C--N 1.289 -2.043 0 CA-C-O 121.152 0.501 . . . . 0.0 111.747 -177.18 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.486 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 38.0 m -90.23 127.24 36.08 Favored 'General case' 0 N--CA 1.416 -2.149 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 176.219 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.0 tp -78.47 129.71 35.2 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-O 120.623 0.249 . . . . 0.0 111.317 -177.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 71.7 mt -93.83 -56.94 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.625 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 175.226 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.448 ' HE3' ' HA ' ' A' ' 16' ' ' LYS . 1.8 tpmt? -175.2 145.22 0.77 Allowed 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 179.006 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.438 ' HA ' HG23 ' A' ' 23' ' ' VAL . . . -94.71 112.72 24.46 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 173.168 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.4 mp -82.75 -63.31 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.04 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 -173.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.417 ' HA ' ' HB3' ' A' ' 59' ' ' SER . 8.1 t70 -114.47 -164.07 0.91 Allowed 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 -176.222 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.67 -29.58 38.82 Favored Glycine 0 C--N 1.304 -1.215 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 -178.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.619 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 2.4 p30 -104.62 -30.44 9.97 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 120.869 -0.332 . . . . 0.0 111.452 178.511 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.75 116.14 31.95 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-O 121.84 0.829 . . . . 0.0 112.472 -175.064 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.438 HG23 ' HA ' ' A' ' 17' ' ' ALA . 3.5 p -131.85 142.32 43.32 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 -178.499 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.2 tttp -104.34 118.89 37.71 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.607 -0.683 . . . . 0.0 109.561 -173.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.457 HD11 HG21 ' A' ' 72' ' ' ILE . 3.6 mm? -119.06 159.3 24.16 Favored 'General case' 0 CA--C 1.502 -0.892 0 CA-C-O 121.731 0.777 . . . . 0.0 111.6 -178.224 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.486 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 46.0 ttm -121.7 102.15 8.03 Favored 'General case' 0 C--N 1.285 -2.214 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 174.536 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -105.29 117.62 34.47 Favored 'General case' 0 C--N 1.292 -1.913 0 C-N-CA 119.23 -0.988 . . . . 0.0 109.473 -176.15 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.9 mttt 61.96 30.62 18.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.748 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.02 -2.55 69.14 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 115.139 -0.937 . . . . 0.0 113.488 177.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.404 ' O ' ' HA ' ' A' ' 26' ' ' MET . 34.4 tt0 -103.84 112.48 65.57 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 117.013 0.406 . . . . 0.0 111.091 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -79.64 116.09 3.47 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 122.52 2.147 . . . . 0.0 111.924 177.724 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 51.0 ttm -136.43 141.2 43.58 Favored 'General case' 0 N--CA 1.423 -1.82 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.9 m -82.79 122.56 28.36 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 176.131 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.458 ' HA ' ' O ' ' A' ' 88' ' ' GLY . 56.4 m-85 -112.2 160.78 17.26 Favored 'General case' 0 N--CA 1.423 -1.796 0 CA-C-O 121.852 0.834 . . . . 0.0 112.762 -176.059 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.619 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 37.7 mtt180 -119.54 148.31 43.45 Favored 'General case' 0 C--N 1.288 -2.086 0 CA-C-N 113.508 -1.678 . . . . 0.0 106.565 167.511 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.406 ' HB2' HG21 ' A' ' 39' ' ' VAL . 5.9 mp -77.49 135.96 38.3 Favored 'General case' 0 C--N 1.289 -2.057 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.982 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.517 HD21 HD13 ' A' ' 89' ' ' LEU . 22.9 mt -70.34 152.73 43.82 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.357 175.155 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.466 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 3.6 mt 68.28 19.86 8.9 Favored 'General case' 0 C--O 1.212 -0.919 0 C-N-CA 125.964 1.706 . . . . 0.0 110.98 177.116 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.406 HG21 ' HB2' ' A' ' 36' ' ' LEU . 66.0 t -110.04 125.12 67.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 CA-C-O 121.27 0.557 . . . . 0.0 109.671 -178.598 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.551 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 26.6 t70 -98.33 108.07 20.69 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 105.601 -2.0 . . . . 0.0 105.601 173.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.442 HG21 ' NH2' ' A' ' 35' ' ' ARG . 5.0 t . . . . . 0 C--N 1.288 -2.09 0 CA-C-N 114.697 -1.138 . . . . 0.0 111.698 -173.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.328 0 CA-C-O 119.229 -0.761 . . . . 0.0 114.545 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -55.49 -34.03 88.18 Favored 'Trans proline' 0 C--N 1.364 1.351 0 C-N-CA 123.051 2.501 . . . . 0.0 113.514 178.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -71.26 -48.43 51.02 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.071 0.462 . . . . 0.0 110.446 178.744 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.525 ' HA ' HD13 ' A' ' 108' ' ' LEU . . . -65.07 -40.12 94.23 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.519 -178.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.476 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 29.8 p -65.28 -43.92 89.67 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.721 -178.947 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.27 -37.16 86.49 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.089 0.471 . . . . 0.0 110.706 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -67.95 -47.55 68.33 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.878 179.095 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.565 ' O ' HG22 ' A' ' 66' ' ' VAL . 58.5 m -58.84 -41.65 87.45 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.09 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 59' ' ' SER . 48.2 mttp -54.24 -54.71 36.29 Favored 'General case' 0 C--N 1.35 0.615 0 O-C-N 123.233 0.333 . . . . 0.0 110.848 178.353 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -66.39 -32.01 73.13 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.335 -176.409 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 17.4 tpt -67.0 -51.08 59.44 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.972 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 62' ' ' THR . 29.6 m -83.51 -27.53 7.6 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -175.267 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -81.46 -20.29 40.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -85.18 -20.63 29.92 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.585 0.707 . . . . 0.0 110.619 178.659 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -77.97 160.47 28.17 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.034 178.196 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -84.6 -57.95 2.92 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -105.46 144.19 32.57 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.081 -174.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.457 HG21 HD11 ' A' ' 25' ' ' LEU . 4.0 mp -116.86 120.39 64.9 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.811 0 N-CA-C 105.987 -1.857 . . . . 0.0 105.987 174.912 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.496 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 22.5 mt-10 -112.81 133.28 54.88 Favored 'General case' 0 C--N 1.279 -2.466 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -175.682 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 30.2 m -110.87 122.75 65.93 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.321 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -118.26 140.36 49.93 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-O 121.326 0.584 . . . . 0.0 111.374 -176.007 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.403 ' CD1' ' HB2' ' A' ' 81' ' ' ARG . 34.2 t80 -104.76 126.28 51.68 Favored 'General case' 0 N--CA 1.421 -1.923 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.897 179.485 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -85.68 -173.47 4.65 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 178.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -71.78 -12.29 61.23 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.903 -0.498 . . . . 0.0 112.091 -175.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -79.79 -118.05 0.31 Allowed Glycine 0 CA--C 1.525 0.708 0 N-CA-C 114.557 0.583 . . . . 0.0 114.557 -178.591 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -124.36 153.34 41.98 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 -176.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.403 ' HB2' ' CD1' ' A' ' 76' ' ' PHE . 43.0 ttm180 -106.97 -15.63 14.65 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 121.832 0.825 . . . . 0.0 108.876 174.441 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 2.2 p . . . . . 0 C--N 1.299 -1.62 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.96 178.796 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 9.7 tpp180 . . . . . 0 N--CA 1.428 -1.574 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.458 ' O ' ' HA ' ' A' ' 34' ' ' PHE . . . -95.53 142.43 16.09 Favored Glycine 0 N--CA 1.432 -1.573 0 N-CA-C 109.18 -1.568 . . . . 0.0 109.18 175.446 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.517 HD13 HD21 ' A' ' 37' ' ' LEU . 0.4 OUTLIER -134.38 135.15 42.45 Favored 'General case' 0 N--CA 1.419 -1.987 0 CA-C-N 117.9 0.85 . . . . 0.0 112.504 177.06 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -152.49 156.49 39.51 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -83.31 130.73 35.08 Favored 'General case' 0 N--CA 1.434 -1.259 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 178.139 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 60.5 mt -103.72 126.54 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.025 0 CA-C-O 121.563 0.697 . . . . 0.0 112.02 -175.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.496 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 79.1 m-85 -107.43 132.44 53.18 Favored 'General case' 0 N--CA 1.423 -1.805 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 172.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.27 99.36 8.97 Favored 'General case' 0 C--N 1.285 -2.237 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 177.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.3 t70 45.83 53.25 9.04 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 125.155 1.382 . . . . 0.0 111.355 -176.429 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 84.1 -5.02 81.65 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 115.617 -0.72 . . . . 0.0 114.641 179.588 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -96.89 141.07 30.52 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 117.927 0.863 . . . . 0.0 109.681 177.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 62.9 mtm -84.29 110.58 18.69 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-O 121.37 0.605 . . . . 0.0 110.901 179.294 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 54.9 t -65.94 -42.2 91.4 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 CA-C-N 114.525 -1.216 . . . . 0.0 111.49 -176.23 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -69.41 -30.41 68.36 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.057 0.456 . . . . 0.0 110.46 -178.355 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -62.12 -38.47 89.07 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 175.799 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -69.58 -36.72 76.52 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.237 178.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 89.2 mt -64.02 -44.16 93.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.35 177.25 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 66.3 t -69.74 -32.5 52.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 121.018 0.437 . . . . 0.0 110.27 178.013 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.93 -17.25 64.4 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.265 0.555 . . . . 0.0 111.008 179.455 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -108.86 -3.68 17.44 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 121.086 0.469 . . . . 0.0 110.033 176.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.537 ' HA3' ' O ' ' B' ' 150' ' ' LEU . . . 63.08 42.47 99.54 Favored Glycine 0 N--CA 1.437 -1.244 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.034 -177.191 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.525 HD13 ' HA ' ' A' ' 58' ' ' ALA . 75.8 mt -90.68 -20.57 22.34 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 121.006 0.432 . . . . 0.0 110.39 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -155.1 173.51 16.49 Favored 'General case' 0 N--CA 1.433 -1.275 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.523 -177.632 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.551 ' HB2' ' HB3' ' A' ' 40' ' ' ASP . 89.6 mttt -118.14 168.78 10.25 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 105.472 -2.048 . . . . 0.0 105.472 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 11.6 m -106.83 127.84 62.07 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 C-N-CA 117.378 -1.729 . . . . 0.0 111.937 178.261 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.494 ' HB2' ' HB2' ' A' ' 40' ' ' ASP . . . . . . . . 0 C--N 1.306 -1.296 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 175.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 . . . . . 0 N--CA 1.449 -0.497 0 N-CA-C 110.689 -0.115 . . . . 0.0 110.689 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -67.45 -50.27 59.98 Favored 'General case' 0 CA--C 1.501 -0.904 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 -172.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 136' ' ' GLN . . . . . 0.489 ' O ' ' HG3' ' B' ' 140' ' ' LYS . 72.7 mt-30 -52.24 -45.33 65.3 Favored 'General case' 0 C--N 1.314 -0.939 0 O-C-N 124.07 0.856 . . . . 0.0 111.784 -175.429 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.9 mt -63.59 -50.3 69.98 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 120.828 0.346 . . . . 0.0 110.871 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.64 -38.9 87.84 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.688 -178.449 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 77.0 mtt-85 -75.24 -29.15 60.14 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -176.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 140' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' B' ' 136' ' ' GLN . 63.5 mttm -70.56 -34.42 72.2 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.546 174.307 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 47.4 m -67.13 -41.75 85.62 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.489 174.724 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.522 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 40.0 tt0 -57.47 -52.77 64.03 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.427 176.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -51.84 -49.38 62.96 Favored 'General case' 0 C--O 1.24 0.558 0 O-C-N 123.782 0.676 . . . . 0.0 111.525 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 144' ' ' GLN . . . . . 0.47 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 27.5 tt0 -61.93 -47.19 86.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.417 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -63.28 -36.77 84.79 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 123.536 0.734 . . . . 0.0 111.746 -177.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 146' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 87.7 mttt -57.62 -48.81 78.41 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.344 0.593 . . . . 0.0 109.844 176.541 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -66.11 -32.33 73.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.858 -178.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 148' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 22.4 mm-40 -73.51 -20.58 60.63 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.456 178.752 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt 54.93 65.01 1.62 Allowed 'General case' 0 CA--C 1.506 -0.733 0 C-N-CA 124.501 1.12 . . . . 0.0 110.615 -172.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 150' ' ' LEU . . . . . 0.537 ' O ' ' HA3' ' A' ' 107' ' ' GLY . 95.7 mt -89.33 108.19 19.49 Favored 'General case' 0 C--N 1.301 -1.528 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.092 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 151' ' ' ASN . . . . . 0.408 ' HB3' ' O ' ' A' ' 107' ' ' GLY . 61.5 t30 48.45 -81.64 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 126.635 1.974 . . . . 0.0 114.525 175.371 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 12.6 tt -72.85 -25.15 21.83 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.499 0 CA-C-O 121.475 0.655 . . . . 0.0 109.833 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 153' ' ' TRP . . . . . 0.494 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 52.4 m95 -82.08 -4.74 57.51 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 121.783 0.802 . . . . 0.0 109.243 178.013 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 11.7 t -110.27 31.92 5.54 Favored 'General case' 0 N--CA 1.407 -2.606 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 175.881 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -69.67 -26.52 64.42 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 119.61 -0.836 . . . . 0.0 109.636 176.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 . . . . . 0 C--O 1.237 0.435 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 173.237 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 67.7 t60 . . . . . 0 N--CA 1.453 -0.302 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -106.83 153.56 22.3 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.158 0.504 . . . . 0.0 110.06 179.246 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 7.8 pt-20 -139.97 149.08 57.52 Favored Pre-proline 0 C--N 1.272 -2.785 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 172.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 8.0 Cg_exo -74.3 144.16 32.61 Favored 'Trans proline' 0 C--O 1.247 0.973 0 C-N-CA 121.924 1.749 . . . . 0.0 111.505 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.402 ' HB1' ' HB3' ' A' ' 25' ' ' LEU . . . -132.1 152.38 51.25 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.277 179.175 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.494 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 22.7 m -98.21 131.69 44.35 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.622 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.438 ' HA ' HD13 ' A' ' 25' ' ' LEU . 61.4 tp -76.27 124.21 27.13 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 120.943 0.402 . . . . 0.0 111.437 -178.782 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 70.0 mt -95.64 -60.21 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.224 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 176.703 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -154.81 160.2 41.1 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 123.756 0.822 . . . . 0.0 109.994 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.97 121.75 45.86 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 106.73 -1.582 . . . . 0.0 106.73 173.301 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.9 mp -92.95 -56.98 4.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.402 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.092 -175.124 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -141.57 -167.82 2.51 Favored 'General case' 0 C--N 1.311 -1.071 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 -177.207 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.532 ' HA2' ' OG1' ' A' ' 62' ' ' THR . . . -88.24 51.89 4.02 Favored Glycine 0 N--CA 1.44 -1.063 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 178.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.434 ' OD1' ' HD3' ' A' ' 35' ' ' ARG . 2.6 t70 179.06 -59.97 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.143 0 C-N-CA 125.813 1.645 . . . . 0.0 108.087 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.4 m -82.46 110.08 17.26 Favored 'General case' 0 N--CA 1.405 -2.706 0 CA-C-N 114.048 -1.433 . . . . 0.0 110.634 -175.079 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.1 t -125.15 152.82 31.98 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.2 tttp -111.19 117.67 33.86 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 118.793 0.724 . . . . 0.0 109.39 -175.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.481 ' HB2' ' CE1' ' A' ' 34' ' ' PHE . 3.3 mm? -123.62 153.94 40.02 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.614 0.721 . . . . 0.0 111.358 -175.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.531 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 49.1 ttm -112.29 109.1 18.56 Favored 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 174.894 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -115.96 116.19 27.49 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.165 -177.041 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.48 ' HA ' ' HE2' ' A' ' 28' ' ' LYS . 9.8 mmpt? 63.84 26.92 14.46 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.423 1.089 . . . . 0.0 109.577 -178.132 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.402 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 92.8 4.96 64.92 Favored Glycine 0 C--N 1.303 -1.263 0 CA-C-N 114.603 -1.18 . . . . 0.0 113.32 179.096 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.531 ' O ' ' HA ' ' A' ' 26' ' ' MET . 46.4 mt-30 -97.03 106.93 34.54 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.53 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.402 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 5.8 Cg_exo -80.42 102.49 1.42 Allowed 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 122.694 2.263 . . . . 0.0 110.354 177.424 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 89.6 mtp -133.98 150.64 51.27 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-O 121.371 0.605 . . . . 0.0 110.814 -177.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.6 m -86.47 126.74 34.63 Favored 'General case' 0 N--CA 1.415 -2.2 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 177.436 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.481 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 33.2 m-85 -97.15 157.95 15.68 Favored 'General case' 0 C--N 1.292 -1.903 0 C-N-CA 123.174 0.589 . . . . 0.0 111.853 -177.511 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.434 ' HD3' ' OD1' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -139.08 133.78 32.03 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 104.104 -2.554 . . . . 0.0 104.104 -179.187 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.6 mt -84.61 132.66 34.47 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.897 0.856 . . . . 0.0 112.265 -174.682 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.473 HD21 ' HB3' ' A' ' 89' ' ' LEU . 74.1 mt -73.31 138.34 45.37 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.115 177.718 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 38.8 mt 66.75 17.88 10.63 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.265 1.426 . . . . 0.0 112.964 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 59.5 t -110.64 136.92 45.16 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.779 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -126.15 106.67 9.73 Favored 'General case' 0 C--N 1.288 -2.103 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 174.001 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 19.6 m . . . . . 0 C--N 1.285 -2.22 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 177.975 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.365 0 CA-C-O 119.206 -0.775 . . . . 0.0 112.741 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -51.55 -29.49 32.3 Favored 'Trans proline' 0 C--N 1.363 1.315 0 C-N-CA 123.154 2.569 . . . . 0.0 113.082 177.384 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -72.77 -47.58 45.55 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 122.554 0.342 . . . . 0.0 110.283 178.768 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.33 -44.85 93.73 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.69 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.568 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 12.9 m -59.21 -46.87 87.31 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.111 178.845 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.11 -46.26 89.84 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -177.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -59.37 -40.86 87.86 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.742 -177.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.532 ' OG1' ' HA2' ' A' ' 20' ' ' GLY . 30.2 m -64.45 -47.15 80.15 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.217 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.568 ' HG3' ' O ' ' A' ' 59' ' ' SER . 55.2 mtpt -60.46 -44.03 96.31 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.379 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp -56.15 -54.04 49.85 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.625 177.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 53.0 ttm -66.07 -42.17 89.77 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.729 -175.092 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 35.1 m -71.65 -37.75 64.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.921 -0.712 . . . . 0.0 112.351 -178.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -75.36 -24.78 57.34 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -78.67 -21.63 47.99 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.508 0.671 . . . . 0.0 110.203 178.173 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.487 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -78.62 147.08 33.78 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.518 -178.811 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.25 -47.49 7.75 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.678 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.4 mtmp? -110.07 139.08 45.59 Favored 'General case' 0 CA--C 1.494 -1.211 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 3.8 mp -112.25 135.0 52.96 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.404 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 176.213 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.531 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 7.0 mm-40 -111.99 132.89 54.51 Favored 'General case' 0 N--CA 1.422 -1.826 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 -177.082 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.443 HG12 ' CD1' ' A' ' 92' ' ' ILE . 35.4 m -116.74 118.91 60.35 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 175.448 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.451 ' HA ' ' HA ' ' A' ' 9' ' ' LYS . 25.1 tt0 -116.25 136.45 53.0 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 121.395 0.617 . . . . 0.0 112.539 -173.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -108.48 140.22 42.12 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 125.222 1.409 . . . . 0.0 111.104 -176.214 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -122.89 -179.3 4.21 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -73.74 69.55 1.33 Allowed 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 124.766 1.226 . . . . 0.0 112.549 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -150.75 -164.03 11.7 Favored Glycine 0 C--N 1.28 -2.557 0 CA-C-N 113.297 -1.774 . . . . 0.0 109.573 174.449 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -89.81 142.47 27.66 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 176.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -101.51 -10.6 19.99 Favored 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.697 -176.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.3 p . . . . . 0 C--N 1.29 -2.005 0 O-C-N 122.114 -0.366 . . . . 0.0 110.157 178.122 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 . . . . . 0 N--CA 1.426 -1.633 0 CA-C-O 120.796 0.331 . . . . 0.0 110.47 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.66 115.01 3.97 Favored Glycine 0 N--CA 1.426 -1.987 0 N-CA-C 110.711 -0.956 . . . . 0.0 110.711 179.564 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.473 ' HB3' HD21 ' A' ' 37' ' ' LEU . 69.5 mt -86.41 101.55 13.23 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -157.19 167.81 29.26 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 -177.11 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.431 ' CE1' ' HB2' ' A' ' 37' ' ' LEU . 11.9 m-85 -90.21 127.51 36.14 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.352 175.425 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.443 ' CD1' HG12 ' A' ' 74' ' ' VAL . 51.0 mm -99.17 122.91 51.47 Favored 'Isoleucine or valine' 0 C--O 1.261 1.7 0 C-N-CA 120.193 -0.603 . . . . 0.0 109.508 177.881 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.531 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 14.1 m-85 -114.48 135.93 53.57 Favored 'General case' 0 N--CA 1.427 -1.623 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 174.6 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.487 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -105.45 109.17 21.05 Favored 'General case' 0 C--N 1.278 -2.529 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 -178.618 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 11.1 t70 46.95 40.45 9.28 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.614 1.566 . . . . 0.0 111.319 -177.193 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 96.03 -14.35 64.72 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.339 -0.846 . . . . 0.0 113.792 177.071 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 8.4 mptt -92.29 140.84 29.2 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -179.29 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' MET . . . . . 0.414 ' HG3' ' CD1' ' A' ' 93' ' ' TYR . 1.9 mpt? -85.08 105.05 15.53 Favored 'General case' 0 C--N 1.297 -1.689 0 O-C-N 122.294 -0.254 . . . . 0.0 111.63 -176.47 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 30.0 t -66.59 -44.91 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-O 122.256 1.027 . . . . 0.0 108.456 -179.255 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 -56.45 -43.61 79.67 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 113.37 -1.741 . . . . 0.0 110.721 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -66.83 -51.44 55.57 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.517 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.48 -45.24 76.98 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.111 -0.95 . . . . 0.0 112.066 -177.497 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.2 mt -54.65 -52.67 61.58 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 178.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 62.0 t -71.01 -37.83 69.43 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.737 -178.43 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 23.5 ttp85 -69.94 -21.49 63.26 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 -179.135 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -95.93 3.71 53.33 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.977 175.6 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.74 29.49 73.84 Favored Glycine 0 C--N 1.331 0.287 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.792 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.9 mt -95.08 -15.03 23.73 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.192 0.52 . . . . 0.0 110.198 -179.367 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -149.24 162.27 40.35 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -106.22 171.47 7.33 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 10.2 p -93.56 133.57 34.23 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 177.279 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.292 -1.932 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 174.537 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 5.5 p80 . . . . . 0 C--O 1.235 0.328 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -67.75 -48.34 66.68 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.212 -173.451 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -60.08 -33.56 72.25 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.069 -0.969 . . . . 0.0 112.937 -178.584 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 91.8 mt -59.54 -47.71 84.48 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.324 0.583 . . . . 0.0 109.538 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -68.5 -40.61 80.81 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.404 178.278 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 -63.96 -36.46 84.05 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.486 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -68.63 -43.72 75.73 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.707 0.289 . . . . 0.0 110.718 175.624 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.0 m -61.41 -45.39 94.52 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.945 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.493 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 0.1 OUTLIER -68.78 -43.11 76.41 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.207 178.434 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -60.1 -44.36 94.9 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.803 0.335 . . . . 0.0 110.722 179.711 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 144' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 35.5 tt0 -67.43 -47.85 69.01 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.774 -179.703 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.91 85.4 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -177.028 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 146' ' ' LYS . . . . . 0.493 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 84.6 mttt -62.25 -47.35 84.76 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.888 175.875 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -69.92 -31.36 69.09 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 123.447 0.467 . . . . 0.0 112.019 -175.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 148' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 11.8 mm-40 -79.95 -17.68 52.36 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.89 178.621 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 149' ' ' LYS . . . . . 0.63 ' O ' ' HB3' ' B' ' 154' ' ' SER . 13.0 mmmm 60.25 65.45 1.08 Allowed 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -174.352 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 150' ' ' LEU . . . . . 0.478 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 97.6 mt -98.98 123.44 43.28 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 115.925 -0.579 . . . . 0.0 112.287 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 49.45 -88.51 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 126.324 1.85 . . . . 0.0 114.951 173.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 48.3 mt -66.29 -37.35 79.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.165 0.507 . . . . 0.0 110.226 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 62.7 m95 -77.25 -21.0 54.38 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.575 -175.095 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 154' ' ' SER . . . . . 0.63 ' HB3' ' O ' ' B' ' 149' ' ' LYS . 80.7 p -91.89 21.11 5.11 Favored 'General case' 0 N--CA 1.419 -1.989 0 CA-C-O 121.338 0.59 . . . . 0.0 111.049 -178.742 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -64.33 -31.97 73.38 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 170.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 27.0 t70 . . . . . 0 N--CA 1.42 -1.948 0 CA-C-N 113.076 -1.875 . . . . 0.0 107.832 -179.378 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.6 m80 . . . . . 0 CA--C 1.502 -0.867 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -96.6 145.45 25.73 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.68 175.332 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.401 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 11.2 pt-20 -139.28 149.72 61.76 Favored Pre-proline 0 C--N 1.287 -2.15 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 5.1 Cg_exo -78.39 140.96 17.61 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 122.272 1.981 . . . . 0.0 113.172 -177.021 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.437 ' O ' ' HB ' ' A' ' 72' ' ' ILE . . . -132.24 154.83 49.24 Favored 'General case' 0 N--CA 1.424 -1.761 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.433 178.779 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.478 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 50.0 m -98.52 122.46 41.74 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.521 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.2 tp -66.56 118.84 10.73 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 176.003 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 39.0 mm -90.09 -56.9 4.69 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -165.0 153.93 12.47 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.567 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -111.25 123.11 49.54 Favored 'General case' 0 C--N 1.287 -2.15 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 176.064 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.3 mp -90.79 -64.32 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -175.016 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -130.65 -173.71 3.15 Favored 'General case' 0 C--N 1.31 -1.138 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 179.688 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.67 54.63 4.39 Favored Glycine 0 C--N 1.314 -0.654 0 N-CA-C 111.401 -0.68 . . . . 0.0 111.401 -178.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.543 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 4.2 p-10 -177.14 -36.51 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -178.115 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 p -111.33 112.06 23.55 Favored 'General case' 0 N--CA 1.422 -1.832 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.92 -178.473 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.8 m -131.63 143.19 41.14 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.645 0 CA-C-N 114.6 -1.182 . . . . 0.0 108.178 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 33' ' ' THR . 81.0 tttt -104.8 117.77 34.88 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 122.023 -0.423 . . . . 0.0 110.069 -176.671 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.2 mp -120.49 147.01 45.69 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.502 -179.007 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.629 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 44.1 ttm -108.15 108.96 20.25 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 175.128 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -115.38 130.7 56.97 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -178.358 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 32.4 pttt 41.77 35.74 0.54 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.849 1.26 . . . . 0.0 113.559 -174.076 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.445 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 95.32 -0.92 64.07 Favored Glycine 0 N--CA 1.442 -0.9 0 CA-C-N 114.929 -1.032 . . . . 0.0 114.668 177.463 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.629 ' O ' ' HA ' ' A' ' 26' ' ' MET . 1.8 mp0 -99.09 105.8 34.33 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 117.973 0.886 . . . . 0.0 111.458 178.834 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.445 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 1.7 Cg_endo -82.79 104.13 1.26 Allowed 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 122.261 1.974 . . . . 0.0 109.686 173.698 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 86.8 mtp -128.54 143.25 50.93 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 120.658 0.266 . . . . 0.0 110.562 -177.022 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.408 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 15.8 m -80.48 116.22 20.41 Favored 'General case' 0 N--CA 1.421 -1.92 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 174.738 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -98.19 154.62 17.64 Favored 'General case' 0 C--N 1.293 -1.891 0 C-N-CA 124.04 0.936 . . . . 0.0 111.551 -177.801 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.543 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -122.47 122.98 40.23 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 103.73 -2.693 . . . . 0.0 103.73 174.048 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.6 mp -61.77 126.0 25.81 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 123.389 0.431 . . . . 0.0 111.766 -177.184 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.432 HD21 ' HB3' ' A' ' 89' ' ' LEU . 71.7 mt -57.63 134.76 56.45 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.364 175.41 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.543 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 44.0 mt 70.04 16.77 7.5 Favored 'General case' 0 C--O 1.215 -0.714 0 C-N-CA 124.957 1.303 . . . . 0.0 113.002 179.354 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.599 HG23 HD22 ' A' ' 100' ' ' ASN . 55.6 t -119.49 127.5 75.86 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.755 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 177.557 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -137.15 129.52 29.78 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 123.432 0.457 . . . . 0.0 110.179 177.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.9 m . . . . . 0 N--CA 1.426 -1.657 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 174.283 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.297 0 CA-C-O 119.634 -0.537 . . . . 0.0 113.7 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -58.15 -22.57 57.12 Favored 'Trans proline' 0 C--N 1.361 1.203 0 C-N-CA 122.792 2.328 . . . . 0.0 113.154 177.321 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -82.69 -37.94 24.08 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.949 0.404 . . . . 0.0 109.914 178.542 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.63 -47.14 85.05 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.799 177.245 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.523 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 16.3 p -62.16 -44.7 96.04 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.367 179.454 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.59 -47.52 81.91 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 122.684 0.394 . . . . 0.0 111.499 -179.493 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -64.37 -40.64 96.23 Favored 'General case' 0 C--O 1.244 0.807 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.353 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 38.7 m -61.06 -45.14 95.98 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.9 178.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.567 ' HG2' ' HB3' ' A' ' 17' ' ' ALA . 61.4 mtpt -59.83 -52.94 63.32 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.593 -178.524 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.462 ' N ' ' HE2' ' A' ' 64' ' ' LYS . 0.3 OUTLIER -62.14 -33.46 74.54 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 179.258 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 53.3 tpp -65.5 -44.53 86.75 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 120.713 0.292 . . . . 0.0 110.8 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.7 m -75.39 -25.03 17.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.972 179.381 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.531 ' HG3' ' O ' ' A' ' 63' ' ' LYS . 44.9 mt-10 -71.43 -31.57 67.37 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.915 0.388 . . . . 0.0 110.053 174.059 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -78.13 -9.67 59.27 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 123.858 0.863 . . . . 0.0 111.319 -177.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.03 128.36 36.26 Favored 'General case' 0 C--O 1.252 1.211 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.459 -178.9 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 49.1 mttp -68.16 -47.81 67.03 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 105.755 -1.942 . . . . 0.0 105.755 171.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.462 ' H ' ' HB3' ' A' ' 95' ' ' ASP . 4.2 mtpm? -132.96 133.51 43.28 Favored 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 105.25 -2.13 . . . . 0.0 105.25 -179.108 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.437 ' HB ' ' O ' ' A' ' 12' ' ' ALA . 3.8 mp -91.72 119.96 39.98 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.361 0 N-CA-C 105.803 -1.925 . . . . 0.0 105.803 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.579 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 5.5 mm-40 -112.53 133.5 54.56 Favored 'General case' 0 C--N 1.294 -1.817 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.067 -171.225 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.5 m -110.94 125.62 68.28 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 174.434 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -114.01 131.33 56.39 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -178.402 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.466 ' CE1' ' HB2' ' A' ' 81' ' ' ARG . 60.3 t80 -102.47 122.58 44.6 Favored 'General case' 0 N--CA 1.421 -1.878 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.382 178.957 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.412 ' CG ' ' H ' ' A' ' 78' ' ' LYS . 14.9 t70 -94.52 -173.51 3.06 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-N 114.925 -1.034 . . . . 0.0 108.442 178.908 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.412 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 82.1 mttt -81.58 17.03 1.52 Allowed 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 125.002 1.321 . . . . 0.0 111.184 -173.882 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -107.19 -121.91 4.79 Favored Glycine 0 N--CA 1.44 -1.083 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.377 -178.446 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -110.81 149.14 30.99 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 122.509 0.323 . . . . 0.0 110.638 -176.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.466 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . 43.2 ttp180 -110.23 -8.16 14.78 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.577 0.703 . . . . 0.0 109.172 177.124 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 2.1 p . . . . . 0 C--N 1.316 -0.856 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.515 -179.651 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ARG . . . . . 0.441 ' CG ' ' HB2' ' A' ' 35' ' ' ARG . 9.8 tpp180 . . . . . 0 N--CA 1.426 -1.659 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.23 146.27 23.73 Favored Glycine 0 N--CA 1.439 -1.159 0 N-CA-C 109.821 -1.312 . . . . 0.0 109.821 177.147 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.432 ' HB3' HD21 ' A' ' 37' ' ' LEU . 93.0 mt -126.64 119.91 28.2 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.05 161.65 40.39 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.766 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.443 ' CZ ' ' HB3' ' A' ' 100' ' ' ASN . 29.9 t80 -91.89 123.45 35.28 Favored 'General case' 0 N--CA 1.412 -2.369 0 N-CA-C 105.469 -2.049 . . . . 0.0 105.469 174.842 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 38.1 mm -99.44 130.84 47.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 CA-C-O 120.879 0.371 . . . . 0.0 110.736 -172.073 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.579 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 87.4 m-85 -122.09 147.59 45.93 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 174.519 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.13 98.95 8.59 Favored 'General case' 0 C--N 1.284 -2.241 0 N-CA-C 105.342 -2.095 . . . . 0.0 105.342 171.747 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.462 ' HB3' ' H ' ' A' ' 71' ' ' LYS . 4.2 p30 45.41 31.24 0.83 Allowed 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 125.045 1.338 . . . . 0.0 113.608 -175.502 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.49 -5.41 35.36 Favored Glycine 0 CA--C 1.524 0.633 0 CA-C-N 115.949 -0.568 . . . . 0.0 113.712 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -83.26 125.02 31.14 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 173.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 1.5 mpt? -67.4 102.85 1.17 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 117.868 0.303 . . . . 0.0 110.26 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 49.5 t -66.5 -38.69 82.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.599 HD22 HG23 ' A' ' 39' ' ' VAL . 6.7 t-20 -57.78 -51.68 68.59 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.438 176.706 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.493 ' O ' ' HG3' ' A' ' 105' ' ' ARG . 35.1 tt0 -69.96 -34.94 74.07 Favored 'General case' 0 C--O 1.204 -1.32 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.696 -174.9 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.49 -43.3 88.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.925 0.393 . . . . 0.0 110.293 177.653 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.7 mt -65.33 -42.81 92.53 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.757 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 100' ' ' ASN . 84.2 t -65.48 -41.48 91.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.346 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 101' ' ' GLU . 17.1 mtm180 -70.29 -16.39 63.01 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.082 0.553 . . . . 0.0 111.701 -178.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -105.56 1.85 27.84 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.586 176.1 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 59.55 44.37 96.84 Favored Glycine 0 C--O 1.219 -0.795 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.525 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.3 mt -106.27 10.4 31.75 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -177.124 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -165.5 170.33 14.51 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 178.625 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.406 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 96.8 mttt -116.57 147.12 42.14 Favored 'General case' 0 CA--C 1.491 -1.296 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 175.021 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.543 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 99.1 t -73.79 133.85 30.81 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 C-N-CA 120.122 -0.631 . . . . 0.0 109.744 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.644 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 179.475 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 134' ' ' HIS . . . . . 0.502 ' O ' ' HG ' ' B' ' 138' ' ' LEU . 64.4 m-70 . . . . . 0 N--CA 1.479 0.977 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -37.44 -63.67 0.43 Allowed 'General case' 0 C--O 1.205 -1.253 0 C-N-CA 126.279 1.832 . . . . 0.0 113.907 -174.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -61.96 -33.55 74.49 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -170.764 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 88.0 mt -70.47 -47.25 61.48 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 122.052 0.929 . . . . 0.0 108.775 176.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 138' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' B' ' 134' ' ' HIS . 62.5 mt -67.79 -41.18 83.58 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 114.387 -1.279 . . . . 0.0 111.763 -176.658 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -75.44 -19.73 59.29 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.216 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 17.3 tppt? -72.6 -38.89 67.68 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 173.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 45.2 m -66.81 -35.45 80.09 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.404 174.414 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.555 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 24.6 tt0 -62.68 -54.08 44.81 Favored 'General case' 0 C--O 1.205 -1.24 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.245 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.56 -35.92 66.25 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 123.19 0.596 . . . . 0.0 111.226 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 144' ' ' GLN . . . . . 0.418 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 8.8 tp60 -70.97 -47.85 56.65 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.952 176.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -65.07 -35.41 81.07 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 122.45 0.3 . . . . 0.0 111.66 -178.138 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 146' ' ' LYS . . . . . 0.555 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 82.6 mttt -60.88 -46.18 91.63 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 177.009 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -62.53 -35.52 79.67 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.082 -177.345 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 148' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 43.7 mm-40 -88.86 -6.43 57.33 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-N 114.592 -1.185 . . . . 0.0 112.41 -174.173 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 149' ' ' LYS . . . . . 0.564 ' O ' ' HB2' ' B' ' 154' ' ' SER . 35.4 mmtp 53.61 54.35 10.13 Favored 'General case' 0 CA--C 1.512 -0.497 0 O-C-N 123.964 0.79 . . . . 0.0 110.927 -178.593 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 95.6 mt -82.92 114.76 21.43 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.783 -179.311 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 51.31 -93.28 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.475 1.51 . . . . 0.0 114.734 176.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 12.1 mt -64.38 -36.19 76.47 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.851 0 C-N-CA 122.605 0.362 . . . . 0.0 111.748 -179.095 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 153' ' ' TRP . . . . . 0.406 ' CH2' ' HG2' ' A' ' 110' ' ' LYS . 60.3 m95 -67.97 -23.14 65.01 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.043 0.449 . . . . 0.0 110.363 -179.284 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 154' ' ' SER . . . . . 0.564 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 10.1 t -85.79 42.98 1.0 Allowed 'General case' 0 N--CA 1.442 -0.871 0 CA-C-O 122.116 0.96 . . . . 0.0 108.792 179.227 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -74.22 -22.66 59.26 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 114.684 -1.143 . . . . 0.0 108.41 172.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 19.5 t70 . . . . . 0 N--CA 1.432 -1.355 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 175.305 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 23.0 m170 . . . . . 0 N--CA 1.44 -0.944 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.421 ' HA ' ' O ' ' A' ' 74' ' ' VAL . 36.6 ttmt -121.01 135.16 55.28 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 114.377 -1.283 . . . . 0.0 109.094 -179.122 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -138.95 157.35 71.71 Favored Pre-proline 0 C--N 1.296 -1.735 0 C-N-CA 122.504 0.322 . . . . 0.0 110.848 177.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -71.18 148.09 55.24 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 122.358 2.039 . . . . 0.0 112.75 -178.665 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.24 161.51 37.25 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.951 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.433 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 20.4 m -109.78 145.36 36.81 Favored 'General case' 0 C--N 1.293 -1.891 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 176.276 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.7 tp -83.95 134.98 34.64 Favored 'General case' 0 C--N 1.295 -1.769 0 C-N-CA 120.089 -0.645 . . . . 0.0 109.752 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 41.3 mm -91.79 -57.58 4.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 171.09 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -168.84 141.73 2.82 Favored 'General case' 0 N--CA 1.416 -2.171 0 CA-C-N 115.164 -0.925 . . . . 0.0 108.899 178.145 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.484 ' HA ' HG23 ' A' ' 23' ' ' VAL . . . -99.93 110.1 22.44 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 171.603 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.6 mp -89.54 -53.79 8.74 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-O 121.376 0.608 . . . . 0.0 110.034 -174.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -129.99 169.08 15.72 Favored 'General case' 0 C--N 1.291 -1.947 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -175.595 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.31 -29.48 73.27 Favored Glycine 0 C--N 1.306 -1.104 0 O-C-N 123.987 0.805 . . . . 0.0 111.775 178.616 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.575 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 2.3 m-20 -96.99 -46.99 5.98 Favored 'General case' 0 CA--C 1.492 -1.274 0 CA-C-O 120.952 0.406 . . . . 0.0 110.866 177.735 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.6 m -96.72 113.33 24.87 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-O 121.472 0.653 . . . . 0.0 111.84 -171.434 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.484 HG23 ' HA ' ' A' ' 17' ' ' ALA . 5.8 p -135.07 144.76 33.56 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.182 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.109 -177.44 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -106.98 123.01 47.57 Favored 'General case' 0 CA--C 1.49 -1.353 0 O-C-N 121.63 -0.669 . . . . 0.0 111.524 -179.515 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.9 mp -125.82 151.03 47.34 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.987 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.497 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 25.9 ttt -117.52 106.26 12.96 Favored 'General case' 0 C--N 1.289 -2.054 0 CA-C-N 114.911 -1.041 . . . . 0.0 108.871 -178.624 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -113.39 123.66 50.6 Favored 'General case' 0 C--N 1.287 -2.131 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 96.4 mttt 58.79 27.73 16.43 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 123.399 0.679 . . . . 0.0 111.803 177.607 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.444 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 93.82 6.6 61.99 Favored Glycine 0 N--CA 1.44 -1.062 0 C-N-CA 120.83 -0.7 . . . . 0.0 113.104 179.385 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.497 ' O ' ' HA ' ' A' ' 26' ' ' MET . 17.9 mm-40 -107.3 98.37 22.64 Favored Pre-proline 0 C--N 1.318 -0.775 0 CA-C-N 116.85 0.325 . . . . 0.0 110.562 178.581 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 6.0 Cg_exo -80.76 97.16 1.0 Allowed 'Trans proline' 0 C--O 1.243 0.742 0 C-N-CA 122.98 2.453 . . . . 0.0 110.565 174.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 49.8 ttm -112.87 145.62 40.37 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.387 -176.652 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 32.1 m -82.16 120.08 24.87 Favored 'General case' 0 N--CA 1.42 -1.957 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 174.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.431 ' HA ' ' O ' ' A' ' 88' ' ' GLY . 74.9 m-85 -114.38 154.2 28.51 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-O 121.399 0.619 . . . . 0.0 111.682 -177.069 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.575 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 37.8 mtp180 -118.23 148.09 42.75 Favored 'General case' 0 C--N 1.288 -2.109 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.058 164.079 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.419 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 5.2 mp -77.66 123.32 26.5 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.668 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 68.1 mt -63.94 142.04 58.55 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.432 176.11 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.637 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 67.3 mt 72.65 10.56 5.59 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.336 1.055 . . . . 0.0 112.503 177.905 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 97.5 t -113.49 140.85 31.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.223 0.535 . . . . 0.0 111.979 -176.598 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.4 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 17.8 t70 -135.1 107.52 7.31 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 172.268 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 82.3 p . . . . . 0 CA--C 1.571 1.772 0 N-CA-C 116.555 2.058 . . . . 0.0 116.555 179.29 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.423 0 CA-C-O 119.341 -0.7 . . . . 0.0 112.611 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -53.89 -34.98 78.33 Favored 'Trans proline' 0 C--N 1.368 1.601 0 C-N-CA 123.256 2.637 . . . . 0.0 113.764 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -66.4 -38.3 87.19 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.29 0.567 . . . . 0.0 109.628 -179.317 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.92 -48.44 63.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.871 177.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.453 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 19.1 m -57.71 -39.61 77.62 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.024 179.179 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.03 -34.88 78.51 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.142 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -69.63 -41.93 74.98 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 -177.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.463 ' O ' HG22 ' A' ' 66' ' ' VAL . 28.8 m -59.4 -47.99 83.33 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 175.729 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 59' ' ' SER . 60.8 mtpt -55.23 -51.89 65.14 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.682 178.414 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -64.22 -34.17 77.47 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -177.215 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 20.1 mmt -70.36 -47.93 58.7 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.659 177.031 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.463 HG22 ' O ' ' A' ' 62' ' ' THR . 33.9 m -75.18 -36.53 37.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -176.573 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -75.28 -23.94 57.49 Favored 'General case' 0 C--O 1.24 0.583 0 O-C-N 122.111 -0.368 . . . . 0.0 111.904 -179.658 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -78.98 -40.32 31.99 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.057 175.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -56.27 132.66 51.36 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 123.688 0.795 . . . . 0.0 112.329 -177.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -75.02 -50.33 16.87 Favored 'General case' 0 CA--C 1.501 -0.937 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 175.145 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -104.3 119.91 40.02 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.954 -178.497 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 69.4 mt -102.3 128.94 54.5 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.664 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 175.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.55 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 23.2 mt-10 -122.5 139.16 54.2 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 120.504 0.192 . . . . 0.0 110.758 -176.201 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.421 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 18.1 m -113.73 128.69 70.5 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 175.062 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -122.62 115.71 22.59 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.0 p90 -91.56 124.89 36.06 Favored 'General case' 0 N--CA 1.417 -2.12 0 CA-C-O 121.409 0.623 . . . . 0.0 111.323 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ASP . . . . . 0.401 ' CG ' ' H ' ' A' ' 78' ' ' LYS . 17.1 t70 -91.67 176.8 6.41 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.255 -176.025 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.438 ' H ' ' HG2' ' A' ' 78' ' ' LYS . 18.0 pttm -82.14 -5.65 58.6 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 126.56 1.944 . . . . 0.0 112.109 -177.461 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -81.77 -138.45 2.63 Favored Glycine 0 C--O 1.246 0.87 0 C-N-CA 120.584 -0.817 . . . . 0.0 111.468 176.599 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -74.22 120.84 20.34 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 176.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -108.56 -8.18 15.56 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 121.82 0.819 . . . . 0.0 109.141 -176.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 10.0 p . . . . . 0 N--CA 1.438 -1.039 0 CA-C-N 114.986 -1.007 . . . . 0.0 110.331 179.317 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.1 mtm180 . . . . . 0 CA--C 1.484 -1.568 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLY . . . . . 0.431 ' O ' ' HA ' ' A' ' 34' ' ' PHE . . . -93.42 149.72 19.58 Favored Glycine 0 N--CA 1.42 -2.373 0 N-CA-C 109.29 -1.524 . . . . 0.0 109.29 176.182 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 89.3 mt -123.52 120.35 32.64 Favored 'General case' 0 C--N 1.287 -2.116 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 179.04 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -149.98 167.44 26.69 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 120.832 0.349 . . . . 0.0 110.489 -176.668 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.505 ' CZ ' ' HB2' ' A' ' 100' ' ' ASN . 5.4 t80 -94.25 133.02 38.22 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 105.618 -1.993 . . . . 0.0 105.618 174.383 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 44.4 mm -103.32 125.39 57.82 Favored 'Isoleucine or valine' 0 C--O 1.249 1.064 0 CA-C-O 120.919 0.39 . . . . 0.0 110.315 -175.66 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.55 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 61.8 m-85 -109.63 133.16 53.43 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 177.088 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.53 103.44 12.96 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -178.559 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.8 t70 46.98 40.46 9.38 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 125.69 1.596 . . . . 0.0 111.944 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.54 -25.0 24.38 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 115.034 -0.985 . . . . 0.0 113.584 177.407 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -97.09 160.46 14.33 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 117.081 0.44 . . . . 0.0 110.682 -176.414 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' MET . . . . . 0.49 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 3.8 mpp? -92.47 116.18 28.75 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -174.371 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 49.1 t -73.05 -46.8 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 120.817 0.342 . . . . 0.0 110.697 -178.73 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ASN . . . . . 0.505 ' HB2' ' CZ ' ' A' ' 91' ' ' TYR . 1.4 m-20 -54.43 -50.92 66.49 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.025 -0.988 . . . . 0.0 112.25 -173.474 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.488 ' HB3' HD22 ' B' ' 138' ' ' LEU . 9.8 pt-20 -75.22 -27.34 59.51 Favored 'General case' 0 N--CA 1.426 -1.646 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -179.873 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.87 -39.78 95.5 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.038 0.447 . . . . 0.0 110.131 176.351 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 82.8 mt -56.72 -45.91 81.63 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.5 175.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 46.7 t -73.14 -35.4 47.54 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.109 -178.661 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 13.2 mmm180 -55.92 -41.47 74.61 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.983 0.913 . . . . 0.0 111.862 176.32 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -87.17 1.42 53.1 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.041 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.514 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 70.22 37.33 71.66 Favored Glycine 0 C--O 1.222 -0.595 0 C-N-CA 121.536 -0.364 . . . . 0.0 112.631 179.087 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 83.6 mt -106.61 -8.85 16.78 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-O 121.01 0.433 . . . . 0.0 110.733 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -147.47 154.28 40.59 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.279 -178.19 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.4 ' HB2' ' HB3' ' A' ' 40' ' ' ASP . 94.9 mttt -105.3 166.23 10.56 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.601 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.411 HG12 ' OE2' ' B' ' 142' ' ' GLU . 7.3 p -86.99 122.61 39.12 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 CA-C-O 121.762 0.791 . . . . 0.0 110.914 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.637 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . . . . . . 0 C--N 1.295 -1.787 0 N-CA-C 107.135 -1.431 . . . . 0.0 107.135 174.194 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 134' ' ' HIS . . . . . 0.432 ' O ' HD23 ' B' ' 138' ' ' LEU . 11.2 m-70 . . . . . 0 C--O 1.208 -1.114 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.464 ' OE2' ' HD2' ' B' ' 139' ' ' ARG . 2.3 tm-20 -57.61 -42.59 83.59 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.451 -1.25 . . . . 0.0 112.459 -172.789 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -69.81 -42.59 73.49 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-O 121.466 0.651 . . . . 0.0 109.449 -178.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 95.3 mt -60.95 -45.56 94.22 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.317 178.175 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 138' ' ' LEU . . . . . 0.488 HD22 ' HB3' ' A' ' 101' ' ' GLU . 4.3 mm? -60.38 -47.41 86.17 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.743 176.909 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 139' ' ' ARG . . . . . 0.464 ' HD2' ' OE2' ' B' ' 135' ' ' GLU . 53.3 mtt180 -62.62 -41.08 98.8 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 178.855 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -64.48 -35.47 81.05 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.553 176.49 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 30.7 m -68.35 -41.9 80.04 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.228 177.372 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.525 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 38.5 tt0 -64.56 -50.66 66.42 Favored 'General case' 0 CA--C 1.495 -1.162 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.146 179.513 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 143' ' ' ALA . . . . . 0.519 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -56.64 -39.22 73.3 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.857 0.723 . . . . 0.0 110.896 -179.097 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 144' ' ' GLN . . . . . 0.485 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 35.4 tt0 -65.1 -47.67 76.39 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.689 178.239 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -63.62 -33.48 75.71 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.02 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 146' ' ' LYS . . . . . 0.545 ' HA ' ' CG ' ' B' ' 153' ' ' TRP . 79.8 mttt -62.4 -45.76 91.68 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.216 177.226 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 147' ' ' LYS . . . . . 0.519 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 34.7 mmtp -66.71 -44.97 80.19 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.602 -178.418 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 148' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 22.5 mm-40 -75.43 -10.21 59.25 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.323 -176.722 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp 58.26 48.94 11.88 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.013 0.925 . . . . 0.0 110.588 -178.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 150' ' ' LEU . . . . . 0.425 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 95.7 mt -86.02 115.39 23.59 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.277 -177.033 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 151' ' ' ASN . . . . . 0.514 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 40.3 m-80 53.67 -81.47 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 126.107 1.763 . . . . 0.0 113.019 178.248 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 152' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 107' ' ' GLY . 67.3 mt -56.85 -60.35 2.08 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.328 0 C-N-CA 124.183 0.993 . . . . 0.0 110.426 -178.29 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 153' ' ' TRP . . . . . 0.545 ' CG ' ' HA ' ' B' ' 146' ' ' LYS . 62.4 m95 -71.62 -7.83 50.26 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 114.291 -1.322 . . . . 0.0 113.414 -166.683 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 27.1 t -74.93 -0.67 19.42 Favored 'General case' 0 CA--C 1.567 1.633 0 CA-C-O 121.134 0.492 . . . . 0.0 109.808 174.82 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -64.39 -17.64 63.94 Favored 'General case' 0 C--O 1.25 1.1 0 C-N-CA 124.757 1.223 . . . . 0.0 111.023 173.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 N--CA 1.445 -0.689 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.146 -178.117 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 8' ' ' HIS . . . . . 0.563 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 46.3 m-70 . . . . . 0 C--O 1.212 -0.911 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -113.8 117.68 32.15 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 120.685 0.279 . . . . 0.0 111.239 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -139.01 157.72 70.95 Favored Pre-proline 0 C--N 1.305 -1.344 0 CA-C-O 119.441 -0.314 . . . . 0.0 110.993 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -78.92 147.98 21.76 Favored 'Trans proline' 0 C--O 1.243 0.766 0 C-N-CA 121.998 1.799 . . . . 0.0 111.431 178.2 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -136.13 156.85 48.09 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 178.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.457 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 87.8 m -94.7 132.83 39.02 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.72 -178.836 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.497 ' HB2' HD12 ' A' ' 72' ' ' ILE . 60.7 tp -77.04 127.17 32.2 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 120.578 0.228 . . . . 0.0 111.026 -179.101 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 51.0 mm -98.79 -54.7 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 N-CA-C 107.375 -1.342 . . . . 0.0 107.375 172.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -170.67 157.15 5.56 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.065 179.46 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.423 ' HB2' HG21 ' A' ' 66' ' ' VAL . . . -111.04 120.61 42.94 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 174.675 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.45 ' HB ' ' O ' ' A' ' 22' ' ' THR . 67.0 mt -89.47 -64.12 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -175.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -129.14 -164.46 1.4 Allowed 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -177.272 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -88.64 48.33 3.53 Favored Glycine 0 CA--C 1.507 -0.452 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.334 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.556 ' HB3' HG23 ' A' ' 41' ' ' THR . 1.9 t70 178.5 -61.91 0.01 OUTLIER 'General case' 0 CA--C 1.496 -1.123 0 C-N-CA 125.565 1.546 . . . . 0.0 108.534 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.45 ' O ' ' HB ' ' A' ' 18' ' ' ILE . 24.1 m -76.58 106.71 8.39 Favored 'General case' 0 N--CA 1.404 -2.752 0 CA-C-N 114.094 -1.412 . . . . 0.0 109.995 -174.734 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 24.6 m -131.63 164.54 34.24 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 -179.22 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -121.7 114.27 20.89 Favored 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 118.514 0.597 . . . . 0.0 109.812 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.502 HD21 HG21 ' A' ' 72' ' ' ILE . 7.4 mp -126.32 159.18 33.86 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-O 121.217 0.532 . . . . 0.0 111.517 177.832 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.457 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 57.5 ttp -114.77 117.08 29.77 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.523 179.252 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.5 p90 -122.91 131.65 53.83 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.181 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 54.2 mttp 55.97 27.44 11.21 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.7 0.8 . . . . 0.0 112.514 -176.711 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 88.97 3.84 75.91 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 121.077 -0.582 . . . . 0.0 112.89 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.414 ' O ' ' HA ' ' A' ' 26' ' ' MET . 14.7 mm100 -106.29 104.96 52.52 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 116.842 0.321 . . . . 0.0 110.744 -179.058 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -78.98 107.37 2.23 Favored 'Trans proline' 0 C--O 1.247 0.962 0 C-N-CA 122.696 2.264 . . . . 0.0 110.264 175.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 65.5 mtt -127.32 154.13 45.32 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-O 121.137 0.494 . . . . 0.0 110.783 -177.674 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.9 m -81.2 136.62 35.87 Favored 'General case' 0 N--CA 1.42 -1.947 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 175.66 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.455 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 39.2 m-85 -105.05 149.05 26.13 Favored 'General case' 0 C--N 1.277 -2.568 0 CA-C-O 121.319 0.58 . . . . 0.0 112.257 -178.125 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.536 HH12 ' HA ' ' A' ' 40' ' ' ASP . 12.7 tpt85 -130.63 119.21 22.12 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 104.285 -2.487 . . . . 0.0 104.285 176.679 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.424 ' CD2' HG12 ' A' ' 92' ' ' ILE . 26.5 mt -83.98 137.76 33.46 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-O 122.142 0.972 . . . . 0.0 112.437 -169.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.487 HD21 ' HB3' ' A' ' 89' ' ' LEU . 98.5 mt -73.38 130.8 40.94 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 114.646 -1.161 . . . . 0.0 110.205 178.449 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.507 HD12 ' OH ' ' A' ' 91' ' ' TYR . 87.3 mt 73.78 7.41 4.95 Favored 'General case' 0 C--O 1.212 -0.869 0 C-N-CA 124.464 1.106 . . . . 0.0 113.438 176.106 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.7 t -125.01 125.66 69.9 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.716 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 175.56 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.536 ' HA ' HH12 ' A' ' 35' ' ' ARG . 11.0 t70 -105.58 140.68 38.29 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 179.405 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.556 HG23 ' HB3' ' A' ' 21' ' ' ASP . 1.0 OUTLIER . . . . . 0 N--CA 1.425 -1.693 0 O-C-N 124.254 0.971 . . . . 0.0 110.399 -171.387 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.853 0 CA-C-O 118.822 -0.988 . . . . 0.0 113.85 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -50.84 -50.56 13.42 Favored 'Trans proline' 0 C--N 1.37 1.676 0 C-N-CA 122.735 2.29 . . . . 0.0 112.684 176.152 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -63.07 -42.78 99.73 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.22 -45.59 90.93 Favored 'General case' 0 C--O 1.243 0.761 0 CA-C-O 121.066 0.46 . . . . 0.0 111.353 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.45 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 36.1 p -70.17 -41.91 73.17 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.365 -179.115 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.48 -42.1 92.59 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 122.199 0.2 . . . . 0.0 111.046 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -55.47 -43.9 75.97 Favored 'General case' 0 C--O 1.242 0.686 0 C-N-CA 122.715 0.406 . . . . 0.0 109.929 178.052 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.8 m -63.95 -46.3 85.31 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.033 177.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' A' ' 59' ' ' SER . 49.7 mttp -57.39 -54.93 41.28 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.227 -179.582 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.98 -29.69 70.83 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -177.855 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.574 ' SD ' HG22 ' A' ' 99' ' ' VAL . 49.6 ttm -72.64 -46.12 55.59 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 119.621 -0.831 . . . . 0.0 111.194 179.367 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.423 HG21 ' HB2' ' A' ' 17' ' ' ALA . 33.8 m -73.39 -30.11 29.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 C-N-CA 120.338 -0.545 . . . . 0.0 112.172 -177.862 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -76.02 -23.55 55.18 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 120.549 0.214 . . . . 0.0 111.364 177.396 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -77.53 -31.84 53.61 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.492 0.663 . . . . 0.0 109.829 177.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.746 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -65.89 157.74 29.79 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 114.913 -1.04 . . . . 0.0 112.32 -178.288 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.48 ' N ' ' HD3' ' A' ' 70' ' ' LYS . 2.3 mppt? -110.42 -39.93 4.79 Favored 'General case' 0 C--N 1.291 -1.95 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 175.397 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.6 mtmt -120.75 121.81 39.02 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 114.748 -1.115 . . . . 0.0 108.506 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.502 HG21 HD21 ' A' ' 25' ' ' LEU . 61.0 mt -113.16 135.48 52.52 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.147 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 178.268 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.561 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 33.8 mm-40 -112.45 141.4 46.23 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -179.007 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.3 m -114.75 127.31 72.32 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.076 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 174.083 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.563 ' HA ' ' O ' ' A' ' 8' ' ' HIS . 40.2 tt0 -121.83 117.23 26.01 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.477 -179.494 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -95.84 143.41 27.08 Favored 'General case' 0 C--O 1.254 1.324 0 C-N-CA 123.781 0.832 . . . . 0.0 109.437 -177.346 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -87.98 -174.26 4.62 Favored 'General case' 0 C--O 1.253 1.255 0 CA-C-O 120.96 0.41 . . . . 0.0 111.117 -173.787 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.457 ' HE2' ' HA ' ' A' ' 78' ' ' LYS . 9.3 mmpt? -72.95 -21.06 60.93 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 124.087 0.955 . . . . 0.0 112.618 -170.792 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -99.22 -80.7 1.55 Allowed Glycine 0 C--N 1.314 -0.664 0 C-N-CA 119.303 -1.427 . . . . 0.0 114.882 -170.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -122.69 128.39 50.51 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 122.401 -0.47 . . . . 0.0 110.012 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.424 ' HD2' ' N ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -103.4 -4.67 23.81 Favored 'General case' 0 N--CA 1.427 -1.578 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.219 -173.185 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 21.9 p . . . . . 0 C--N 1.307 -1.257 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -179.188 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 . . . . . 0 N--CA 1.439 -1.004 0 CA-C-O 120.507 0.194 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -100.44 137.7 13.41 Favored Glycine 0 N--CA 1.434 -1.438 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 174.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.487 ' HB3' HD21 ' A' ' 37' ' ' LEU . 95.3 mt -100.98 107.05 18.42 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 -178.806 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -154.38 168.06 27.91 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.437 0.637 . . . . 0.0 112.542 -175.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.507 ' OH ' HD12 ' A' ' 38' ' ' LEU . 2.5 m-85 -94.59 134.95 36.61 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.396 -1.274 . . . . 0.0 108.571 170.892 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.424 HG12 ' CD2' ' A' ' 36' ' ' LEU . 47.8 mm -99.89 126.09 53.42 Favored 'Isoleucine or valine' 0 C--O 1.254 1.328 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 175.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.561 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 31.1 m-85 -120.48 131.75 54.88 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 174.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.746 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -106.28 98.49 8.16 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 177.802 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.479 1.1 p30 31.95 57.32 0.34 Allowed 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 116.214 1.931 . . . . 0.0 116.214 -176.617 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 103.84 -21.95 36.83 Favored Glycine 0 N--CA 1.427 -1.925 0 CA-C-N 114.135 -1.393 . . . . 0.0 113.77 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -89.56 123.73 33.9 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -178.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' MET . . . . . 0.499 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 4.5 mpp? -84.32 101.6 12.06 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.255 178.225 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.574 HG22 ' SD ' ' A' ' 65' ' ' MET . 37.9 t -62.87 -46.06 97.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -54.86 -47.81 73.72 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 113.812 -1.54 . . . . 0.0 110.893 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.42 ' HB3' ' HB2' ' A' ' 98' ' ' MET . 13.7 tp10 -62.09 -50.64 71.13 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.734 0.814 . . . . 0.0 109.994 179.27 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.63 -41.14 85.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.582 -0.735 . . . . 0.0 112.192 -176.385 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 99' ' ' VAL . 95.8 mt -58.4 -46.34 86.6 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-O 120.738 0.304 . . . . 0.0 111.814 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.8 t -73.29 -43.87 56.08 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-O 121.191 0.52 . . . . 0.0 109.99 178.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 21.8 tpt180 -60.95 -40.32 92.87 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.951 -176.636 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -84.0 -5.45 59.23 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.426 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 68.93 38.68 85.11 Favored Glycine 0 CA--C 1.503 -0.661 0 N-CA-C 111.575 -0.61 . . . . 0.0 111.575 -178.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.8 mt -94.27 -22.07 18.62 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -140.57 174.43 10.52 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 115.284 -0.871 . . . . 0.0 108.842 -177.423 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -111.54 166.08 11.45 Favored 'General case' 0 C--N 1.309 -1.166 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.492 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 73.6 t -83.89 127.07 40.12 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.237 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.076 177.395 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.496 -1.133 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -179.902 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 3.0 p80 . . . . . 0 C--O 1.247 0.93 0 CA-C-O 121.117 0.484 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 135' ' ' GLU . . . . . 0.427 ' HA ' ' CD1' ' A' ' 38' ' ' LEU . 36.3 tt0 -58.56 -44.48 89.72 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.37 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -61.47 -34.17 75.01 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.396 -176.315 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 82.9 mt -63.3 -50.97 68.0 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-O 121.126 0.488 . . . . 0.0 110.002 179.28 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 138' ' ' LEU . . . . . 0.41 ' HA ' HD23 ' B' ' 138' ' ' LEU . 24.7 mt -69.92 -34.42 73.45 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 178.729 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 139' ' ' ARG . . . . . 0.417 ' HG2' HG11 ' A' ' 111' ' ' VAL . 15.4 mtp85 -69.23 -31.49 70.09 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 179.03 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -77.26 -22.66 51.78 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.359 0.599 . . . . 0.0 111.138 174.728 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.1 m -76.4 -38.09 56.18 Favored 'General case' 0 N--CA 1.427 -1.605 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 173.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.571 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 36.4 tt0 -60.48 -42.98 97.37 Favored 'General case' 0 C--O 1.209 -1.069 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 173.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.96 -43.37 66.3 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 123.451 0.7 . . . . 0.0 111.452 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 144' ' ' GLN . . . . . 0.496 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 75.3 mt-30 -70.7 -48.36 55.07 Favored 'General case' 0 CA--C 1.497 -1.084 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.154 177.374 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -57.91 -38.85 76.61 Favored 'General case' 0 C--O 1.244 0.777 0 O-C-N 123.945 0.778 . . . . 0.0 112.038 -176.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 146' ' ' LYS . . . . . 0.571 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 89.4 mttt -57.62 -51.72 68.37 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 175.874 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -64.13 -45.15 89.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.109 -178.517 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 148' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 23.3 mm-40 -64.14 -14.08 52.51 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 124.093 0.957 . . . . 0.0 113.035 -178.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 149' ' ' LYS . . . . . 0.48 ' O ' ' HB2' ' B' ' 154' ' ' SER . 0.0 OUTLIER 62.39 40.95 10.57 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -178.932 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 150' ' ' LEU . . . . . 0.412 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 90.5 mt -76.41 109.7 10.35 Favored 'General case' 0 C--N 1.315 -0.918 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.238 -175.75 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 151' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 2.7 m-20 46.1 -88.3 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.415 1.886 . . . . 0.0 114.224 179.492 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 13.1 tt -68.19 -27.63 37.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 -176.696 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 153' ' ' TRP . . . . . 0.522 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 63.9 m95 -80.8 -7.25 59.36 Favored 'General case' 0 N--CA 1.435 -1.198 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.545 -178.143 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 154' ' ' SER . . . . . 0.48 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 22.5 t -81.6 13.38 3.14 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 120.985 0.421 . . . . 0.0 110.052 177.058 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -81.96 -20.81 37.8 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 172.682 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 156' ' ' ASP . . . . . 0.475 ' HB3' ' HE2' ' B' ' 149' ' ' LYS . 14.2 t70 . . . . . 0 N--CA 1.443 -0.82 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.27 -176.323 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 . . . . . 0 N--CA 1.428 -1.531 0 CA-C-O 120.435 0.159 . . . . 0.0 111.058 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.432 ' HA ' ' O ' ' A' ' 74' ' ' VAL . 43.1 mtmt -65.29 143.98 57.43 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 124.481 1.113 . . . . 0.0 112.562 -172.186 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -126.86 158.09 69.53 Favored Pre-proline 0 C--N 1.297 -1.71 0 N-CA-C 105.31 -2.107 . . . . 0.0 105.31 167.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -74.34 147.34 36.91 Favored 'Trans proline' 0 C--N 1.322 -0.817 0 C-N-CA 122.163 1.909 . . . . 0.0 112.096 -178.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.01 155.47 47.96 Favored 'General case' 0 N--CA 1.428 -1.566 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.886 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.429 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 37.5 m -103.19 123.07 46.02 Favored 'General case' 0 N--CA 1.415 -2.195 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.27 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 49.1 tp -69.29 124.76 24.69 Favored 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.4 mm -88.15 -52.33 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 N-CA-C 107.159 -1.422 . . . . 0.0 107.159 174.563 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -174.87 161.92 3.1 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 176.154 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -103.55 147.52 27.08 Favored 'General case' 0 C--N 1.285 -2.196 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 174.517 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.0 mp -107.25 -58.08 3.99 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 N-CA-C 107.359 -1.349 . . . . 0.0 107.359 176.077 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -140.91 173.58 11.34 Favored 'General case' 0 CA--C 1.484 -1.562 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.517 178.592 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -82.91 60.63 4.87 Favored Glycine 0 CA--C 1.5 -0.878 0 N-CA-C 108.449 -1.86 . . . . 0.0 108.449 174.27 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.463 ' HB2' ' HB ' ' A' ' 41' ' ' THR . 7.2 t70 -174.86 -56.98 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 124.691 1.196 . . . . 0.0 108.682 -172.791 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 34.8 m -119.04 127.78 53.74 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.966 178.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 15.9 m -135.52 167.57 24.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 C-N-CA 124.356 1.062 . . . . 0.0 109.796 -176.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -121.09 117.88 28.32 Favored 'General case' 0 C--N 1.316 -0.856 0 O-C-N 121.852 -0.53 . . . . 0.0 110.044 -177.877 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.407 ' HB2' ' CD1' ' A' ' 34' ' ' PHE . 7.0 mp -127.92 159.5 34.75 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.473 0.654 . . . . 0.0 111.667 -178.453 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.47 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 57.7 ttp -119.92 111.19 17.63 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 175.047 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.6 p90 -109.91 114.93 28.88 Favored 'General case' 0 C--N 1.293 -1.85 0 C-N-CA 118.709 -1.197 . . . . 0.0 109.962 -177.515 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt 63.28 28.44 15.73 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.736 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.449 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 94.82 2.78 62.67 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 114.868 -1.06 . . . . 0.0 113.072 -178.787 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.47 ' O ' ' HA ' ' A' ' 26' ' ' MET . 1.9 mp0 -99.72 101.97 15.47 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 117.022 0.411 . . . . 0.0 111.488 178.857 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.449 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 4.4 Cg_exo -78.09 113.7 3.46 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.351 2.034 . . . . 0.0 110.828 177.474 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 26.4 mmt -136.25 156.06 49.21 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.954 -178.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.0 m -95.04 112.21 23.94 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 176.901 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.407 ' CD1' ' HB2' ' A' ' 25' ' ' LEU . 60.2 m-85 -95.85 145.07 25.65 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-O 121.526 0.679 . . . . 0.0 112.129 -174.509 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -123.07 117.75 26.14 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 105.464 -2.05 . . . . 0.0 105.464 176.607 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.401 ' HG ' ' CG1' ' A' ' 92' ' ' ILE . 6.7 mp -60.62 116.14 4.15 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 123.945 0.778 . . . . 0.0 112.219 -174.166 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.402 HD21 ' HB3' ' A' ' 89' ' ' LEU . 74.1 mt -70.19 140.35 52.51 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.571 175.723 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.5 mt 76.54 10.07 2.92 Favored 'General case' 0 C--O 1.217 -0.625 0 C-N-CA 125.534 1.534 . . . . 0.0 110.705 -175.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.48 HG13 ' HB1' ' A' ' 109' ' ' ALA . 53.8 t -126.02 138.21 55.29 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.135 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 176.636 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -148.13 106.58 3.77 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.463 ' HB ' ' HB2' ' A' ' 21' ' ' ASP . 3.3 m . . . . . 0 CA--C 1.598 2.821 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 175.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 2.266 0 CA-C-O 119.173 -0.793 . . . . 0.0 114.429 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -64.83 -25.85 60.16 Favored 'Trans proline' 0 C--N 1.373 1.82 0 CA-C-N 120.488 2.144 . . . . 0.0 112.379 178.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -80.06 -28.15 39.26 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.581 -177.596 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.19 -48.06 81.71 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 174.757 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.408 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 14.6 m -62.84 -34.54 77.56 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.21 177.767 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.46 -46.9 81.11 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.893 0.378 . . . . 0.0 110.056 177.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -60.82 -41.63 96.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.913 177.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.514 ' O ' HG22 ' A' ' 66' ' ' VAL . 54.2 m -58.38 -48.63 79.99 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.127 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 59' ' ' SER . 56.2 mtpt -56.37 -51.84 66.82 Favored 'General case' 0 CA--C 1.509 -0.61 0 O-C-N 123.601 0.563 . . . . 0.0 110.734 178.641 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -58.74 -39.76 81.84 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.213 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 13.2 tpt -69.9 -47.73 61.37 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.663 -179.002 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 62' ' ' THR . 35.8 m -77.85 -34.68 19.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 -175.847 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -76.47 -19.49 57.97 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-O 121.027 0.442 . . . . 0.0 110.693 -179.706 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -89.93 -10.02 46.69 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.287 176.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -78.8 133.68 37.04 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 120.904 0.383 . . . . 0.0 111.767 -175.69 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -73.31 -34.13 65.55 Favored 'General case' 0 CA--C 1.502 -0.874 0 CA-C-O 121.439 0.637 . . . . 0.0 111.219 176.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -131.66 123.1 27.11 Favored 'General case' 0 C--N 1.292 -1.899 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 4.4 mp -101.71 121.54 52.79 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.314 0 N-CA-C 104.983 -2.228 . . . . 0.0 104.983 173.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.557 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 24.4 mt-10 -119.08 145.51 45.85 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-O 120.793 0.33 . . . . 0.0 110.904 -173.244 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.432 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 11.0 m -120.96 133.39 67.77 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.759 179.119 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -135.64 134.42 39.23 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.555 ' HB3' ' HG2' ' A' ' 81' ' ' ARG . 89.9 m-85 -95.28 148.03 22.85 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.469 -175.263 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -85.81 163.71 17.99 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 -179.591 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -73.1 -6.05 43.12 Favored 'General case' 0 C--O 1.246 0.887 0 C-N-CA 123.167 0.587 . . . . 0.0 111.955 -178.948 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -96.44 -99.28 1.89 Allowed Glycine 0 N--CA 1.433 -1.542 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 175.313 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 19.5 mp0 -93.52 134.93 35.27 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 121.041 0.448 . . . . 0.0 111.125 -176.082 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.555 ' HG2' ' HB3' ' A' ' 76' ' ' PHE . 55.8 mtt180 -111.67 -27.61 8.46 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.922 175.819 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 16.2 p . . . . . 0 CA--C 1.511 -0.528 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.568 -176.83 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 . . . . . 0 N--CA 1.442 -0.842 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -90.28 121.52 6.23 Favored Glycine 0 N--CA 1.422 -2.254 0 N-CA-C 108.172 -1.971 . . . . 0.0 108.172 173.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.402 ' HB3' HD21 ' A' ' 37' ' ' LEU . 90.4 mt -101.33 107.4 18.74 Favored 'General case' 0 C--N 1.289 -2.023 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 -177.594 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -153.92 167.33 30.09 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.463 -176.248 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -87.31 142.33 27.97 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 173.581 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.401 ' CG1' ' HG ' ' A' ' 36' ' ' LEU . 50.0 mm -108.31 123.32 63.83 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 178.177 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.557 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 17.4 m-85 -115.44 150.5 36.35 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 177.611 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -120.59 99.93 6.83 Favored 'General case' 0 C--N 1.291 -1.956 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 176.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.315 4.4 p-10 44.08 57.91 3.96 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 125.07 1.348 . . . . 0.0 113.638 -177.303 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.16 -23.34 27.45 Favored Glycine 0 N--CA 1.432 -1.601 0 CA-C-N 114.884 -1.053 . . . . 0.0 114.176 178.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -93.16 123.84 36.72 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -177.189 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' MET . . . . . 0.478 ' HG3' ' CB ' ' A' ' 101' ' ' GLU . 25.7 ptp -79.0 116.38 19.27 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-O 121.971 0.891 . . . . 0.0 111.125 -179.672 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 56.3 t -65.17 -31.37 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.599 -175.389 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 25.2 p-10 -65.11 -31.15 72.2 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.871 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.478 ' CB ' ' HG3' ' A' ' 98' ' ' MET . 5.1 tp10 -63.8 -51.47 64.62 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 173.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.46 -45.57 84.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.9 -177.498 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.2 mt -61.66 -41.15 97.13 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.747 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 96.7 t -70.66 -43.18 77.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.749 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 -67.29 -26.63 66.63 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 86.7 mm-40 -93.65 -4.23 51.04 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 120.829 0.347 . . . . 0.0 111.196 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.463 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 66.35 44.13 91.21 Favored Glycine 0 C--O 1.215 -1.082 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.741 -179.051 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 90.9 mt -113.16 7.85 18.05 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-O 121.511 0.672 . . . . 0.0 109.779 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.48 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -159.38 171.04 20.51 Favored 'General case' 0 N--CA 1.427 -1.588 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -179.576 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.563 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 95.3 mttt -120.97 161.47 21.55 Favored 'General case' 0 N--CA 1.424 -1.734 0 N-CA-C 104.921 -2.251 . . . . 0.0 104.921 177.045 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.6 p -76.56 150.73 6.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.701 0 C-N-CA 118.739 -1.184 . . . . 0.0 109.159 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.296 -1.737 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 175.43 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 6.9 p80 . . . . . 0 N--CA 1.448 -0.563 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -53.56 -50.47 65.47 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.873 175.416 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -48.77 -37.99 20.58 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.621 1.168 . . . . 0.0 112.977 -176.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 95.2 mt -70.41 -50.08 42.24 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.974 0.416 . . . . 0.0 110.599 -179.703 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 19.8 mt -69.58 -41.24 76.06 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-O 121.563 0.697 . . . . 0.0 111.361 -178.08 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 139' ' ' ARG . . . . . 0.475 ' O ' ' HB3' ' B' ' 142' ' ' GLU . 64.4 ttt180 -67.32 -31.91 72.51 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.431 -175.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -78.74 -24.43 44.82 Favored 'General case' 0 N--CA 1.432 -1.326 0 C-N-CA 119.654 -0.819 . . . . 0.0 111.116 176.526 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 51.0 m -69.03 -36.97 78.34 Favored 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 171.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 142' ' ' GLU . . . . . 0.646 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 28.1 tt0 -56.62 -49.25 75.53 Favored 'General case' 0 C--O 1.204 -1.324 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.358 174.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.81 -45.47 59.4 Favored 'General case' 0 C--O 1.255 1.379 0 CA-C-O 121.44 0.638 . . . . 0.0 111.512 -178.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 144' ' ' GLN . . . . . 0.499 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 29.0 tt0 -67.1 -47.78 70.16 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.586 178.311 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -60.06 -34.0 72.81 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 123.532 0.733 . . . . 0.0 112.17 -178.255 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 146' ' ' LYS . . . . . 0.646 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 60.2 mttm -55.15 -51.37 66.67 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 175.707 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -71.77 -27.42 62.95 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.252 -178.286 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 148' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 9.5 mm-40 -73.25 -16.19 61.4 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.931 176.819 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt 51.92 55.63 9.0 Favored 'General case' 0 CA--C 1.505 -0.754 0 C-N-CA 125.052 1.341 . . . . 0.0 110.838 -178.827 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 95.0 mt -86.37 114.06 22.85 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.211 -178.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 151' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 44.3 m-80 48.23 -87.53 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.314 1.846 . . . . 0.0 114.257 177.4 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 10.7 tt -72.01 -24.89 23.1 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-O 120.932 0.396 . . . . 0.0 110.286 -175.373 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 153' ' ' TRP . . . . . 0.626 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 52.6 m95 -80.64 -10.43 59.73 Favored 'General case' 0 CA--C 1.506 -0.731 0 CA-C-O 121.771 0.796 . . . . 0.0 110.288 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 22.6 t -87.33 12.82 11.05 Favored 'General case' 0 N--CA 1.419 -1.993 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.001 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -66.62 -31.24 71.81 Favored 'General case' 0 C--N 1.356 0.871 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 172.191 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 20.9 t70 . . . . . 0 C--O 1.254 1.318 0 C-N-CA 125.007 1.323 . . . . 0.0 113.261 173.266 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.901 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 25.8 m 71.48 -58.67 0.57 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.297 1.039 . . . . 0.0 111.116 -178.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.3 t -88.81 157.99 18.29 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 15.2 m -79.78 -37.17 35.89 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 178.172 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -82.81 120.45 25.65 Favored 'General case' 0 N--CA 1.433 -1.291 0 CA-C-N 114.963 -1.017 . . . . 0.0 108.315 175.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -87.91 125.98 34.8 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 176.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.548 HD13 ' HA ' ' A' ' 77' ' ' ASP . 96.0 mt -66.1 165.53 13.37 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 124.043 0.84 . . . . 0.0 112.972 -175.44 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -86.75 113.15 22.35 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-N 115.274 -0.876 . . . . 0.0 112.072 -172.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.453 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 37.0 ttmt -115.73 134.37 55.09 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 114.093 -1.412 . . . . 0.0 108.554 177.441 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -138.19 146.34 51.31 Favored Pre-proline 0 C--N 1.3 -1.558 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 176.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -69.22 150.59 71.67 Favored 'Trans proline' 0 C--O 1.246 0.891 0 C-N-CA 122.228 1.952 . . . . 0.0 112.388 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -141.45 165.04 28.61 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.142 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.547 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 8.4 m -100.23 133.81 44.08 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.636 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.4 tp -81.84 124.76 29.97 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 178.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.453 HD11 ' HB2' ' A' ' 26' ' ' MET . 59.4 mt -95.78 -54.87 6.63 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 176.521 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -162.68 153.83 17.49 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.197 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.459 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -111.32 107.47 16.75 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 176.305 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.4 mt -81.04 -63.53 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.237 0 CA-C-O 121.59 0.71 . . . . 0.0 109.357 -173.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -112.77 -171.37 1.85 Allowed 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.186 -0.916 . . . . 0.0 109.856 -176.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -92.29 40.18 2.92 Favored Glycine 0 C--O 1.202 -1.884 0 N-CA-C 109.779 -1.328 . . . . 0.0 109.779 177.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.612 ' OD1' ' HG2' ' A' ' 35' ' ' ARG . 2.5 t0 -174.9 -57.46 0.01 OUTLIER 'General case' 0 CA--C 1.505 -0.761 0 N-CA-C 106.534 -1.654 . . . . 0.0 106.534 -174.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.3 111.37 18.92 Favored 'General case' 0 N--CA 1.425 -1.704 0 CA-C-N 113.826 -1.534 . . . . 0.0 109.103 -176.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.425 HG12 ' HA ' ' A' ' 17' ' ' ALA . 22.2 m -134.6 163.16 37.48 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.892 0 C-N-CA 123.499 0.72 . . . . 0.0 109.058 -176.525 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -116.26 116.26 27.44 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.619 -0.676 . . . . 0.0 110.107 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.8 mp -121.92 159.44 26.88 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 121.409 0.623 . . . . 0.0 111.001 178.193 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.547 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 26.9 ttt -120.08 105.93 11.48 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -178.704 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.425 ' CD1' ' HZ ' ' A' ' 34' ' ' PHE . 11.3 p90 -106.74 120.61 42.46 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -177.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 60.9 mttp 55.79 28.71 12.72 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.438 0.637 . . . . 0.0 111.916 -178.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.402 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 93.43 6.08 62.96 Favored Glycine 0 N--CA 1.434 -1.464 0 C-N-CA 120.513 -0.851 . . . . 0.0 113.197 178.565 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.465 ' O ' ' HA ' ' A' ' 26' ' ' MET . 84.0 mm-40 -105.62 104.01 46.29 Favored Pre-proline 0 C--N 1.311 -1.081 0 CA-C-N 117.122 0.461 . . . . 0.0 110.938 178.453 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.402 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 6.2 Cg_exo -76.77 117.09 4.4 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.682 2.254 . . . . 0.0 110.703 176.025 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 25.8 mmt -137.42 147.58 45.5 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 90.3 m -85.59 116.73 24.05 Favored 'General case' 0 N--CA 1.425 -1.685 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 173.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.425 ' HZ ' ' CD1' ' A' ' 27' ' ' TYR . 90.5 m-85 -102.53 157.59 16.82 Favored 'General case' 0 C--N 1.291 -1.962 0 C-N-CA 123.686 0.794 . . . . 0.0 109.847 -177.53 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.612 ' HG2' ' OD1' ' A' ' 21' ' ' ASP . 11.9 ttt-85 -132.66 156.44 46.96 Favored 'General case' 0 C--N 1.286 -2.157 0 N-CA-C 104.127 -2.546 . . . . 0.0 104.127 172.609 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.467 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 84.1 mt -89.88 116.88 28.28 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -170.413 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.485 HD21 ' HB3' ' A' ' 89' ' ' LEU . 37.3 mt -55.71 135.82 51.21 Favored 'General case' 0 C--O 1.245 0.816 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.009 178.494 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.499 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 95.6 mt 72.24 13.14 5.73 Favored 'General case' 0 C--O 1.209 -1.031 0 O-C-N 124.872 1.357 . . . . 0.0 112.132 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 57.3 t -125.88 143.38 39.59 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.433 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -140.08 107.8 5.64 Favored 'General case' 0 C--O 1.249 1.052 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 175.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.441 HG23 ' O ' ' A' ' 108' ' ' LEU . 2.6 m -122.52 -60.36 0.03 OUTLIER Pre-proline 0 CA--C 1.571 1.785 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 -173.634 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.423 ' HD2' ' NH2' ' A' ' 35' ' ' ARG . 7.2 Cg_exo -68.57 -65.94 0.04 OUTLIER 'Trans proline' 0 C--N 1.378 2.097 0 C-N-CA 122.418 2.078 . . . . 0.0 113.826 -164.373 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -99.1 124.0 43.79 Favored 'General case' 0 N--CA 1.405 -2.678 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 176.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.2 m -78.53 157.7 28.75 Favored 'General case' 0 C--N 1.282 -2.355 0 CA-C-N 115.262 -0.881 . . . . 0.0 108.88 -176.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -55.62 -39.39 70.75 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 121.681 0.753 . . . . 0.0 109.098 176.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.411 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 48.1 t-80 -170.63 104.2 0.42 Allowed Pre-proline 0 C--O 1.204 -1.33 0 N-CA-C 104.896 -2.261 . . . . 0.0 104.896 171.541 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -57.71 98.39 0.09 OUTLIER 'Trans proline' 0 C--O 1.239 0.57 0 C-N-CA 122.223 1.949 . . . . 0.0 112.274 -176.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 46' ' ' HIS . 26.6 mtpp -83.11 -40.92 19.17 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.016 -175.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.421 ' HG2' ' OE2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -83.04 -12.5 57.12 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 120.21 -0.596 . . . . 0.0 109.564 176.404 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 87.55 -71.31 2.66 Favored Glycine 0 N--CA 1.443 -0.854 0 N-CA-C 108.8 -1.72 . . . . 0.0 108.8 -173.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.7 t -83.89 43.68 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.062 0 CA-C-O 123.311 1.529 . . . . 0.0 107.589 177.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.421 ' OE2' ' HG2' ' A' ' 49' ' ' LYS . 32.7 tt0 -91.46 -13.86 31.51 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 114.059 -1.428 . . . . 0.0 109.477 -175.534 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -89.32 -37.71 14.7 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 59.68 31.16 20.72 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-O 121.285 0.564 . . . . 0.0 112.075 -177.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -44.53 -54.76 6.36 Favored Glycine 0 CA--C 1.539 1.552 0 CA-C-N 114.185 -1.371 . . . . 0.0 116.328 -176.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo -49.06 -52.0 9.55 Favored 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 123.059 2.506 . . . . 0.0 113.774 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -70.45 -48.57 55.25 Favored 'General case' 0 C--O 1.206 -1.197 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.5 -48.1 72.28 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -177.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.517 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 46.0 p -69.08 -33.77 74.07 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-O 121.146 0.498 . . . . 0.0 111.876 -178.358 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.605 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -71.04 -38.62 72.56 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 175.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -61.51 -43.13 99.41 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 124.917 1.287 . . . . 0.0 111.509 -176.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.527 ' O ' HG22 ' A' ' 66' ' ' VAL . 5.0 p -64.28 -41.47 96.88 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.951 177.374 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.517 ' HG3' ' O ' ' A' ' 59' ' ' SER . 57.7 mttp -57.11 -39.12 74.47 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 123.541 0.526 . . . . 0.0 111.096 177.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.605 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 82.1 mttt -59.51 -54.27 48.52 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -179.278 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -67.35 -39.56 85.77 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -177.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.527 HG22 ' O ' ' A' ' 62' ' ' THR . 34.5 m -82.32 -39.02 15.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 113.634 0.975 . . . . 0.0 113.634 -176.22 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -75.55 -22.85 56.68 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -177.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -83.94 -9.44 58.69 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.766 0.793 . . . . 0.0 109.766 178.007 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.45 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -86.17 140.35 30.25 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.476 0.655 . . . . 0.0 112.436 -177.113 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -87.04 -38.52 16.48 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.042 -0.981 . . . . 0.0 108.977 175.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -119.11 119.78 35.21 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.522 -176.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 74.6 mt -118.23 121.37 67.04 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.475 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 22.8 mt-10 -115.9 137.95 51.63 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.199 -173.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.8 m -110.7 118.67 57.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 174.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.453 ' HA ' ' HA ' ' A' ' 9' ' ' LYS . 39.6 tt0 -111.71 133.76 53.73 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.484 ' CE1' ' HG3' ' A' ' 81' ' ' ARG . 60.8 m-85 -108.65 147.3 32.09 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -175.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.548 ' HA ' HD13 ' A' ' 7' ' ' LEU . 1.3 t70 -97.33 -174.54 2.96 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 120.939 0.4 . . . . 0.0 110.816 -176.437 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.0 mtpm? -76.82 -8.41 57.26 Favored 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 123.787 0.835 . . . . 0.0 110.79 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -69.13 -93.65 0.05 OUTLIER Glycine 0 C--N 1.335 0.508 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -145.97 158.74 43.86 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 176.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.484 ' HG3' ' CE1' ' A' ' 76' ' ' PHE . 37.0 ttm180 -88.52 -35.37 17.0 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 173.694 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 8.4 p -131.71 145.32 51.57 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.285 -0.87 . . . . 0.0 112.119 -175.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -109.07 157.63 18.53 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.258 177.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -56.7 -24.95 52.72 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -176.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -77.04 -1.38 28.66 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 121.458 -0.776 . . . . 0.0 111.099 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 83.34 24.2 51.95 Favored Glycine 0 CA--C 1.486 -1.737 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 177.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -116.89 141.15 48.6 Favored 'General case' 0 N--CA 1.412 -2.339 0 CA-C-N 114.531 -0.835 . . . . 0.0 109.383 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -87.9 157.47 28.49 Favored Glycine 0 N--CA 1.427 -1.966 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.412 -175.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.485 ' HB3' HD21 ' A' ' 37' ' ' LEU . 72.7 mt -122.39 108.55 13.34 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 -178.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.436 ' O ' ' HA ' ' A' ' 36' ' ' LEU . . . -150.66 167.61 26.82 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 119.992 -0.683 . . . . 0.0 112.543 -175.562 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.415 ' HE2' ' HB2' ' A' ' 77' ' ' ASP . 78.8 m-85 -106.22 127.93 53.58 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 171.374 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 65.5 mt -103.14 126.7 57.42 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.978 0 C-N-CA 119.503 -0.879 . . . . 0.0 111.608 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.475 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 35.4 m-85 -112.45 133.94 54.26 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.278 178.552 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.45 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -105.34 105.83 16.04 Favored 'General case' 0 C--N 1.283 -2.306 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 174.603 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.2 p30 46.96 26.53 0.61 Allowed 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 125.201 1.4 . . . . 0.0 113.866 -172.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.46 -6.94 36.46 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.694 -0.765 . . . . 0.0 113.396 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -89.07 115.38 26.57 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 175.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 51.8 ttp -76.11 112.55 12.68 Favored 'General case' 0 C--N 1.294 -1.846 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 -178.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 57.5 t -62.41 -32.77 56.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.245 0.545 . . . . 0.0 110.138 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.467 ' ND2' ' HB3' ' A' ' 36' ' ' LEU . 1.3 m-20 -57.79 -37.95 74.63 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.073 178.588 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -66.3 -46.01 78.4 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.758 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.36 -39.77 88.38 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.662 -178.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 97.2 mt -62.19 -53.46 54.94 Favored 'General case' 0 C--O 1.244 0.795 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 19.3 m -69.54 -37.88 75.6 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 116.222 -0.444 . . . . 0.0 112.156 -177.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 53.2 ttp180 -68.26 -24.64 64.91 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 123.405 0.682 . . . . 0.0 111.16 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 50.7 tp60 -92.01 -5.74 52.43 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.547 0.689 . . . . 0.0 109.375 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.497 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 73.23 27.19 68.69 Favored Glycine 0 N--CA 1.441 -0.976 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.766 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.441 ' O ' HG23 ' A' ' 41' ' ' THR . 83.3 mt -97.63 -7.04 31.93 Favored 'General case' 0 CA--C 1.495 -1.138 0 O-C-N 122.864 -0.198 . . . . 0.0 111.186 -179.104 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -150.61 164.67 35.47 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 -177.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -112.66 156.92 21.91 Favored 'General case' 0 CA--C 1.488 -1.421 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 174.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 75.2 t -73.77 136.13 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.755 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 174.04 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -86.36 121.73 29.34 Favored 'General case' 0 N--CA 1.424 -1.766 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -177.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 18.6 t80 -73.7 102.33 3.93 Favored 'General case' 0 N--CA 1.417 -2.125 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.513 -171.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.558 HG11 ' HB3' ' B' ' 131' ' ' ASN . 48.1 t -87.39 127.01 41.07 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.702 0 N-CA-C 104.214 -2.513 . . . . 0.0 104.214 171.346 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.694 ' HH ' ' N ' ' B' ' 122' ' ' GLY . 67.2 t80 -92.35 124.86 36.72 Favored 'General case' 0 C--N 1.274 -2.709 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -162.249 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.402 ' HG3' ' HA ' ' B' ' 130' ' ' PRO . 3.6 mppt? -116.97 109.58 42.7 Favored Pre-proline 0 N--CA 1.428 -1.527 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 169.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -59.74 -58.75 0.52 Allowed 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.524 2.149 . . . . 0.0 111.024 -177.114 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ASN . . . . . 0.529 ' HB3' ' OXT' ' A' ' 121' ' ' HIS . 25.5 t-20 -165.22 -61.15 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 105.691 -1.966 . . . . 0.0 105.691 176.388 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -137.6 -90.42 0.24 Allowed 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.015 173.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 26.9 m -88.96 -25.78 21.87 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' HIS . . . . . 0.529 ' OXT' ' HB3' ' A' ' 118' ' ' ASN . 20.8 t-80 . . . . . 0 N--CA 1.409 -2.499 0 N-CA-C 101.925 -3.361 . . . . 0.0 101.925 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 122' ' ' GLY . . . . . 0.694 ' N ' ' HH ' ' A' ' 115' ' ' TYR . . . . . . . . 0 CA--C 1.503 -0.66 0 N-CA-C 111.34 -0.704 . . . . 0.0 111.34 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 23.8 m 66.85 -13.62 0.19 Allowed 'General case' 0 CA--C 1.554 1.104 0 N-CA-C 114.71 1.374 . . . . 0.0 114.71 175.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 124' ' ' VAL . . . . . 0.402 ' O ' HG12 ' B' ' 124' ' ' VAL . 47.7 t 65.31 27.1 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.216 0 CA-C-O 123.445 1.593 . . . . 0.0 108.67 -176.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -127.7 157.37 40.49 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 114.386 -1.279 . . . . 0.0 107.574 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 126' ' ' TYR . . . . . 0.437 ' HA ' ' CD2' ' A' ' 115' ' ' TYR . 79.3 t80 -151.04 130.66 13.06 Favored 'General case' 0 C--N 1.314 -0.968 0 C-N-CA 120.277 -0.569 . . . . 0.0 111.411 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 86.1 t -145.68 151.7 14.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 N-CA-C 103.978 -2.601 . . . . 0.0 103.978 175.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -102.32 -34.58 9.15 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 118.347 0.522 . . . . 0.0 111.241 -179.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.482 ' HA ' ' HD3' ' B' ' 130' ' ' PRO . 88.6 mttt -73.48 132.5 81.33 Favored Pre-proline 0 C--N 1.319 -0.757 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -175.301 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 130' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' B' ' 129' ' ' LYS . 1.1 Cg_endo -76.71 79.72 2.98 Favored 'Trans proline' 0 N--CA 1.436 -1.891 0 C-N-CA 122.301 2.001 . . . . 0.0 111.95 177.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 131' ' ' ASN . . . . . 0.558 ' HB3' HG11 ' A' ' 114' ' ' VAL . 38.6 t-20 -90.37 100.16 13.05 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 176.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -119.02 -20.4 8.1 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -178.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.6 118.15 5.76 Favored 'General case' 0 N--CA 1.382 -3.869 0 CA-C-N 114.636 -1.166 . . . . 0.0 108.569 176.234 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 134' ' ' HIS . . . . . 0.428 ' CE1' HD12 ' A' ' 7' ' ' LEU . 65.8 m80 85.93 -14.2 0.55 Allowed 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 113.655 -1.612 . . . . 0.0 112.377 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.4 ' HA ' HD13 ' A' ' 38' ' ' LEU . 33.9 tt0 -60.98 -41.75 97.05 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 118.889 0.768 . . . . 0.0 110.628 -176.021 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -65.9 -33.6 76.21 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.319 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 95.0 mt -68.52 -49.73 57.41 Favored 'General case' 0 C--O 1.246 0.871 0 CA-C-O 121.657 0.741 . . . . 0.0 109.136 178.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -63.55 -44.56 93.81 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.288 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 139' ' ' ARG . . . . . 0.433 ' HA ' ' HB3' ' B' ' 142' ' ' GLU 0.436 48.6 mtt180 -75.13 -18.39 60.24 Favored 'General case' 0 N--CA 1.436 -1.159 0 N-CA-C 117.62 2.452 . . . . 0.0 117.62 -175.767 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -72.68 -42.78 63.91 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 169.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 15.0 m -66.4 -37.12 84.51 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 114.651 -1.159 . . . . 0.0 110.275 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.606 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 39.0 tt0 -63.39 -51.17 66.92 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.694 175.143 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.61 -39.21 70.47 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.65 0.78 . . . . 0.0 111.65 -176.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -60.17 -47.54 85.53 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.432 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -74.45 -34.29 63.13 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.423 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 146' ' ' LYS . . . . . 0.606 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 39.6 mtpt -59.82 -47.71 84.63 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-O 121.131 0.491 . . . . 0.0 110.208 179.402 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -67.98 -26.95 66.18 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.541 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -82.85 -8.54 59.57 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 149' ' ' LYS . . . . . 0.54 ' O ' ' HB2' ' B' ' 154' ' ' SER . 29.8 mmmt 58.35 42.72 21.07 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 36.3 mt -79.13 112.28 16.18 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.19 -176.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 151' ' ' ASN . . . . . 0.497 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 85.6 m-20 54.16 -92.85 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.084 1.354 . . . . 0.0 112.671 174.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 52.1 mt -67.69 -32.73 58.06 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.948 0 CA-C-O 121.206 0.527 . . . . 0.0 110.387 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 52.8 m95 -75.69 -5.43 45.56 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-O 121.765 0.793 . . . . 0.0 111.473 -177.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 154' ' ' SER . . . . . 0.54 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 23.2 t -93.72 12.66 24.81 Favored 'General case' 0 N--CA 1.423 -1.787 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.604 173.423 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -70.79 -24.3 62.55 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.615 0.722 . . . . 0.0 109.08 175.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 30.2 t70 . . . . . 0 N--CA 1.429 -1.488 0 CA-C-N 114.356 -1.293 . . . . 0.0 109.295 -178.351 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.303 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 56.2 m 70.96 109.02 0.06 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.084 0.953 . . . . 0.0 113.127 177.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 46.9 t -94.44 104.18 16.15 Favored 'General case' 0 N--CA 1.433 -1.282 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 175.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 33.3 p -81.65 91.53 6.44 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.945 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.411 ' NZ ' ' HB3' ' A' ' 5' ' ' LYS . 6.3 mtpm? -71.05 121.51 18.36 Favored 'General case' 0 N--CA 1.434 -1.272 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.204 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -67.34 -37.39 83.19 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 74.9 mt -82.32 103.94 12.26 Favored 'General case' 0 C--O 1.257 1.447 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 173.446 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 14.9 p-80 -74.87 141.67 44.18 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.549 -175.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.485 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 21.4 pttp -111.46 145.9 38.17 Favored 'General case' 0 C--N 1.291 -1.951 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 173.521 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -138.85 147.6 54.81 Favored Pre-proline 0 C--N 1.259 -3.34 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -74.96 149.76 37.39 Favored 'Trans proline' 0 C--O 1.244 0.804 0 C-N-CA 122.212 1.941 . . . . 0.0 113.193 -177.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -138.12 155.05 49.13 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.542 -0.753 . . . . 0.0 109.448 178.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.474 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 21.6 m -100.59 137.02 39.55 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.442 ' HB2' HD12 ' A' ' 72' ' ' ILE . 62.2 tp -83.36 132.97 34.97 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.979 -0.451 . . . . 0.0 111.594 -176.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 51.0 mm -95.92 -59.47 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.481 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 172.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.24 142.3 0.8 Allowed 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 -178.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.428 ' HA ' HG23 ' A' ' 23' ' ' VAL . . . -92.04 122.53 34.63 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 171.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.4 mt -90.15 -64.8 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -175.039 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -134.83 -178.82 5.25 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.643 -178.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.7 56.01 4.9 Favored Glycine 0 C--O 1.238 0.379 0 C-N-CA 121.732 -0.27 . . . . 0.0 112.95 -176.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.572 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 3.2 p-10 177.71 -34.06 0.01 OUTLIER 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 124.546 1.139 . . . . 0.0 108.259 179.261 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -110.12 109.89 20.58 Favored 'General case' 0 N--CA 1.419 -2.002 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.953 -177.157 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.428 HG23 ' HA ' ' A' ' 17' ' ' ALA . 7.3 p -129.33 139.2 52.39 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.881 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 178.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -106.0 119.48 39.31 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -175.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 31' ' ' PRO . 4.7 mp -127.24 156.28 42.13 Favored 'General case' 0 CA--C 1.496 -1.119 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.958 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.474 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 49.3 ttm -110.83 99.94 8.77 Favored 'General case' 0 C--N 1.29 -2.019 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 175.079 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -98.29 113.26 25.14 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.329 -0.949 . . . . 0.0 108.717 -177.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 96.8 mttt 56.71 31.62 19.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.878 0.847 . . . . 0.0 111.563 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 95.52 4.2 60.86 Favored Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 114.815 -1.084 . . . . 0.0 113.938 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 33.5 mm-40 -105.97 103.46 44.64 Favored Pre-proline 0 C--N 1.309 -1.173 0 CA-C-N 117.403 0.601 . . . . 0.0 111.163 175.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.48 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 1.9 Cg_endo -82.69 107.69 1.6 Allowed 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 122.798 2.332 . . . . 0.0 111.124 177.328 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 92.0 mtp -131.52 156.49 45.62 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-O 121.081 0.467 . . . . 0.0 111.463 -177.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.8 m -78.31 108.95 12.02 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 175.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -95.1 142.7 27.25 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-O 121.291 0.567 . . . . 0.0 111.572 -178.304 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.572 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 8.2 tpt180 -110.88 112.25 23.96 Favored 'General case' 0 N--CA 1.417 -2.105 0 N-CA-C 105.443 -2.058 . . . . 0.0 105.443 172.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.569 HD12 ' H ' ' A' ' 36' ' ' LEU . 3.9 mp -62.93 122.08 15.11 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -177.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 78.9 mt -69.09 146.58 52.46 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.306 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.487 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 70.3 mt 75.47 4.27 4.02 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 124.935 1.294 . . . . 0.0 112.265 177.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 94.1 t -120.3 125.79 74.57 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.223 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.599 -178.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.472 ' HA ' ' NH2' ' A' ' 35' ' ' ARG . 31.9 t70 -121.89 134.9 54.87 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 173.225 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.561 ' OG1' ' HB3' ' A' ' 21' ' ' ASP . 1.7 m -73.21 152.48 90.35 Favored Pre-proline 0 C--N 1.307 -1.242 0 C-N-CA 123.741 0.816 . . . . 0.0 109.547 -177.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -44.94 123.72 5.23 Favored 'Trans proline' 0 C--N 1.379 2.164 0 C-N-CA 122.744 2.296 . . . . 0.0 110.093 172.361 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.408 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.6 OUTLIER -57.54 136.41 56.73 Favored 'General case' 0 C--O 1.248 1.008 0 O-C-N 124.183 0.927 . . . . 0.0 113.279 -171.446 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.7 t -103.9 108.42 19.74 Favored 'General case' 0 N--CA 1.403 -2.825 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -65.52 -23.71 66.95 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 121.908 0.861 . . . . 0.0 110.472 -176.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -157.72 144.04 12.9 Favored Pre-proline 0 C--N 1.293 -1.865 0 N-CA-C 102.345 -3.206 . . . . 0.0 102.345 173.471 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_exo -40.72 136.91 1.83 Allowed 'Trans proline' 0 C--O 1.247 0.967 0 C-N-CA 123.416 2.744 . . . . 0.0 113.942 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.514 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 8.0 mmpt? 78.87 2.13 2.48 Favored 'General case' 0 C--N 1.351 0.653 0 C-N-CA 125.119 1.367 . . . . 0.0 112.901 178.648 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -99.24 -20.0 16.81 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 121.847 -0.533 . . . . 0.0 111.647 -179.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -77.34 -31.96 49.49 Favored Glycine 0 CA--C 1.499 -0.955 0 C-N-CA 120.05 -1.072 . . . . 0.0 110.658 178.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.552 ' HA ' ' HA3' ' A' ' 55' ' ' GLY . 14.6 p -71.14 -21.0 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.909 0 CA-C-N 114.777 -0.712 . . . . 0.0 109.472 177.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -69.89 -28.08 65.33 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.033 178.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -79.03 -68.81 0.62 Allowed 'General case' 0 N--CA 1.436 -1.175 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.773 -177.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -149.48 23.8 0.9 Allowed 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.045 0.45 . . . . 0.0 110.01 -174.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.552 ' HA3' ' HA ' ' A' ' 51' ' ' VAL . . . -58.93 -58.65 13.42 Favored Glycine 0 CA--C 1.524 0.598 0 CA-C-O 118.836 -0.98 . . . . 0.0 114.395 -176.329 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.477 ' HA ' ' OG ' ' A' ' 59' ' ' SER . 32.4 Cg_exo -64.12 -21.48 67.85 Favored 'Trans proline' 0 C--N 1.364 1.381 0 C-N-CA 122.842 2.362 . . . . 0.0 112.357 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -68.8 -47.38 66.25 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 177.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.88 -46.47 68.34 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.078 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.501 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 12.9 p -65.88 -45.16 83.07 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -177.4 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.38 -39.46 90.73 Favored 'General case' 0 CA--C 1.51 -0.58 0 C-N-CA 121.255 -0.178 . . . . 0.0 110.864 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -63.92 -45.19 90.38 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.496 ' O ' HG22 ' A' ' 66' ' ' VAL . 44.8 m -56.84 -49.86 74.17 Favored 'General case' 0 N--CA 1.445 -0.708 0 O-C-N 124.181 0.926 . . . . 0.0 109.425 177.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.501 ' HG3' ' O ' ' A' ' 59' ' ' SER . 59.7 mtpt -56.83 -54.59 44.66 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.821 179.482 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -57.48 -42.01 81.8 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.69 0.618 . . . . 0.0 111.89 -177.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.8 ttt -72.35 -44.87 61.99 Favored 'General case' 0 N--CA 1.441 -0.911 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.854 -177.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.496 HG22 ' O ' ' A' ' 62' ' ' THR . 33.2 m -74.88 -30.91 24.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -70.8 -31.56 68.36 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.338 0.589 . . . . 0.0 109.774 176.088 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -84.23 -13.44 52.64 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.384 -178.681 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.57 132.43 46.91 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.025 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -79.51 -38.27 34.75 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-O 122.004 0.906 . . . . 0.0 109.226 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.458 ' H ' ' HB3' ' A' ' 95' ' ' ASP . 44.5 mtmt -133.18 150.44 52.0 Favored 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 106.02 -1.845 . . . . 0.0 106.02 178.01 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.442 HD12 ' HB2' ' A' ' 14' ' ' LEU . 53.3 mt -119.1 130.69 73.53 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.744 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 171.732 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.585 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 14.2 mm-40 -111.49 133.11 54.01 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 106.222 -1.77 . . . . 0.0 106.222 -178.364 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 m -112.64 122.81 67.54 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.916 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 174.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.485 ' HA ' ' HA ' ' A' ' 9' ' ' LYS . 33.7 tt0 -106.51 135.16 48.51 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 120.902 0.382 . . . . 0.0 110.526 -177.217 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -79.13 116.6 19.51 Favored 'General case' 0 N--CA 1.415 -2.215 0 CA-C-N 114.919 -1.037 . . . . 0.0 108.882 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.451 ' CG ' ' H ' ' A' ' 78' ' ' LYS . 25.9 t70 -96.8 -175.2 3.21 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 123.926 0.766 . . . . 0.0 109.924 -177.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.451 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 43.1 tptt -73.05 -9.4 58.69 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 124.443 1.097 . . . . 0.0 112.353 -173.009 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -81.05 -113.54 0.33 Allowed Glycine 0 C--N 1.314 -0.675 0 C-N-CA 120.337 -0.935 . . . . 0.0 110.927 174.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -130.21 175.01 9.27 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 176.169 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 40.4 ttt180 -96.15 -32.75 12.34 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 43.0 p -137.11 142.36 42.3 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.834 177.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.434 ' HB2' HD11 ' A' ' 89' ' ' LEU . 16.4 t70 -100.76 140.58 34.85 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.212 0.53 . . . . 0.0 110.58 176.771 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.7 pttp -44.36 -26.07 0.3 Allowed 'General case' 0 C--N 1.301 -1.508 0 C-N-CA 127.909 2.483 . . . . 0.0 115.773 176.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 69.4 t80 -79.71 -15.4 57.6 Favored 'General case' 0 C--O 1.237 0.445 0 O-C-N 121.34 -0.85 . . . . 0.0 110.274 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 105.13 45.81 1.32 Allowed Glycine 0 N--CA 1.439 -1.15 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 -178.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 27.8 mmt85 -129.04 144.26 51.13 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -89.19 141.58 16.34 Favored Glycine 0 C--N 1.291 -1.919 0 N-CA-C 109.105 -1.598 . . . . 0.0 109.105 175.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.434 HD11 ' HB2' ' A' ' 83' ' ' ASP . 90.6 mt -124.4 105.84 9.75 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -178.34 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.54 164.18 38.51 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-O 120.631 0.253 . . . . 0.0 110.434 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.413 ' CZ ' ' HB2' ' A' ' 100' ' ' ASN . 13.1 t80 -89.21 130.77 35.57 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 173.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 45.2 mm -99.99 123.94 53.13 Favored 'Isoleucine or valine' 0 C--O 1.251 1.14 0 CA-C-O 120.954 0.407 . . . . 0.0 111.623 -175.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.585 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 50.1 m-85 -113.94 145.65 41.21 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 173.481 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.19 100.4 9.99 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 175.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.458 ' HB3' ' H ' ' A' ' 71' ' ' LYS 0.338 4.2 p-10 43.83 42.5 4.51 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 125.46 1.504 . . . . 0.0 114.256 -176.864 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.25 -17.84 39.99 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-N 114.687 -1.142 . . . . 0.0 113.52 177.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.2 mtmt -97.97 132.29 43.66 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 120.937 0.398 . . . . 0.0 110.908 -177.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' MET . . . . . 0.446 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 1.9 mpt? -70.39 109.99 5.06 Favored 'General case' 0 C--N 1.305 -1.334 0 C-N-CA 123.999 0.92 . . . . 0.0 112.95 -173.702 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 58.7 t -73.41 -43.78 55.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 121.441 0.639 . . . . 0.0 109.941 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.506 HD21 ' HB3' ' A' ' 36' ' ' LEU . 14.3 m120 -60.65 -45.16 95.15 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.247 -176.467 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -61.91 -38.0 86.76 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.05 178.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.557 ' O ' ' HG2' ' A' ' 106' ' ' GLN . . . -65.33 -46.69 79.25 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.265 179.585 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 97.2 mt -53.57 -48.66 68.95 Favored 'General case' 0 C--O 1.244 0.777 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -179.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 12.7 m -70.81 -36.97 66.76 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.514 ' HB2' ' HB3' ' B' ' 141' ' ' SER . 29.2 ttp180 -72.26 -21.81 61.32 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.557 ' HG2' ' O ' ' A' ' 102' ' ' ALA . 82.0 mm-40 -87.54 -2.67 58.78 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.32 0.581 . . . . 0.0 109.508 176.326 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.436 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 69.75 28.7 71.76 Favored Glycine 0 N--CA 1.444 -0.833 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.993 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.4 mt -94.98 -13.98 24.79 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-O 121.189 0.518 . . . . 0.0 110.577 -177.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -151.22 167.41 27.9 Favored 'General case' 0 N--CA 1.428 -1.569 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.231 -176.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -112.57 153.11 28.04 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 175.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.508 HG11 ' HG2' ' B' ' 139' ' ' ARG . 11.7 p -76.9 125.55 36.8 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-O 121.516 0.674 . . . . 0.0 110.475 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.455 ' CB ' ' HB2' ' A' ' 40' ' ' ASP . . . -134.74 120.81 19.9 Favored 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.867 176.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.475 ' HB2' ' HB2' ' B' ' 131' ' ' ASN . 1.6 p90 -118.34 98.61 6.37 Favored 'General case' 0 C--N 1.292 -1.892 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.123 176.198 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 21.7 t -126.71 105.05 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.923 0 CA-C-O 121.902 0.858 . . . . 0.0 111.946 -176.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.426 ' O ' ' HD3' ' A' ' 117' ' ' PRO . 65.0 t80 -165.27 65.37 0.12 Allowed 'General case' 0 C--N 1.286 -2.157 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 166.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.449 ' HD2' ' HD2' ' A' ' 117' ' ' PRO . 46.1 tptt -89.19 113.26 55.59 Favored Pre-proline 0 N--CA 1.393 -3.294 0 CA-C-N 113.123 -1.853 . . . . 0.0 110.015 -175.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.449 ' HD2' ' HD2' ' A' ' 116' ' ' LYS . 91.1 Cg_endo -88.53 20.36 1.15 Allowed 'Trans proline' 0 C--N 1.314 -1.239 0 C-N-CA 123.96 3.107 . . . . 0.0 110.664 178.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 49.8 t30 65.33 -85.49 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 126.19 1.796 . . . . 0.0 112.039 177.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -98.45 -2.55 38.72 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-O 121.226 0.536 . . . . 0.0 109.91 -177.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.406 ' HA ' ' HG2' ' A' ' 117' ' ' PRO . 21.5 m 76.16 -65.65 0.3 Allowed 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.347 1.059 . . . . 0.0 109.538 -178.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 49.5 t60 . . . . . 0 N--CA 1.425 -1.7 0 N-CA-C 106.884 -1.525 . . . . 0.0 106.884 175.109 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.58 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 15.1 m -108.05 -44.46 4.17 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.893 0.347 . . . . 0.0 110.189 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 61.7 t -72.13 -44.89 64.41 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 178.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -115.49 93.71 4.4 Favored 'General case' 0 N--CA 1.427 -1.598 0 CA-C-N 114.72 -1.127 . . . . 0.0 108.082 173.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -88.53 110.42 20.87 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 179.239 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 45.4 t -110.3 126.96 67.57 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.576 0 CA-C-O 121.266 0.555 . . . . 0.0 112.285 -172.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 128' ' ' TYR . . . . . 0.494 ' C ' ' HD3' ' B' ' 130' ' ' PRO . 56.2 m-85 -117.29 101.21 8.24 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.985 171.342 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -124.63 68.12 51.35 Favored Pre-proline 0 C--N 1.311 -1.093 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 172.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 130' ' ' PRO . . . . . 0.494 ' HD3' ' C ' ' B' ' 128' ' ' TYR . 6.0 Cg_endo -94.32 -74.9 0.0 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.117 0 C-N-CA 122.949 2.432 . . . . 0.0 110.964 178.364 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 131' ' ' ASN . . . . . 0.475 ' HB2' ' HB2' ' A' ' 113' ' ' TYR . 15.8 m120 -88.73 47.63 1.53 Allowed 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 176.289 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.461 ' HA ' ' HB2' ' B' ' 135' ' ' GLU . 28.2 p-10 -83.0 4.2 26.98 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.36 -175.194 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.64 -33.52 66.41 Favored 'General case' 0 C--N 1.311 -1.089 0 C-N-CA 125.011 1.324 . . . . 0.0 113.281 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -127.32 21.74 6.63 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.994 0.426 . . . . 0.0 110.49 178.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.461 ' HB2' ' HA ' ' B' ' 132' ' ' ASN . 37.2 tt0 -54.82 -55.35 31.22 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.926 -1.033 . . . . 0.0 112.892 -175.428 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 56.9 mm-40 -56.74 -45.92 81.69 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.043 -171.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.0 mt -62.9 -51.1 68.25 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 123.78 0.675 . . . . 0.0 111.019 -176.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 7.6 mp -70.04 -32.95 71.33 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 139' ' ' ARG . . . . . 0.508 ' HG2' HG11 ' A' ' 111' ' ' VAL . 34.1 mtp180 -68.25 -34.26 75.89 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.378 176.399 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 19.4 mmmt -70.46 -32.04 69.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.875 0.369 . . . . 0.0 110.941 173.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 141' ' ' SER . . . . . 0.514 ' HB3' ' HB2' ' A' ' 105' ' ' ARG . 43.3 m -65.82 -41.96 91.2 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.807 177.106 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.552 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 48.0 mt-10 -63.65 -46.96 83.27 Favored 'General case' 0 C--O 1.198 -1.612 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.455 172.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 143' ' ' ALA . . . . . 0.548 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -51.04 -44.41 61.08 Favored 'General case' 0 CA--C 1.509 -0.617 0 O-C-N 123.899 0.749 . . . . 0.0 111.608 -176.178 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -61.31 -47.41 86.09 Favored 'General case' 0 N--CA 1.441 -0.876 0 O-C-N 123.864 0.728 . . . . 0.0 109.503 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.1 -40.79 91.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.055 -178.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 146' ' ' LYS . . . . . 0.552 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 56.0 mttm -54.55 -45.09 73.4 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.102 0.477 . . . . 0.0 110.52 177.247 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 147' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 31.1 mmtp -79.9 -24.01 41.43 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.772 -174.161 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -87.23 -9.86 54.01 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.584 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 149' ' ' LYS . . . . . 0.552 ' O ' ' HB2' ' B' ' 154' ' ' SER . 27.4 mmmt 61.97 55.91 2.45 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.387 1.075 . . . . 0.0 108.428 -178.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 88.7 mt -95.06 123.25 38.44 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.038 -177.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 151' ' ' ASN . . . . . 0.436 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 54.2 m-80 46.26 -97.11 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.766 1.626 . . . . 0.0 113.574 -179.185 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 152' ' ' ILE . . . . . 0.563 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 64.4 mt -60.98 -36.01 69.22 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.632 0 CA-C-O 121.767 0.794 . . . . 0.0 110.401 -178.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -80.61 1.0 31.63 Favored 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.6 -175.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 154' ' ' SER . . . . . 0.552 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 25.0 t -99.72 -6.73 26.59 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.49 177.627 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 155' ' ' GLU . . . . . 0.563 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 12.5 pt-20 -79.94 -19.67 47.46 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 119.939 -0.704 . . . . 0.0 109.24 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 18.4 t70 . . . . . 0 CA--C 1.487 -1.473 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -178.027 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.37 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.4 p -80.56 98.54 7.66 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 121.475 0.655 . . . . 0.0 112.121 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.4 m -75.06 -46.93 31.48 Favored 'General case' 0 N--CA 1.428 -1.562 0 N-CA-C 106.46 -1.681 . . . . 0.0 106.46 174.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.6 m -89.57 78.09 7.1 Favored 'General case' 0 N--CA 1.413 -2.288 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.154 178.358 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -80.42 -29.37 37.67 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 178.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -136.7 -73.37 0.44 Allowed 'General case' 0 N--CA 1.413 -2.289 0 CA-C-N 113.552 -1.658 . . . . 0.0 108.656 -175.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 87.2 mt -153.85 -173.5 4.6 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 124.643 1.177 . . . . 0.0 108.178 -177.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 28.9 t-80 -95.09 105.81 17.76 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -96.33 125.02 40.54 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 115.32 -0.854 . . . . 0.0 108.926 179.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.473 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 7.5 pt-20 -135.38 143.4 45.2 Favored Pre-proline 0 C--N 1.303 -1.454 0 CA-C-N 116.78 -0.191 . . . . 0.0 110.489 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 6.0 Cg_exo -79.97 147.36 18.91 Favored 'Trans proline' 0 C--O 1.249 1.046 0 C-N-CA 122.472 2.115 . . . . 0.0 113.903 -176.763 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -129.86 171.26 12.91 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.208 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.423 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 28.1 m -117.13 145.6 43.7 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 107.081 -1.452 . . . . 0.0 107.081 178.529 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.1 tp -88.28 127.93 35.47 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 118.721 0.691 . . . . 0.0 110.381 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.483 HD11 ' HB2' ' A' ' 26' ' ' MET . 46.6 mm -93.13 -51.47 11.2 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 176.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -169.48 134.12 1.41 Allowed 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.347 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -84.79 131.51 34.53 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 172.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.436 ' HB ' ' O ' ' A' ' 22' ' ' THR . 59.7 mt -105.89 -64.45 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 C-N-CA 120.544 -0.463 . . . . 0.0 111.016 -175.09 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.457 ' HB2' ' OG1' ' A' ' 22' ' ' THR . 36.9 m-20 -122.71 -152.71 0.52 Allowed 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.051 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -101.69 44.43 1.54 Allowed Glycine 0 CA--C 1.498 -0.971 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 -178.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.455 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 33.0 t0 -179.73 -56.12 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 -178.177 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.457 ' OG1' ' HB2' ' A' ' 19' ' ' ASP . 1.0 OUTLIER -76.4 106.34 7.98 Favored 'General case' 0 N--CA 1.411 -2.377 0 CA-C-N 114.627 -1.169 . . . . 0.0 110.059 -178.296 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.5 m -130.68 151.04 35.27 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.451 -178.035 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 45.7 tttp -108.49 114.48 28.35 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 -176.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.7 mp -121.5 159.69 25.77 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 121.382 0.611 . . . . 0.0 111.416 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.513 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 64.0 ttp -119.46 116.24 25.71 Favored 'General case' 0 C--N 1.294 -1.83 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 177.47 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.2 p90 -119.66 119.53 33.98 Favored 'General case' 0 C--N 1.286 -2.154 0 C-N-CA 119.368 -0.933 . . . . 0.0 109.272 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 98.0 mttt 60.85 27.52 17.33 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.266 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.434 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 94.31 3.67 63.11 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-N 115.232 -0.895 . . . . 0.0 113.034 -179.589 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.513 ' O ' ' HA ' ' A' ' 26' ' ' MET . 1.7 mp0 -100.47 102.39 18.59 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.95 0.375 . . . . 0.0 110.446 177.217 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.434 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 1.5 Cg_endo -83.34 101.96 1.01 Allowed 'Trans proline' 0 N--CA 1.443 -1.45 0 C-N-CA 122.31 2.007 . . . . 0.0 109.856 176.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 66.7 mtt -124.98 147.47 48.91 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.492 -176.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.54 ' O ' ' HD3' ' A' ' 87' ' ' ARG . 23.7 m -85.91 121.37 28.45 Favored 'General case' 0 N--CA 1.422 -1.839 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 177.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -99.57 161.58 13.53 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-O 122.256 1.026 . . . . 0.0 113.532 -174.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.455 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 9.0 tpt180 -134.51 131.02 37.52 Favored 'General case' 0 N--CA 1.412 -2.327 0 N-CA-C 105.037 -2.208 . . . . 0.0 105.037 173.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.1 mp -69.94 129.3 39.13 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 119.658 -0.817 . . . . 0.0 111.859 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.453 HD21 ' HB3' ' A' ' 89' ' ' LEU . 50.2 mt -57.42 126.07 25.67 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 115.047 -0.979 . . . . 0.0 112.629 177.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.436 HD22 HG22 ' A' ' 114' ' ' VAL . 40.2 mt 72.03 23.4 3.47 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-N 113.485 -1.688 . . . . 0.0 112.562 173.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 51.1 t -111.41 135.57 50.2 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.033 0 CA-C-O 121.113 0.482 . . . . 0.0 110.596 177.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.539 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 35.8 t70 -122.36 106.79 11.39 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 174.364 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.455 HG21 ' HB2' ' A' ' 21' ' ' ASP . 1.8 p -97.35 160.66 28.34 Favored Pre-proline 0 N--CA 1.421 -1.925 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.774 177.522 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -68.96 67.22 1.29 Allowed 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 122.639 2.226 . . . . 0.0 114.063 -178.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -77.95 170.76 16.05 Favored 'General case' 0 N--CA 1.436 -1.143 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 173.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 28.2 m 74.58 -42.57 0.5 Allowed 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 -173.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -68.26 -35.62 78.18 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 170.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 73.9 m80 73.41 97.99 0.04 OUTLIER Pre-proline 0 C--O 1.251 1.152 0 CA-C-N 114.042 -1.436 . . . . 0.0 111.123 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.93 133.33 57.3 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 123.293 2.662 . . . . 0.0 111.27 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.4 mtpt 72.29 -42.34 0.53 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.826 1.25 . . . . 0.0 113.854 -178.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -61.45 -37.71 84.56 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 123.256 0.622 . . . . 0.0 109.674 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -153.23 28.02 0.79 Allowed Glycine 0 N--CA 1.44 -1.081 0 C-N-CA 119.991 -1.1 . . . . 0.0 112.254 178.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 47.6 t -137.6 98.33 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -91.91 -29.45 16.67 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.497 ' HE2' ' HA ' ' A' ' 53' ' ' LYS . 11.2 mmpt? -69.01 -42.26 76.65 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 120.429 -0.508 . . . . 0.0 112.325 -174.258 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -124.16 -9.34 7.62 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 120.122 -0.631 . . . . 0.0 111.22 -176.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -69.04 -59.19 6.06 Favored Glycine 0 CA--C 1.524 0.616 0 CA-C-O 118.803 -0.998 . . . . 0.0 114.758 -173.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.47 -25.2 70.46 Favored 'Trans proline' 0 C--N 1.366 1.47 0 C-N-CA 122.409 2.073 . . . . 0.0 112.899 -178.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -70.3 -50.46 39.07 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 178.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.3 -43.06 98.91 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.296 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.7 p -64.91 -49.41 70.54 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.444 -178.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.33 -39.12 93.27 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 120.52 0.2 . . . . 0.0 110.853 -178.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -59.74 -52.73 64.21 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 123.435 0.694 . . . . 0.0 109.562 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 25.6 m -61.72 -47.15 86.56 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.313 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -58.36 -48.05 81.85 Favored 'General case' 0 CA--C 1.503 -0.839 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.191 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -60.7 -39.86 90.11 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.426 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 84.9 mtp -66.8 -47.71 71.22 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 120.141 -0.624 . . . . 0.0 111.633 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.9 m -75.09 -29.9 22.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -176.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -85.62 -29.52 24.01 Favored 'General case' 0 C--N 1.315 -0.933 0 O-C-N 121.83 -0.543 . . . . 0.0 112.182 -179.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -84.99 -11.71 54.87 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.296 0.57 . . . . 0.0 109.92 178.004 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.31 123.26 11.41 Favored 'General case' 0 C--O 1.244 0.791 0 C-N-CA 123.7 0.8 . . . . 0.0 112.069 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -74.54 -40.82 61.48 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 177.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -126.57 122.59 35.52 Favored 'General case' 0 N--CA 1.416 -2.169 0 CA-C-N 113.513 -1.676 . . . . 0.0 107.915 -179.043 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 63.5 mt -97.44 112.5 29.62 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.251 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 177.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.546 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 30.2 mt-10 -113.07 133.8 54.83 Favored 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 120.525 -0.47 . . . . 0.0 109.925 -175.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.0 m -110.93 127.01 68.33 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.693 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 171.629 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -115.33 128.85 56.37 Favored 'General case' 0 C--N 1.279 -2.495 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -175.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.455 ' CE1' ' HB2' ' A' ' 81' ' ' ARG . 32.2 t80 -97.41 131.86 43.67 Favored 'General case' 0 N--CA 1.414 -2.228 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.458 -175.149 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -85.66 -174.95 5.42 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.426 ' HB2' ' O ' ' B' ' 130' ' ' PRO . 72.6 mmtt -75.79 -14.95 60.32 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -175.629 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.464 ' HA3' ' OD1' ' B' ' 131' ' ' ASN . . . -97.93 -116.52 3.57 Favored Glycine 0 C--N 1.313 -0.742 0 C-N-CA 120.19 -1.005 . . . . 0.0 115.586 -172.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 16.4 mp0 -96.07 141.22 29.72 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -175.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.455 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . 19.3 ttm180 -96.82 -22.4 16.95 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 124.145 0.903 . . . . 0.0 108.859 176.668 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.4 p -142.22 143.43 32.9 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.985 -177.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -93.96 148.22 22.36 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 172.224 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -58.8 -16.77 18.58 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 -177.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -68.93 -20.09 64.21 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.311 0.577 . . . . 0.0 109.732 175.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 103.03 24.76 7.84 Favored Glycine 0 C--O 1.219 -0.828 0 N-CA-C 110.594 -1.002 . . . . 0.0 110.594 -178.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.54 ' HD3' ' O ' ' A' ' 33' ' ' THR . 10.8 tpp85 -110.52 126.93 54.91 Favored 'General case' 0 C--N 1.299 -1.587 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -176.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -76.62 141.17 26.18 Favored Glycine 0 N--CA 1.441 -0.967 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.453 ' HB3' HD21 ' A' ' 37' ' ' LEU . 88.2 mt -122.95 102.04 7.78 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -178.163 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -153.13 167.75 28.24 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 -178.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -88.28 141.99 28.11 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 174.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 46.5 mm -111.62 123.42 67.42 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.546 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 13.4 m-85 -118.91 139.0 52.37 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 176.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.63 98.85 8.49 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 174.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.276 4.3 p-10 42.91 43.34 3.48 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.749 1.22 . . . . 0.0 113.714 -175.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.3 -19.48 37.08 Favored Glycine 0 N--CA 1.443 -0.878 0 C-N-CA 120.858 -0.686 . . . . 0.0 113.412 178.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.3 mttp -82.85 113.15 20.28 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 179.131 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' MET . . . . . 0.483 ' CE ' ' HB2' ' A' ' 101' ' ' GLU . 44.7 ttp -77.48 106.85 9.52 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 45.4 t -59.73 -44.32 93.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.424 -173.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -65.62 -30.05 70.72 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.483 ' HB2' ' CE ' ' A' ' 98' ' ' MET . 7.9 tp10 -62.24 -53.82 49.76 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 173.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.76 -44.5 96.65 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.047 -0.979 . . . . 0.0 112.061 -177.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 90.3 mt -56.64 -51.7 67.7 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.1 t -73.17 -38.02 53.81 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.204 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.586 -177.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 101' ' ' GLU . 3.9 tpt180 -69.46 -25.95 64.34 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.164 0.586 . . . . 0.0 111.415 -176.287 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.2 tp60 -95.67 -1.84 49.29 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.265 0.555 . . . . 0.0 109.565 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.451 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 73.23 39.71 51.63 Favored Glycine 0 N--CA 1.442 -0.953 0 CA-C-N 115.316 -0.856 . . . . 0.0 113.597 177.662 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 78.8 mt -104.24 -10.09 18.14 Favored 'General case' 0 C--N 1.296 -1.756 0 O-C-N 122.431 -0.452 . . . . 0.0 110.337 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -153.17 168.21 26.72 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.824 -177.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.561 ' HG3' ' CZ3' ' B' ' 153' ' ' TRP . 0.9 OUTLIER -99.87 168.07 10.12 Favored 'General case' 0 CA--C 1.492 -1.268 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 176.024 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 12.7 p -93.08 138.12 20.89 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.475 0 N-CA-C 106.576 -1.638 . . . . 0.0 106.576 173.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.9 122.48 32.32 Favored 'General case' 0 C--N 1.282 -2.353 0 N-CA-C 104.458 -2.423 . . . . 0.0 104.458 174.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -70.24 145.02 51.65 Favored 'General case' 0 N--CA 1.419 -2.017 0 CA-C-O 121.686 0.755 . . . . 0.0 111.474 -170.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.436 HG22 HD22 ' A' ' 38' ' ' LEU . 23.5 t -86.96 137.16 21.42 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.902 0 CA-C-N 114.277 -1.329 . . . . 0.0 109.052 -172.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -73.52 -47.81 38.08 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 114.649 -1.16 . . . . 0.0 111.794 -172.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.417 ' HE2' ' HB3' ' A' ' 121' ' ' HIS . 3.4 mppt? 69.97 146.09 0.11 Allowed Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 123.713 0.805 . . . . 0.0 110.526 -172.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_endo -46.02 -36.94 16.8 Favored 'Trans proline' 0 N--CA 1.493 1.457 0 C-N-CA 124.376 3.384 . . . . 0.0 115.937 -170.134 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 20.9 p-10 -133.7 32.58 3.56 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 120.775 0.321 . . . . 0.0 111.442 -177.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 16.2 m120 68.51 21.49 8.1 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 175.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 25.0 m -75.84 98.41 4.17 Favored 'General case' 0 C--N 1.304 -1.372 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.261 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' HIS . . . . . 0.417 ' HB3' ' HE2' ' A' ' 116' ' ' LYS . 6.5 p80 . . . . . 0 C--N 1.309 -1.195 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.196 175.249 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.338 0 N-CA-C 110.363 -1.095 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 7.3 p -77.41 79.47 3.92 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-O 121.575 0.702 . . . . 0.0 112.766 -177.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 46.3 t -119.07 87.58 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 176.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -120.11 126.63 51.21 Favored 'General case' 0 N--CA 1.427 -1.625 0 CA-C-N 115.127 -0.942 . . . . 0.0 108.995 -177.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 6.1 p90 -162.58 -179.38 6.86 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 178.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 127' ' ' VAL . . . . . 0.491 ' C ' ' H ' ' B' ' 129' ' ' LYS . 59.2 t -67.02 122.18 17.55 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 177.441 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -82.02 36.01 0.44 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 122.557 1.17 . . . . 0.0 110.776 -173.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.491 ' H ' ' C ' ' B' ' 127' ' ' VAL . 64.4 mttm 71.4 130.38 0.04 OUTLIER Pre-proline 0 C--N 1.291 -1.972 0 C-N-CA 128.128 2.571 . . . . 0.0 115.307 179.002 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 130' ' ' PRO . . . . . 0.426 ' O ' ' HB2' ' A' ' 78' ' ' LYS . 2.8 Cg_exo -76.84 -151.91 0.04 OUTLIER 'Trans proline' 0 CA--C 1.558 1.681 0 C-N-CA 123.506 2.804 . . . . 0.0 109.583 167.202 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 131' ' ' ASN . . . . . 0.464 ' OD1' ' HA3' ' A' ' 79' ' ' GLY . 1.4 m120 -85.44 98.46 10.6 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -175.22 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -142.73 10.24 1.8 Allowed 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -172.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 75.0 m -69.17 -46.2 68.1 Favored 'General case' 0 N--CA 1.427 -1.58 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -174.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -99.01 23.9 8.43 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.487 -0.758 . . . . 0.0 111.277 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -51.07 -65.72 0.51 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.789 1.236 . . . . 0.0 109.523 -178.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 136' ' ' GLN . . . . . 0.56 ' O ' ' HG3' ' B' ' 140' ' ' LYS . 14.6 mm100 -60.86 -47.55 85.88 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.038 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 84.4 mt -58.65 -49.4 77.65 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -175.292 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 138' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' B' ' 138' ' ' LEU . 28.6 mt -70.03 -26.61 64.13 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 178.101 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -71.48 -25.39 62.26 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 119.831 -0.747 . . . . 0.0 110.532 173.106 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 140' ' ' LYS . . . . . 0.56 ' HG3' ' O ' ' B' ' 136' ' ' GLN . 29.5 mtpp -72.89 -38.07 67.09 Favored 'General case' 0 C--O 1.243 0.745 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 175.644 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 15.7 m -60.88 -45.53 94.19 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.322 -0.854 . . . . 0.0 108.805 175.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.454 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 5.0 tt0 -57.9 -58.54 7.92 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.828 176.323 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -51.58 -50.73 59.57 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.614 0.766 . . . . 0.0 112.537 -176.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 144' ' ' GLN . . . . . 0.438 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 50.5 tt0 -61.37 -47.11 87.35 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.945 -178.228 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -71.69 -33.04 68.47 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.713 -176.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 146' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 77.3 mttt -64.0 -43.33 96.0 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 175.031 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -60.11 -38.46 83.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.146 178.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 148' ' ' GLU . . . . . 0.459 ' HB2' ' HG ' ' B' ' 150' ' ' LEU . 13.3 mm-40 -81.58 -17.93 46.61 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.592 -179.378 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 31.2 mtpt 54.48 60.99 3.21 Favored 'General case' 0 C--O 1.244 0.78 0 C-N-CA 124.987 1.315 . . . . 0.0 109.342 -174.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 150' ' ' LEU . . . . . 0.459 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 53.4 mt -82.78 116.86 22.31 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 113.591 -1.64 . . . . 0.0 110.841 -176.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 151' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 93.6 m-20 47.44 -89.97 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 125.371 1.469 . . . . 0.0 114.616 174.107 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 152' ' ' ILE . . . . . 0.452 HG12 ' HE3' ' A' ' 110' ' ' LYS . 6.8 tt -70.46 -27.24 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -175.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 153' ' ' TRP . . . . . 0.561 ' CZ3' ' HG3' ' A' ' 110' ' ' LYS . 56.2 m95 -74.18 -18.41 60.77 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-O 121.646 0.736 . . . . 0.0 110.612 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 8.4 t -87.19 61.66 6.84 Favored 'General case' 0 N--CA 1.426 -1.646 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 176.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -97.3 -4.64 38.33 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 114.795 -1.093 . . . . 0.0 111.688 -179.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 . . . . . 0 C--N 1.295 -1.774 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 179.935 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.243 0 N-CA-C 111.431 0.16 . . . . 0.0 111.431 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 18.3 m -75.71 -4.38 40.03 Favored 'General case' 0 CA--C 1.558 1.278 0 CA-C-O 121.623 0.725 . . . . 0.0 111.644 -178.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.3 m -77.77 -13.81 59.78 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 172.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.7 p 49.01 87.18 0.02 OUTLIER 'General case' 0 C--N 1.352 0.684 0 C-N-CA 125.422 1.489 . . . . 0.0 113.359 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -89.57 59.07 4.59 Favored 'General case' 0 N--CA 1.422 -1.862 0 CA-C-O 123.565 1.65 . . . . 0.0 110.915 -178.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -159.95 119.16 2.81 Favored 'General case' 0 N--CA 1.424 -1.767 0 N-CA-C 100.776 -3.787 . . . . 0.0 100.776 178.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . 0.289 5.5 mp -107.63 -105.08 0.34 Allowed 'General case' 0 C--N 1.287 -2.121 0 C-N-CA 117.879 -1.528 . . . . 0.0 114.988 -173.018 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.569 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 18.6 m80 -112.53 103.75 11.83 Favored 'General case' 0 CA--C 1.493 -1.24 0 C-N-CA 120.278 -0.569 . . . . 0.0 111.936 -173.467 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.439 ' HG3' ' OE1' ' A' ' 75' ' ' GLU . 18.2 mtmm -93.9 117.92 30.76 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 172.707 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.505 ' CD ' HH22 ' A' ' 81' ' ' ARG . 9.3 pt-20 -127.85 139.14 34.5 Favored Pre-proline 0 C--N 1.28 -2.44 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.479 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 17.0 Cg_exo -67.76 142.98 59.8 Favored 'Trans proline' 0 C--O 1.25 1.096 0 C-N-CA 122.443 2.095 . . . . 0.0 113.309 -178.02 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -134.43 159.27 41.61 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.439 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 7.0 m -96.91 138.62 34.17 Favored 'General case' 0 N--CA 1.423 -1.818 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 179.235 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 49.8 tp -84.97 124.01 31.19 Favored 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 120.164 -0.614 . . . . 0.0 109.5 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 75.1 mt -84.72 -52.69 12.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.532 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 174.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -179.02 163.6 1.35 Allowed 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 115.177 -0.919 . . . . 0.0 108.993 175.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.559 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -107.28 126.08 51.98 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 174.166 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.443 ' HB ' ' HB ' ' A' ' 22' ' ' THR . 44.8 mm -78.44 -64.13 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -175.582 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -113.25 -161.62 0.77 Allowed 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 178.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -97.47 27.27 19.44 Favored Glycine 0 C--N 1.296 -1.649 0 N-CA-C 108.863 -1.695 . . . . 0.0 108.863 169.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.709 ' OD2' ' HD2' ' A' ' 35' ' ' ARG . 4.9 t70 -143.78 -62.19 0.39 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 -171.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.443 ' HB ' ' HB ' ' A' ' 18' ' ' ILE . 1.8 m -83.77 128.22 34.38 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 114.631 -1.168 . . . . 0.0 108.75 178.498 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.4 m -133.23 155.65 41.07 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 C-N-CA 122.78 0.432 . . . . 0.0 110.656 -177.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -119.61 112.11 18.91 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 -176.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.1 mp -126.0 159.5 32.54 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.519 0.676 . . . . 0.0 112.532 -176.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.439 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 25.3 ttt -127.62 102.78 6.99 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.464 -1.244 . . . . 0.0 108.741 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -105.1 119.1 38.21 Favored 'General case' 0 C--N 1.287 -2.127 0 C-N-CA 118.931 -1.108 . . . . 0.0 109.867 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 88.2 mttt 59.43 27.92 17.17 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 122.092 0.948 . . . . 0.0 110.754 175.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.444 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 93.07 7.04 62.75 Favored Glycine 0 N--CA 1.439 -1.114 0 CA-C-N 114.619 -1.173 . . . . 0.0 113.245 179.013 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -105.57 101.42 32.02 Favored Pre-proline 0 C--N 1.31 -1.127 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 5.5 Cg_exo -79.67 118.3 3.82 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 122.628 2.219 . . . . 0.0 110.47 177.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 63.7 mtt -136.1 149.0 48.52 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.092 0.472 . . . . 0.0 110.819 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.6 m -83.87 107.48 16.28 Favored 'General case' 0 N--CA 1.427 -1.579 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 176.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -101.99 163.78 12.06 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-O 121.602 0.715 . . . . 0.0 110.246 -177.023 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.709 ' HD2' ' OD2' ' A' ' 21' ' ' ASP . 25.3 ttp85 -137.46 141.79 41.58 Favored 'General case' 0 C--N 1.27 -2.88 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 169.317 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.542 ' HB2' ' HB ' ' A' ' 39' ' ' VAL . 28.6 mt -60.94 109.43 1.07 Allowed 'General case' 0 C--N 1.307 -1.261 0 O-C-N 124.115 0.884 . . . . 0.0 109.213 -177.572 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.4 tt -63.71 126.29 27.1 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 -179.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.45 ' C ' ' H ' ' A' ' 112' ' ' ALA . 91.0 mt 85.99 8.48 0.31 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.16 1.784 . . . . 0.0 113.85 -178.037 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.542 ' HB ' ' HB2' ' A' ' 36' ' ' LEU . 99.7 t -118.33 130.93 72.48 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.15 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 176.257 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -133.53 107.86 8.27 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 177.593 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.423 ' HB ' ' HD3' ' A' ' 42' ' ' PRO . 3.8 m -106.87 -56.3 0.06 OUTLIER Pre-proline 0 CA--C 1.569 1.68 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -177.002 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.423 ' HD3' ' HB ' ' A' ' 41' ' ' THR . 9.8 Cg_endo -92.29 13.11 1.95 Allowed 'Trans proline' 0 C--N 1.382 2.292 0 C-N-CA 122.273 1.982 . . . . 0.0 111.788 -175.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -138.26 152.27 48.41 Favored 'General case' 0 N--CA 1.419 -1.975 0 N-CA-C 103.799 -2.667 . . . . 0.0 103.799 178.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.8 m 63.81 20.98 12.48 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-O 121.975 0.893 . . . . 0.0 108.961 -175.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.686 ' O ' ' HD2' ' A' ' 47' ' ' PRO . 22.5 tptp -69.63 -37.91 77.0 Favored 'General case' 0 N--CA 1.436 -1.161 0 O-C-N 121.721 -0.612 . . . . 0.0 111.693 -174.208 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . 0.38 86.3 t60 87.84 -77.65 0.0 OUTLIER Pre-proline 0 N--CA 1.485 1.308 0 C-N-CA 124.702 1.201 . . . . 0.0 113.221 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.686 ' HD2' ' O ' ' A' ' 45' ' ' LYS . 37.0 Cg_endo -72.07 119.18 6.01 Favored 'Trans proline' 0 C--N 1.375 1.933 0 CA-C-N 122.731 2.011 . . . . 0.0 109.448 169.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -20.35 61.49 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-O 120.92 0.391 . . . . 0.0 111.704 -175.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.556 ' NZ ' ' HA ' ' A' ' 49' ' ' LYS . 1.3 mmpm? -90.96 3.73 53.86 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 121.503 0.668 . . . . 0.0 110.585 175.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -95.93 1.06 62.95 Favored Glycine 0 N--CA 1.425 -2.048 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.876 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 12.7 p -84.78 -35.58 10.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 117.485 0.642 . . . . 0.0 110.526 -178.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -77.87 -26.82 49.49 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 178.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -78.38 -48.36 15.69 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 114.873 -1.058 . . . . 0.0 112.149 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.587 ' OH ' ' HA ' ' A' ' 108' ' ' LEU . 3.0 t80 -88.78 -28.79 20.24 Favored 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.886 -174.008 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -43.77 -58.0 4.38 Favored Glycine 0 CA--C 1.536 1.365 0 N-CA-C 115.186 0.834 . . . . 0.0 115.186 -175.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -56.49 -32.08 88.24 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 123.035 2.49 . . . . 0.0 113.984 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -68.21 -57.1 6.55 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.918 0.39 . . . . 0.0 111.616 -176.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.3 -41.41 98.95 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.559 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 37.0 m -63.96 -35.69 81.5 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.137 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.94 -37.86 88.71 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.023 0.44 . . . . 0.0 110.333 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -68.91 -53.09 22.98 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.774 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 28.5 m -57.11 -48.11 79.45 Favored 'General case' 0 C--N 1.318 -0.79 0 O-C-N 124.101 0.876 . . . . 0.0 112.306 -178.009 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.559 ' HG2' ' HB3' ' A' ' 17' ' ' ALA . 51.8 mttp -60.61 -54.54 44.16 Favored 'General case' 0 C--N 1.344 0.359 0 C-N-CA 120.962 -0.295 . . . . 0.0 110.963 -178.609 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.6 mtmp? -67.5 -23.24 65.45 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.194 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 15.5 tpt -67.05 -45.11 78.4 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.21 0.529 . . . . 0.0 109.629 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.0 m -86.93 -26.13 6.06 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.438 -178.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 63' ' ' LYS . 51.0 mt-10 -73.9 -34.15 64.29 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.368 177.608 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -83.96 -16.34 44.47 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 121.01 0.433 . . . . 0.0 110.415 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.74 143.12 48.03 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.018 -178.163 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 44.2 mttp -74.44 -44.31 52.34 Favored 'General case' 0 CA--C 1.493 -1.236 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.408 ' HB2' ' HE3' ' A' ' 71' ' ' LYS . 42.2 mtmt -133.78 147.35 51.26 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-N 113.846 -1.524 . . . . 0.0 107.047 -179.43 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.448 ' O ' ' HA ' ' A' ' 11' ' ' PRO . 4.0 mp -105.9 120.99 57.67 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.719 0 N-CA-C 105.106 -2.183 . . . . 0.0 105.106 173.467 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.627 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 23.9 mm-40 -111.83 132.95 54.36 Favored 'General case' 0 C--N 1.292 -1.908 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 -175.104 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.6 m -112.3 129.72 67.32 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.989 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 175.304 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.569 ' HA ' ' O ' ' A' ' 8' ' ' HIS . 28.4 tt0 -106.52 118.97 38.04 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 119.525 -0.87 . . . . 0.0 111.229 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -87.24 124.24 33.1 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-N 113.395 -1.729 . . . . 0.0 109.232 177.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -88.31 -175.58 5.06 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 177.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.55 -3.81 56.08 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -173.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -93.2 -87.67 1.59 Allowed Glycine 0 N--CA 1.435 -1.421 0 C-N-CA 119.913 -1.137 . . . . 0.0 112.473 -177.426 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -125.59 139.24 53.75 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -175.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.505 HH22 ' CD ' ' A' ' 10' ' ' GLU . 25.6 ttt180 -98.96 -13.35 19.99 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.648 0.737 . . . . 0.0 109.129 178.012 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 13.6 p -141.93 159.1 42.92 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.333 177.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.29 -168.9 1.94 Allowed 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.557 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -71.77 -31.42 66.62 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-O 120.632 0.253 . . . . 0.0 111.561 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -79.86 -22.23 43.14 Favored 'General case' 0 C--O 1.244 0.785 0 CA-C-O 121.227 0.537 . . . . 0.0 110.814 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 105.55 28.5 5.39 Favored Glycine 0 N--CA 1.437 -1.25 0 C-N-CA 120.808 -0.711 . . . . 0.0 111.895 176.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 12.2 mmt85 -94.74 139.19 31.58 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 174.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -74.78 121.22 6.62 Favored Glycine 0 N--CA 1.425 -2.033 0 O-C-N 123.712 0.632 . . . . 0.0 111.575 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.3 mt -103.58 93.05 4.72 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 178.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -145.13 155.08 43.1 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -179.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -85.25 132.04 34.33 Favored 'General case' 0 C--N 1.29 -2.02 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 48.3 mm -99.5 126.38 52.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 C-N-CA 119.247 -0.981 . . . . 0.0 110.073 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.627 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 27.0 m-85 -120.3 144.07 48.01 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 114.682 -1.145 . . . . 0.0 109.125 179.078 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -106.67 99.54 9.11 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 176.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.5 p30 42.79 38.31 1.32 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 125.146 1.378 . . . . 0.0 113.907 -176.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.78 -11.4 38.35 Favored Glycine 0 N--CA 1.444 -0.785 0 CA-C-N 115.449 -0.796 . . . . 0.0 114.131 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -87.63 135.27 33.43 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 176.063 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' MET . . . . . 0.602 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 3.6 mpp? -80.4 111.69 17.04 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 177.801 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 82.8 t -70.14 -45.63 75.28 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 19.1 m-20 -55.35 -50.13 70.46 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.421 -179.193 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' A' ' 105' ' ' ARG . 9.3 tp10 -55.8 -51.01 68.94 Favored 'General case' 0 C--O 1.211 -0.96 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.226 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.93 -43.29 95.04 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.829 -176.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 79.0 mt -60.29 -48.98 79.42 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 179.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 52.1 t -73.06 -31.5 35.47 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.47 -178.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.454 ' HB2' ' O ' ' A' ' 101' ' ' GLU . 1.8 tpt180 -72.57 -28.02 62.55 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.997 -178.654 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -87.51 -8.7 56.06 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.239 0.543 . . . . 0.0 109.76 175.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.97 41.52 87.48 Favored Glycine 0 N--CA 1.431 -1.695 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.186 -176.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.587 ' HA ' ' OH ' ' A' ' 54' ' ' TYR . 90.7 mt -96.89 -18.21 19.66 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.063 0.459 . . . . 0.0 110.768 179.421 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -149.7 171.32 16.88 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -176.058 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -110.2 171.55 7.38 Favored 'General case' 0 N--CA 1.425 -1.678 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.415 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 8.0 p -84.01 133.35 29.39 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.782 0 CA-C-O 121.066 0.46 . . . . 0.0 110.359 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.45 ' H ' ' C ' ' A' ' 38' ' ' LEU . . . -88.46 121.63 31.06 Favored 'General case' 0 CA--C 1.486 -1.503 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 176.403 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -77.66 133.8 38.3 Favored 'General case' 0 C--N 1.28 -2.431 0 CA-C-N 114.841 -1.072 . . . . 0.0 111.769 -171.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 44.5 t -88.3 127.75 41.08 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.876 0 N-CA-C 103.857 -2.646 . . . . 0.0 103.857 169.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -81.46 -17.89 47.18 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -165.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 9.6 mptt 69.45 121.99 0.03 OUTLIER Pre-proline 0 N--CA 1.474 0.761 0 C-N-CA 123.998 0.919 . . . . 0.0 111.958 -175.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.433 ' HD2' ' HG3' ' B' ' 130' ' ' PRO . 30.5 Cg_endo -97.45 -166.43 0.1 OUTLIER 'Trans proline' 0 N--CA 1.435 -1.935 0 C-N-CA 122.249 1.966 . . . . 0.0 109.151 173.15 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -102.75 -65.3 1.0 Allowed 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 176.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -164.18 99.17 0.84 Allowed 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -178.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 13.0 p -79.0 -34.39 44.08 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-O 120.826 0.346 . . . . 0.0 110.75 -179.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 . . . . . 0 N--CA 1.435 -1.185 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 178.737 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.442 0 N-CA-C 110.901 -0.88 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 50.6 m -89.78 18.05 5.99 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.91 0.355 . . . . 0.0 111.083 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 7.7 p -63.91 111.57 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.83 0 CA-C-O 121.243 0.544 . . . . 0.0 110.936 177.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . 54.78 -100.65 0.11 Allowed 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 124.668 1.187 . . . . 0.0 112.884 -178.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -170.26 99.81 0.27 Allowed 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 106.19 -1.782 . . . . 0.0 106.19 -177.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 60.6 t -97.82 121.49 48.41 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.862 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.667 -177.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -72.2 101.76 2.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.629 0.728 . . . . 0.0 110.391 172.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.422 ' HB3' ' CD ' ' B' ' 130' ' ' PRO . 59.1 mtpt -91.13 174.16 4.73 Favored Pre-proline 0 C--N 1.304 -1.382 0 CA-C-N 114.363 -1.289 . . . . 0.0 110.035 -179.13 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 130' ' ' PRO . . . . . 0.433 ' HG3' ' HD2' ' A' ' 117' ' ' PRO . 2.0 Cg_endo -74.58 172.59 15.88 Favored 'Trans proline' 0 C--N 1.37 1.675 0 C-N-CA 121.719 1.613 . . . . 0.0 112.456 -179.105 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -89.15 41.97 1.06 Allowed 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.403 ' HA ' ' HB2' ' B' ' 135' ' ' GLU . 26.9 p-10 -97.69 9.14 43.32 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.995 -174.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.57 -37.61 73.44 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-O 122.036 0.922 . . . . 0.0 110.88 -179.358 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 63.0 m80 -103.83 -0.45 29.19 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.498 -0.773 . . . . 0.0 109.852 -177.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.403 ' HB2' ' HA ' ' B' ' 132' ' ' ASN . 25.1 tt0 -66.66 -38.03 86.01 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.902 -176.112 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -58.52 -37.93 76.65 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.153 -178.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.1 mt -64.83 -51.09 64.01 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.811 -178.115 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 8.2 mp -70.25 -23.26 62.87 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 178.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 84.9 mtt-85 -66.03 -31.24 72.02 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.278 -0.569 . . . . 0.0 110.537 174.051 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 140' ' ' LYS . . . . . 0.561 ' HE2' ' HA ' ' B' ' 140' ' ' LYS . 10.8 mmpt? -71.35 -39.7 71.15 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 176.022 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 3.5 m -59.99 -49.73 76.52 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.672 177.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.498 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 0.8 OUTLIER -64.22 -43.17 95.79 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.838 179.04 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 143' ' ' ALA . . . . . 0.403 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -61.66 -40.93 96.68 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.995 0.426 . . . . 0.0 110.888 179.125 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -69.21 -48.02 63.19 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.453 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.55 -32.49 73.87 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.564 -0.743 . . . . 0.0 112.081 -175.066 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 146' ' ' LYS . . . . . 0.498 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 84.0 mttt -65.33 -40.38 93.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.498 0.19 . . . . 0.0 110.648 174.009 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 147' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 48.4 mmtm -64.79 -37.88 89.11 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.501 0.667 . . . . 0.0 109.582 178.078 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 148' ' ' GLU . . . . . 0.407 ' HB2' ' HG ' ' B' ' 150' ' ' LEU . 49.3 mm-40 -79.24 -13.87 59.41 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 114.709 -1.132 . . . . 0.0 113.043 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm 54.32 47.49 22.86 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.54 0.736 . . . . 0.0 109.834 -178.283 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 150' ' ' LEU . . . . . 0.407 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 96.3 mt -74.98 95.59 3.02 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 114.943 -1.026 . . . . 0.0 112.0 -174.454 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 51.9 t30 53.92 -69.84 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 127.775 2.43 . . . . 0.0 114.154 173.088 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 12.0 tt -75.84 -28.74 19.48 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.075 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -78.13 -15.58 58.73 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.365 0.602 . . . . 0.0 111.407 -178.225 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 22.9 t -88.8 11.09 18.77 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.548 177.185 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -66.79 -28.73 68.62 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.147 0.579 . . . . 0.0 112.41 -178.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.1 t70 . . . . . 0 C--N 1.299 -1.592 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 -170.577 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.514 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 86.0 m -77.08 100.44 5.7 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 121.597 0.713 . . . . 0.0 110.179 177.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.5 p -90.53 -15.19 31.14 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.669 -177.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.413 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 10.5 m -66.15 -39.34 89.74 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 176.51 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 4' ' ' THR . 92.0 mttt 73.1 -178.19 0.19 Allowed 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 114.515 -1.221 . . . . 0.0 111.456 -173.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -135.68 -150.99 0.4 Allowed 'General case' 0 C--N 1.291 -1.943 0 N-CA-C 105.69 -1.967 . . . . 0.0 105.69 175.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.431 ' HB3' ' O ' ' A' ' 76' ' ' PHE . 64.0 mt 64.75 -158.86 0.29 Allowed 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 179.505 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.426 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 7.7 m-70 -117.11 102.91 9.71 Favored 'General case' 0 C--N 1.292 -1.914 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 174.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.52 107.48 15.21 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 105.022 -2.214 . . . . 0.0 105.022 175.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -138.99 159.0 68.73 Favored Pre-proline 0 C--N 1.3 -1.582 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.454 -173.415 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -78.94 147.17 21.06 Favored 'Trans proline' 0 C--O 1.25 1.075 0 C-N-CA 122.729 2.286 . . . . 0.0 114.123 -174.424 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -144.14 155.59 43.99 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.343 177.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.437 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 9.1 m -104.35 142.67 34.16 Favored 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 179.108 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -84.22 142.9 29.95 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 118.109 -1.437 . . . . 0.0 109.538 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 70.4 mt -103.0 -57.59 4.4 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.055 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 171.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 51.1 mttm -152.57 154.14 34.81 Favored 'General case' 0 N--CA 1.428 -1.536 0 C-N-CA 124.013 0.925 . . . . 0.0 110.552 -178.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.516 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -108.8 95.97 6.01 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 105.824 -1.917 . . . . 0.0 105.824 169.647 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 60.5 mt -68.4 -37.67 78.21 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.923 -171.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -152.44 -165.03 2.09 Favored 'General case' 0 C--N 1.291 -1.97 0 N-CA-C 106.366 -1.716 . . . . 0.0 106.366 -176.12 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -90.96 -25.76 23.82 Favored Glycine 0 C--N 1.286 -2.206 0 N-CA-C 109.029 -1.628 . . . . 0.0 109.029 176.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.698 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 10.5 t70 -92.87 -36.32 12.88 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 122.035 0.922 . . . . 0.0 109.504 -177.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.8 m -114.13 127.29 55.85 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 114.902 -1.045 . . . . 0.0 111.294 -173.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.9 p -132.79 153.75 38.54 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.629 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -178.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -112.85 112.96 24.82 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 -175.514 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -115.75 159.1 21.86 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.764 0.792 . . . . 0.0 111.737 -178.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.437 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 46.7 ttm -123.01 104.85 9.49 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 175.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -109.87 118.13 35.67 Favored 'General case' 0 C--N 1.286 -2.158 0 C-N-CA 118.147 -1.421 . . . . 0.0 109.626 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 78.9 mttt 62.41 27.69 16.46 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.222 1.009 . . . . 0.0 110.199 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.08 1.86 64.74 Favored Glycine 0 CA--C 1.524 0.598 0 CA-C-N 115.365 -0.834 . . . . 0.0 113.164 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.411 ' HA ' ' HD3' ' A' ' 31' ' ' PRO . 53.7 tt0 -104.11 107.55 57.5 Favored Pre-proline 0 C--N 1.32 -0.68 0 O-C-N 122.462 -0.434 . . . . 0.0 110.48 -179.108 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 30' ' ' GLN . 2.7 Cg_endo -83.23 120.31 2.9 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.119 2.546 . . . . 0.0 111.992 178.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' MET . . . . . 0.49 ' HB2' ' CE2' ' A' ' 34' ' ' PHE . 90.4 mtp -134.82 156.35 49.04 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 120.892 0.377 . . . . 0.0 110.273 178.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.2 m -92.98 119.5 32.31 Favored 'General case' 0 C--N 1.295 -1.786 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.49 ' CE2' ' HB2' ' A' ' 32' ' ' MET . 86.0 m-85 -116.78 142.57 46.75 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -176.149 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.698 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 31.6 mtm105 -106.3 153.89 21.54 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 166.119 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.527 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 73.9 mt -83.82 129.4 34.94 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-O 121.651 0.738 . . . . 0.0 112.464 -175.027 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.429 HD13 ' HB2' ' A' ' 77' ' ' ASP . 52.5 mt -57.04 130.29 45.45 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.452 176.107 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.602 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 78.5 mt 73.55 11.27 4.79 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 124.551 1.157 . . . . 0.0 112.481 177.603 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 86.3 t -110.84 131.05 63.08 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 CA-C-O 121.252 0.548 . . . . 0.0 110.646 -179.015 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.404 ' HB2' ' HB2' ' A' ' 112' ' ' ALA . 22.0 t70 -128.31 107.17 9.54 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 174.623 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.57 ' HB ' ' HB2' ' A' ' 21' ' ' ASP . 1.3 m -114.52 -27.22 0.11 Allowed Pre-proline 0 C--N 1.287 -2.11 0 CA-C-O 118.139 -0.934 . . . . 0.0 112.357 175.299 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.42 ' CD ' ' H ' ' A' ' 41' ' ' THR . 75.7 Cg_exo -55.32 109.55 0.43 Allowed 'Trans proline' 1 C--N 1.426 4.629 0 CA-C-N 121.873 1.705 . . . . 0.0 110.689 177.167 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.427 ' HB3' ' HE3' ' A' ' 53' ' ' LYS . 2.3 tm-20 -83.2 123.23 29.37 Favored 'General case' 0 N--CA 1.414 -2.269 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 -177.071 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.1 t -124.8 0.74 8.08 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -174.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.572 ' NZ ' ' HB2' ' B' ' 155' ' ' GLU . 35.5 ttpt -82.78 -44.31 15.7 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 35.2 m170 72.77 104.58 0.03 OUTLIER Pre-proline 0 CA--C 1.505 -0.786 0 CA-C-N 113.574 -1.648 . . . . 0.0 111.403 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -64.56 -35.33 48.7 Favored 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 123.015 2.477 . . . . 0.0 112.152 -175.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt 72.93 -41.62 0.51 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.172 1.389 . . . . 0.0 111.597 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -36.13 83.02 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 124.867 1.267 . . . . 0.0 113.889 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 172.29 -163.25 35.4 Favored Glycine 0 CA--C 1.502 -0.732 0 C-N-CA 120.361 -0.923 . . . . 0.0 111.417 -177.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.7 p -81.57 79.14 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 CA-C-O 122.877 1.322 . . . . 0.0 112.539 -176.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -90.81 -12.65 35.74 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.235 -1.348 . . . . 0.0 108.289 176.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.427 ' HE3' ' HB3' ' A' ' 43' ' ' GLU . 43.6 mtpt -66.63 -37.41 84.77 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-N 114.484 -1.234 . . . . 0.0 112.12 -175.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 75.1 m-85 59.37 27.34 16.42 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.77 0.828 . . . . 0.0 113.101 -178.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -51.14 -55.78 17.43 Favored Glycine 0 CA--C 1.54 1.643 0 CA-C-N 115.287 -0.87 . . . . 0.0 113.451 177.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo -56.26 -36.34 96.73 Favored 'Trans proline' 0 C--N 1.373 1.837 0 C-N-CA 122.911 2.407 . . . . 0.0 112.517 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.8 mp0 -62.36 -51.77 66.3 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 122.973 0.509 . . . . 0.0 110.406 178.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.29 -41.64 85.07 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.841 -178.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.0 m -67.83 -33.97 75.81 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.395 0.617 . . . . 0.0 111.357 -177.133 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -70.95 -39.07 72.8 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.042 175.508 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -62.8 -41.95 99.5 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.318 -176.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.537 ' O ' HG22 ' A' ' 66' ' ' VAL . 7.5 p -63.47 -44.61 93.92 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.85 178.331 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.516 ' HG2' ' HB3' ' A' ' 17' ' ' ALA . 9.1 mtpm? -57.67 -49.03 77.84 Favored 'General case' 0 CA--C 1.513 -0.475 0 O-C-N 123.385 0.428 . . . . 0.0 110.472 176.323 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 97.1 mttt -57.36 -39.89 76.92 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.139 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.6 mmt -72.19 -51.38 21.44 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.537 HG22 ' O ' ' A' ' 62' ' ' THR . 34.6 m -74.33 -27.21 21.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 -174.018 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -86.19 -20.15 28.98 Favored 'General case' 0 C--N 1.314 -0.953 0 O-C-N 121.847 -0.533 . . . . 0.0 110.577 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -83.59 -24.66 31.4 Favored 'General case' 0 C--O 1.245 0.856 0 CA-C-O 121.158 0.504 . . . . 0.0 109.822 174.204 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.57 131.25 38.32 Favored 'General case' 0 C--O 1.248 1.013 0 CA-C-N 114.819 -1.082 . . . . 0.0 112.027 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -82.99 -37.49 23.94 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 115.117 -0.947 . . . . 0.0 108.69 177.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -133.09 119.8 20.46 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.781 -1.1 . . . . 0.0 108.182 -178.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 63.4 mt -99.51 112.56 32.17 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.658 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -114.31 142.14 46.7 Favored 'General case' 0 C--N 1.289 -2.023 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.083 -177.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -110.34 124.95 67.53 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.756 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.426 ' HA ' ' O ' ' A' ' 8' ' ' HIS . 34.2 tt0 -115.28 125.62 53.51 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.431 ' O ' ' HB3' ' A' ' 7' ' ' LEU . 29.8 t80 -96.55 129.18 43.98 Favored 'General case' 0 N--CA 1.406 -2.627 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.851 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.429 ' HB2' HD13 ' A' ' 37' ' ' LEU . 17.2 t70 -85.51 -174.37 5.14 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 125.117 1.367 . . . . 0.0 110.031 -176.462 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.655 ' NZ ' ' HA ' ' A' ' 78' ' ' LYS . 1.1 mmpm? -94.78 7.85 44.52 Favored 'General case' 0 C--N 1.313 -0.993 0 O-C-N 121.458 -0.776 . . . . 0.0 112.144 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.578 ' HA3' ' CG1' ' A' ' 114' ' ' VAL . . . -84.15 -137.2 3.43 Favored Glycine 0 N--CA 1.428 -1.867 0 C-N-CA 120.775 -0.726 . . . . 0.0 111.899 175.281 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -95.23 144.22 26.01 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.6 ttm180 -87.07 -29.18 22.09 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.162 0.506 . . . . 0.0 110.528 178.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.0 p -101.97 142.94 32.47 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-O 121.353 0.597 . . . . 0.0 111.561 -178.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -91.63 149.66 21.54 Favored 'General case' 0 C--N 1.287 -2.14 0 CA-C-N 115.052 -0.976 . . . . 0.0 111.125 179.08 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -17.3 63.98 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 124.555 1.142 . . . . 0.0 113.531 -178.307 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -97.15 -2.36 43.19 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.623 0.725 . . . . 0.0 109.65 179.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 101.87 24.85 8.34 Favored Glycine 0 N--CA 1.438 -1.176 0 C-N-CA 120.553 -0.832 . . . . 0.0 113.037 177.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.504 ' HG2' ' HG3' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -106.71 -178.71 3.73 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 122.048 -0.678 . . . . 0.0 110.176 174.656 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -103.76 152.28 17.79 Favored Glycine 0 N--CA 1.42 -2.374 0 N-CA-C 106.859 -2.496 . . . . 0.0 106.859 168.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 93.6 mt -109.03 122.5 47.39 Favored 'General case' 0 C--N 1.282 -2.333 0 CA-C-N 117.972 0.886 . . . . 0.0 110.442 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -144.16 157.85 44.06 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.116 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.487 ' CZ ' ' HB2' ' A' ' 100' ' ' ASN . 4.3 t80 -103.83 129.73 51.32 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 105.546 -2.02 . . . . 0.0 105.546 174.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 41.6 mm -99.32 125.73 52.8 Favored 'Isoleucine or valine' 0 C--O 1.249 1.042 0 C-N-CA 119.731 -0.788 . . . . 0.0 111.892 -178.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -110.79 131.6 54.91 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.983 173.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.67 98.26 8.03 Favored 'General case' 0 C--N 1.289 -2.052 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 175.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.251 4.1 p30 44.92 32.12 0.79 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.209 1.404 . . . . 0.0 114.137 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.21 2.16 35.77 Favored Glycine 0 CA--C 1.521 0.442 0 CA-C-N 115.676 -0.693 . . . . 0.0 113.445 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.7 mttp -99.78 126.88 45.92 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 175.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -78.13 105.5 9.39 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 122.815 0.446 . . . . 0.0 110.401 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 57.6 t -71.51 -43.05 72.46 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.332 -178.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.527 ' ND2' ' HB3' ' A' ' 36' ' ' LEU . 1.7 m-20 -58.76 -49.82 76.2 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.957 -178.719 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -63.84 -37.16 86.34 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.542 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.55 -44.6 93.19 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.898 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.13 -52.75 64.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.747 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.1 t -65.05 -41.45 92.02 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.276 -177.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 34.4 ttp85 -64.23 -31.98 73.39 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.922 0.391 . . . . 0.0 111.291 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -87.99 -1.05 57.75 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.954 0.354 . . . . 0.0 111.954 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.433 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 74.44 22.14 77.85 Favored Glycine 0 N--CA 1.441 -0.997 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.428 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.3 mt -91.67 -6.24 52.44 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -151.85 162.95 40.22 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.005 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt -120.34 154.74 34.62 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 178.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.6 p -76.98 127.97 37.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 C-N-CA 118.656 -1.218 . . . . 0.0 112.28 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.602 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . -97.58 121.05 39.03 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 105.225 -2.139 . . . . 0.0 105.225 171.083 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.503 ' OH ' ' HA ' ' B' ' 130' ' ' PRO . 31.5 t80 -78.12 129.13 34.81 Favored 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 118.783 -1.167 . . . . 0.0 112.386 -173.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.578 ' CG1' ' HA3' ' A' ' 79' ' ' GLY . 95.4 t -99.56 120.01 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.952 0 CA-C-N 114.649 -1.16 . . . . 0.0 108.905 178.407 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -97.34 140.29 32.03 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -77.31 115.65 50.97 Favored Pre-proline 0 N--CA 1.42 -1.961 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 173.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -89.0 9.51 3.56 Favored 'Trans proline' 0 C--N 1.309 -1.552 0 C-N-CA 122.505 2.137 . . . . 0.0 113.064 -171.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 76.62 -24.65 0.22 Allowed 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 124.118 0.967 . . . . 0.0 111.909 -178.315 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 79.12 -36.54 0.17 Allowed 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.49 1.516 . . . . 0.0 112.396 174.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 28.6 m -82.17 -42.97 18.31 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 176.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 16.0 t-80 . . . . . 0 C--N 1.317 -0.83 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.383 178.659 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.477 0 N-CA-C 110.859 -0.897 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 19.0 m -126.86 111.1 13.77 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.346 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 7.6 p -165.27 144.25 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -71.3 116.46 11.65 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -176.319 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 126' ' ' TYR . . . . . 0.583 ' CE1' ' HB2' ' B' ' 128' ' ' TYR . 0.2 OUTLIER -154.56 172.78 17.27 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.194 173.398 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 27.7 m -88.43 -33.78 6.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 C-N-CA 121.039 -0.264 . . . . 0.0 111.574 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 128' ' ' TYR . . . . . 0.583 ' HB2' ' CE1' ' B' ' 126' ' ' TYR . 24.5 t80 51.11 74.74 0.22 Allowed 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 124.721 1.208 . . . . 0.0 110.983 -175.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -103.54 103.34 35.4 Favored Pre-proline 0 C--N 1.295 -1.764 0 N-CA-C 105.468 -2.049 . . . . 0.0 105.468 173.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 130' ' ' PRO . . . . . 0.503 ' HA ' ' OH ' ' A' ' 113' ' ' TYR . 9.3 Cg_exo -67.02 116.33 4.1 Favored 'Trans proline' 0 N--CA 1.446 -1.301 0 C-N-CA 122.093 1.862 . . . . 0.0 113.146 -174.215 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 131' ' ' ASN . . . . . 0.402 ' C ' ' H ' ' B' ' 133' ' ' THR . 26.6 p-10 -60.38 -50.44 73.58 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 170.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.512 ' HA ' ' HB3' ' B' ' 135' ' ' GLU . 16.7 t-20 73.15 -10.91 0.95 Allowed 'General case' 0 CA--C 1.508 -0.663 0 C-N-CA 127.982 2.513 . . . . 0.0 112.523 168.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 133' ' ' THR . . . . . 0.402 ' H ' ' C ' ' B' ' 131' ' ' ASN . 0.7 OUTLIER -62.15 -32.29 72.88 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-N 113.87 -1.514 . . . . 0.0 112.263 -176.447 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 69.9 m80 -139.24 10.83 2.56 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 176.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.512 ' HB3' ' HA ' ' B' ' 132' ' ' ASN . 45.0 tt0 -60.64 -59.84 4.75 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.467 -174.318 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 136' ' ' GLN . . . . . 0.464 ' O ' ' HG2' ' B' ' 140' ' ' LYS . 13.7 mm100 -54.99 -44.57 74.6 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 123.946 0.779 . . . . 0.0 111.885 -176.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 91.2 mt -60.24 -47.4 86.14 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.652 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.58 -35.5 75.4 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 178.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -60.62 -45.21 94.89 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 120.759 0.314 . . . . 0.0 110.296 176.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 140' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' B' ' 136' ' ' GLN . 2.8 mmmp? -63.43 -44.91 93.21 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.436 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 8.1 p -70.2 -41.07 74.17 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.327 -178.193 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.529 ' HG3' ' CZ2' ' B' ' 153' ' ' TRP . 39.3 tt0 -65.94 -44.84 83.86 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.516 177.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -54.29 -43.4 71.03 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 120.999 0.428 . . . . 0.0 110.591 -179.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -64.73 -46.85 80.47 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.526 178.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.13 -35.73 80.36 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.915 -178.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 146' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 88.8 mttt -62.33 -38.77 90.76 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.971 0.415 . . . . 0.0 110.334 176.187 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 9.9 mtpm? -63.99 -40.63 96.79 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.226 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -86.35 -8.12 57.94 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.337 -175.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 149' ' ' LYS . . . . . 0.515 ' O ' ' HB2' ' B' ' 154' ' ' SER . 51.0 mtpt 49.7 58.83 5.0 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 124.092 0.957 . . . . 0.0 111.119 -177.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 90.8 mt -88.52 119.51 29.04 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.299 -178.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 151' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 90.9 m-20 52.5 -93.46 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.163 1.385 . . . . 0.0 113.885 176.021 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 35.3 mt -65.64 -31.4 53.61 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.593 0 CA-C-O 121.087 0.47 . . . . 0.0 110.569 178.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 153' ' ' TRP . . . . . 0.529 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 58.8 m95 -77.94 -6.49 54.54 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-O 122.101 0.953 . . . . 0.0 111.117 -178.792 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 154' ' ' SER . . . . . 0.515 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 19.9 t -99.87 18.62 17.87 Favored 'General case' 0 N--CA 1.411 -2.4 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.14 175.082 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 155' ' ' GLU . . . . . 0.572 ' HB2' ' NZ ' ' A' ' 45' ' ' LYS . 10.0 pt-20 -71.25 -17.62 62.48 Favored 'General case' 0 C--N 1.356 0.86 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 173.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.1 t70 . . . . . 0 CA--C 1.5 -0.966 0 CA-C-N 113.339 -1.755 . . . . 0.0 112.1 175.08 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.273 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.6 m -63.56 -52.86 59.24 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 177.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.8 m 57.55 76.04 0.34 Allowed 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.271 -1.332 . . . . 0.0 114.504 176.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 15.2 p -122.97 -39.26 2.52 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.624 176.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -91.79 -29.21 16.89 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.22 178.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.01 168.8 16.77 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.3 mt -91.4 -175.39 4.22 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -173.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 25.5 p80 -123.61 102.17 7.71 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.135 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.579 ' H ' ' HD3' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -94.49 132.23 39.37 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 174.7 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.48 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 3.9 pt-20 -117.38 144.37 33.85 Favored Pre-proline 0 C--N 1.262 -3.217 0 CA-C-N 114.423 -1.262 . . . . 0.0 110.847 -175.592 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.48 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 23.5 Cg_exo -63.92 138.91 65.34 Favored 'Trans proline' 0 C--N 1.359 1.098 0 C-N-CA 123.07 2.514 . . . . 0.0 114.301 -174.214 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.587 ' O ' ' HB ' ' A' ' 72' ' ' ILE . . . -136.08 151.68 50.08 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.488 178.257 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.418 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 86.7 m -98.94 133.2 43.55 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 178.158 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.489 ' H ' HD23 ' A' ' 14' ' ' LEU . 2.2 pt? -80.93 141.31 34.64 Favored 'General case' 0 C--N 1.306 -1.292 0 C-N-CA 118.498 -1.281 . . . . 0.0 109.255 177.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 74.1 mt -101.36 -53.56 7.51 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 175.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -161.67 156.99 23.82 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.489 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.473 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -112.54 119.11 37.06 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 174.64 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 59.8 mt -85.71 -64.03 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 CA-C-O 121.192 0.52 . . . . 0.0 109.747 -175.069 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -135.93 -168.79 2.28 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.172 -0.922 . . . . 0.0 108.526 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -74.11 -22.54 77.69 Favored Glycine 0 C--N 1.314 -0.661 0 C-N-CA 120.657 -0.783 . . . . 0.0 112.615 -177.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.438 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 9.6 p-10 -100.63 -20.36 15.69 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 122.304 0.242 . . . . 0.0 110.756 -176.628 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 p -127.73 118.8 24.46 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.3 m -128.11 157.45 40.33 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.916 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 176.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -119.89 119.22 32.87 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -178.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.9 mp -125.25 159.57 31.33 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.501 0.667 . . . . 0.0 112.2 -175.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.455 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 48.0 ttm -122.8 107.09 11.51 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 124.177 0.991 . . . . 0.0 108.497 177.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -113.18 126.89 55.93 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.9 mttt 59.0 27.66 16.66 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 121.613 0.721 . . . . 0.0 111.0 178.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 88.03 7.05 74.49 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.749 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.455 ' O ' ' HA ' ' A' ' 26' ' ' MET . 17.6 mm-40 -103.88 104.11 41.11 Favored Pre-proline 0 C--N 1.319 -0.74 0 O-C-N 122.422 -0.457 . . . . 0.0 110.511 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -81.07 113.83 2.77 Favored 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.623 2.215 . . . . 0.0 110.685 176.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 65.6 mtt -135.14 149.85 50.07 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.6 m -87.75 129.68 35.09 Favored 'General case' 0 C--N 1.295 -1.804 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 175.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -113.51 138.9 49.47 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -173.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.438 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 10.6 tpp85 -107.99 129.46 55.12 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 106.324 -1.732 . . . . 0.0 106.324 168.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.406 HD22 HD12 ' A' ' 103' ' ' LEU . 6.9 mp -64.94 122.02 16.02 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.5 0.667 . . . . 0.0 111.066 178.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.4 tt -66.35 130.18 42.33 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.98 -1.009 . . . . 0.0 108.699 -177.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 70.3 mt 79.5 8.16 1.76 Allowed 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 124.938 1.295 . . . . 0.0 111.611 -177.281 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 54.2 t -115.41 126.44 72.97 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 CA-C-O 121.175 0.512 . . . . 0.0 110.543 179.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -141.68 108.01 5.27 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.325 175.121 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.3 m -82.34 -40.46 0.91 Allowed Pre-proline 0 C--N 1.282 -2.351 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.143 173.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.568 ' HG3' ' O ' ' A' ' 47' ' ' PRO . 87.5 Cg_exo -50.6 110.09 0.36 Allowed 'Trans proline' 0 C--N 1.398 3.169 0 C-N-CA 123.015 2.476 . . . . 0.0 116.155 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.441 ' O ' ' HB ' ' A' ' 44' ' ' THR . 32.3 tt0 -149.83 147.65 28.22 Favored 'General case' 0 C--N 1.287 -2.151 0 N-CA-C 101.952 -3.351 . . . . 0.0 101.952 167.447 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.441 ' HB ' ' O ' ' A' ' 43' ' ' GLU . 46.2 m 76.48 161.89 0.23 Allowed 'General case' 0 CA--C 1.563 1.454 0 N-CA-C 106.006 -1.85 . . . . 0.0 106.006 -165.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -69.87 -0.26 6.97 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -176.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -102.6 98.94 11.95 Favored Pre-proline 0 C--N 1.318 -0.797 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.568 ' O ' ' HG3' ' A' ' 42' ' ' PRO . 46.1 Cg_endo -89.16 9.88 3.41 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.781 2.32 . . . . 0.0 115.897 -169.438 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -109.71 -37.93 5.53 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 118.616 -1.233 . . . . 0.0 111.813 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm -101.9 -23.0 14.21 Favored 'General case' 0 C--N 1.295 -1.762 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.336 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 67.6 -103.62 1.0 Allowed Glycine 0 C--N 1.337 0.618 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 -177.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 29.8 t -87.49 95.26 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.32 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 173.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -52.7 -29.03 24.55 Favored 'General case' 0 C--N 1.31 -1.15 0 C-N-CA 124.907 1.283 . . . . 0.0 114.393 -170.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -69.51 -20.5 63.71 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.791 0.329 . . . . 0.0 111.721 178.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -117.64 4.8 12.34 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.907 0.861 . . . . 0.0 108.931 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -57.94 -49.06 78.18 Favored Glycine 0 N--CA 1.443 -0.863 0 CA-C-N 114.322 -1.308 . . . . 0.0 113.157 178.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -54.44 -38.74 89.66 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 122.776 2.317 . . . . 0.0 111.852 176.28 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -63.25 -56.82 13.35 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.737 178.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.48 -51.07 69.85 Favored 'General case' 0 CA--C 1.516 -0.351 0 O-C-N 124.018 0.824 . . . . 0.0 111.943 -176.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.515 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 13.9 p -64.8 -44.46 89.87 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.846 -0.616 . . . . 0.0 112.661 -177.099 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -69.98 -34.81 73.84 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -59.66 -49.22 78.58 Favored 'General case' 0 C--O 1.244 0.767 0 C-N-CA 123.116 0.566 . . . . 0.0 110.758 -177.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.9 m -61.6 -42.02 98.27 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.138 178.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.515 ' HG3' ' O ' ' A' ' 59' ' ' SER . 29.7 mtpp -57.28 -46.79 82.79 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.646 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 97.6 mttt -65.89 -42.43 90.29 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.641 -0.708 . . . . 0.0 111.331 -178.314 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.1 mmt -64.05 -44.71 91.66 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 123.557 0.536 . . . . 0.0 112.373 -179.12 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.5 m -72.38 -29.23 30.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -176.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -82.65 -26.97 31.66 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 119.915 -0.714 . . . . 0.0 110.979 178.381 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -73.08 -27.87 61.97 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.009 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.533 ' HA ' ' OD1' ' A' ' 95' ' ' ASP . . . -55.09 121.02 7.85 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 114.63 -1.168 . . . . 0.0 112.481 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.47 ' HD2' ' N ' ' A' ' 70' ' ' LYS . 9.3 mptt -82.88 -31.09 28.07 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 174.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.6 mtpp -127.21 126.97 43.71 Favored 'General case' 0 N--CA 1.426 -1.64 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.587 ' HB ' ' O ' ' A' ' 12' ' ' ALA . 3.7 mp -113.64 113.15 43.1 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.194 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 178.272 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.521 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 24.8 mt-10 -113.01 137.46 51.37 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 -177.091 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.1 m -110.29 127.04 67.53 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 177.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -114.11 140.45 48.48 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.717 -175.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -109.92 116.82 32.31 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 124.204 1.002 . . . . 0.0 110.963 -177.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.416 ' OD2' ' HB ' ' B' ' 133' ' ' THR . 9.1 t70 -88.36 -174.28 4.55 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 176.478 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -60.1 -13.08 10.12 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -175.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.514 ' N ' HD21 ' B' ' 131' ' ' ASN . . . -76.6 -151.08 3.73 Favored Glycine 0 C--N 1.313 -0.706 0 CA-C-O 121.497 0.499 . . . . 0.0 114.155 -173.617 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -89.81 155.86 18.88 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 42.4 ttt180 -91.75 -3.51 56.12 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 122.357 1.075 . . . . 0.0 108.615 178.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.8 p -115.81 142.86 46.2 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.566 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.409 ' HB3' ' CB ' ' A' ' 87' ' ' ARG . 16.7 t70 -102.2 157.71 16.69 Favored 'General case' 0 C--N 1.311 -1.094 0 C-N-CA 123.022 0.529 . . . . 0.0 111.801 -178.479 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -61.27 -25.6 67.21 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 126.784 2.034 . . . . 0.0 113.591 -176.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.419 ' HE2' ' NH2' ' A' ' 35' ' ' ARG . 46.4 m-85 -84.33 -3.49 58.29 Favored 'General case' 0 N--CA 1.469 0.494 0 O-C-N 121.734 -0.604 . . . . 0.0 110.788 177.484 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 93.86 24.33 20.6 Favored Glycine 0 N--CA 1.436 -1.328 0 N-CA-C 109.118 -1.593 . . . . 0.0 109.118 -174.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.409 ' CB ' ' HB3' ' A' ' 83' ' ' ASP . 0.0 OUTLIER -99.33 -171.32 2.05 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 114.474 -0.863 . . . . 0.0 109.119 177.867 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -112.79 144.64 18.02 Favored Glycine 0 N--CA 1.42 -2.403 0 N-CA-C 108.789 -1.724 . . . . 0.0 108.789 171.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 59.4 mt -101.64 110.48 22.48 Favored 'General case' 0 CA--C 1.491 -1.307 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 178.552 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.12 155.47 32.6 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 177.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . 0.302 54.2 p90 -110.06 140.84 43.68 Favored 'General case' 0 N--CA 1.424 -1.746 0 C-N-CA 119.241 -0.983 . . . . 0.0 112.456 176.205 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 34.4 mm -98.92 131.0 46.96 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 CA-C-N 115.551 -0.749 . . . . 0.0 112.695 -166.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.521 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 82.8 m-85 -107.66 127.67 53.87 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 168.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.426 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -105.15 99.4 9.02 Favored 'General case' 0 C--N 1.289 -2.05 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 176.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.533 ' OD1' ' HA ' ' A' ' 69' ' ' ALA . 6.2 p-10 45.01 41.72 5.68 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.09 1.356 . . . . 0.0 113.191 -178.438 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.95 -23.39 27.74 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.293 -0.867 . . . . 0.0 113.337 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -87.52 113.65 23.4 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' MET . . . . . 0.484 ' HE3' ' HB2' ' A' ' 101' ' ' GLU . 52.2 ttp -74.99 105.42 6.0 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 45.2 t -64.12 -29.82 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-O 121.679 0.752 . . . . 0.0 109.665 -175.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -61.08 -40.07 92.32 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.067 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.506 ' OE2' ' HD3' ' A' ' 105' ' ' ARG . 11.4 tp10 -64.94 -54.05 36.75 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 114.883 -1.053 . . . . 0.0 108.338 176.638 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -53.1 -48.38 67.84 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.112 -0.949 . . . . 0.0 113.129 -176.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.406 HD12 HD22 ' A' ' 36' ' ' LEU . 85.1 mt -59.87 -48.14 82.89 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 78.7 t -73.01 -35.06 47.57 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 CA-C-O 120.981 0.42 . . . . 0.0 110.292 -178.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.506 ' HD3' ' OE2' ' A' ' 101' ' ' GLU . 4.0 tpt180 -65.5 -41.05 93.65 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 123.388 0.675 . . . . 0.0 110.174 -178.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -83.99 -3.1 57.75 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.887 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.98 39.05 85.31 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 121.077 -0.582 . . . . 0.0 112.744 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 92.3 mt -102.17 4.4 39.43 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-O 121.938 0.875 . . . . 0.0 109.586 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -165.18 165.36 19.8 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 114.513 -1.221 . . . . 0.0 107.862 178.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.4 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 83.1 mttt -111.53 165.75 11.73 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 174.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.457 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 78.1 t -76.76 136.46 24.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.631 177.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.65 149.47 23.51 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.976 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 55.5 t80 -71.75 146.99 47.77 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.046 -178.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.401 HG11 ' HB2' ' B' ' 131' ' ' ASN . 27.0 m -88.16 128.32 40.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-O 121.556 0.694 . . . . 0.0 110.918 -178.222 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -97.18 85.65 3.75 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -174.395 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.494 ' HB2' ' HB3' ' B' ' 130' ' ' PRO . 64.4 mmtt -127.61 109.15 20.74 Favored Pre-proline 0 C--N 1.299 -1.601 0 CA-C-N 113.698 -1.592 . . . . 0.0 109.093 173.607 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -78.41 -149.07 0.03 OUTLIER 'Trans proline' 0 C--O 1.244 0.822 0 C-N-CA 122.74 2.293 . . . . 0.0 109.364 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -79.68 46.12 0.74 Allowed 'General case' 0 CA--C 1.559 1.318 0 CA-C-O 122.334 1.064 . . . . 0.0 109.73 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -84.56 -17.91 37.33 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 174.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.1 p -83.94 19.52 1.73 Allowed 'General case' 0 N--CA 1.431 -1.409 0 CA-C-N 113.352 -1.749 . . . . 0.0 109.901 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 . . . . . 0 N--CA 1.44 -0.931 0 C-N-CA 124.895 1.278 . . . . 0.0 109.944 -176.371 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.497 -1.05 0 N-CA-C 110.382 -1.087 . . . . 0.0 110.382 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 27.0 m -72.45 -48.74 38.63 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 117.132 0.466 . . . . 0.0 110.648 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 27.4 m -89.92 153.47 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.707 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 177.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -76.44 139.6 40.94 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 176.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 24.1 p90 -70.56 -41.56 72.27 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 119.957 -0.697 . . . . 0.0 109.814 -177.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 46.4 t 61.6 118.17 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.346 0.454 0 C-N-CA 125.077 1.351 . . . . 0.0 111.438 -179.117 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -85.78 110.81 19.62 Favored 'General case' 0 N--CA 1.422 -1.83 0 C-N-CA 118.652 -1.219 . . . . 0.0 108.459 176.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -100.57 161.47 23.84 Favored Pre-proline 0 C--N 1.287 -2.109 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.356 -178.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 130' ' ' PRO . . . . . 0.494 ' HB3' ' HB2' ' A' ' 116' ' ' LYS . 79.0 Cg_exo -55.21 -159.65 0.01 OUTLIER 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 124.473 3.449 . . . . 0.0 115.309 178.476 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 131' ' ' ASN . . . . . 0.514 HD21 ' N ' ' A' ' 79' ' ' GLY . 2.1 m-20 -63.51 99.45 0.21 Allowed 'General case' 0 C--O 1.213 -0.836 0 CA-C-N 115.198 -0.91 . . . . 0.0 108.684 175.37 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.437 ' HA ' ' HB3' ' B' ' 135' ' ' GLU . 15.4 m120 -110.08 -8.61 14.78 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 173.673 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 133' ' ' THR . . . . . 0.416 ' HB ' ' OD2' ' A' ' 77' ' ' ASP . 0.2 OUTLIER -43.91 -61.34 1.48 Allowed 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 127.306 2.242 . . . . 0.0 112.092 -173.591 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -116.91 3.74 12.86 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-O 120.973 0.416 . . . . 0.0 111.359 176.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.548 ' OE2' ' HD2' ' B' ' 139' ' ' ARG . 2.4 tm-20 -69.15 -47.92 63.72 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.373 -178.527 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -63.84 -33.32 75.43 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.354 0.597 . . . . 0.0 110.516 176.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 78.8 mt -70.41 -50.57 37.19 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.729 -177.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.21 -33.6 75.71 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.713 0.292 . . . . 0.0 111.586 177.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 139' ' ' ARG . . . . . 0.548 ' HD2' ' OE2' ' B' ' 135' ' ' GLU . 84.2 mtt180 -66.81 -27.92 67.95 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 177.203 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 28.5 ttpp -71.37 -39.88 70.96 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 177.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 15.2 m -62.39 -45.66 92.15 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 114.832 -1.076 . . . . 0.0 109.249 175.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.525 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 40.2 tt0 -59.44 -48.08 83.01 Favored 'General case' 0 C--O 1.204 -1.291 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.652 177.383 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -56.65 -40.97 76.42 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 122.693 0.397 . . . . 0.0 110.993 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -67.78 -47.37 69.34 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.04 178.303 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -64.15 -34.06 77.21 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.707 -178.069 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 146' ' ' LYS . . . . . 0.525 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 89.8 mttt -61.87 -46.88 87.48 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 177.248 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -69.85 -35.41 74.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.222 -177.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 59.7 mm-40 -74.36 -17.25 60.85 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.195 177.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt 57.03 56.51 5.25 Favored 'General case' 0 CA--C 1.514 -0.424 0 C-N-CA 124.785 1.234 . . . . 0.0 110.49 -178.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 91.8 mt -91.55 121.37 33.18 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.76 -176.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 51.24 -92.51 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 125.481 1.513 . . . . 0.0 113.898 178.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 24.5 mt -65.2 -33.98 67.37 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.899 0 CA-C-O 121.058 0.456 . . . . 0.0 110.979 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 153' ' ' TRP . . . . . 0.518 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 63.7 m95 -75.96 -6.09 49.31 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.573 0.701 . . . . 0.0 111.465 -177.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 42.3 t -92.72 16.31 12.57 Favored 'General case' 0 N--CA 1.425 -1.704 0 CA-C-N 115.433 -0.803 . . . . 0.0 108.916 174.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -63.03 -21.79 66.41 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.494 0.664 . . . . 0.0 110.11 174.427 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 . . . . . 0 N--CA 1.427 -1.592 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 176.989 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.295 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 33.2 m -143.51 110.04 5.48 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 29.4 m -147.25 138.17 23.69 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 177.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.1 m -149.58 -84.22 0.09 Allowed 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -145.77 20.61 1.47 Allowed 'General case' 0 CA--C 1.55 0.976 0 CA-C-O 121.662 0.744 . . . . 0.0 110.449 -174.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -150.47 163.34 38.67 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 178.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.458 HD13 ' HA ' ' A' ' 77' ' ' ASP . 4.9 mp -117.59 -160.19 0.77 Allowed 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 177.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -91.95 139.53 30.56 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.277 0.56 . . . . 0.0 112.035 -176.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.408 ' HB3' ' HB2' ' A' ' 75' ' ' GLU . 62.2 pttt -116.13 159.62 21.5 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.042 176.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -134.71 159.8 70.81 Favored Pre-proline 0 C--N 1.3 -1.551 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 178.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -81.68 140.51 11.75 Favored 'Trans proline' 0 C--O 1.244 0.824 0 C-N-CA 123.007 2.472 . . . . 0.0 111.138 175.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -127.64 162.87 25.51 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.805 178.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.501 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 36.5 m -98.16 131.47 44.51 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.6 tp -84.28 122.19 28.55 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 -179.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 72.4 mt -93.0 -59.74 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.501 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -161.22 143.58 12.24 Favored 'General case' 0 N--CA 1.416 -2.128 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.055 -178.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.478 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -96.25 108.31 20.77 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 105.966 -1.864 . . . . 0.0 105.966 171.56 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 70.6 mt -81.85 -53.87 11.08 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.417 0 CA-C-O 121.345 0.593 . . . . 0.0 110.795 -173.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.534 ' HB2' ' H ' ' A' ' 22' ' ' THR . 11.8 m-20 -128.55 -175.35 3.5 Favored 'General case' 0 C--N 1.295 -1.803 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 -179.131 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -94.98 46.43 2.06 Favored Glycine 0 C--N 1.304 -1.218 0 N-CA-C 108.571 -1.812 . . . . 0.0 108.571 173.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.586 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 9.6 t70 -171.48 -52.74 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 105.926 -1.879 . . . . 0.0 105.926 -172.23 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.534 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 1.3 m -91.54 118.49 30.64 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 113.868 -1.514 . . . . 0.0 110.56 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.4 m -133.16 151.04 33.27 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.931 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 177.092 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -116.03 116.04 27.18 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 -177.144 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.9 mp -123.93 159.06 30.55 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.274 0.559 . . . . 0.0 111.028 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.501 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 57.2 ttp -120.67 111.83 18.12 Favored 'General case' 0 C--N 1.293 -1.862 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 175.127 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 44.1 p90 -106.93 110.34 22.46 Favored 'General case' 0 CA--C 1.485 -1.523 0 C-N-CA 119.163 -1.015 . . . . 0.0 110.748 -178.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 97.2 mttt 53.43 38.99 29.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.716 -178.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.497 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 95.26 2.18 62.25 Favored Glycine 0 N--CA 1.448 -0.535 0 CA-C-N 113.796 -1.547 . . . . 0.0 113.766 177.121 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.438 ' O ' ' HA ' ' A' ' 26' ' ' MET . 2.4 mp0 -100.48 97.56 6.69 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 117.0 0.4 . . . . 0.0 110.545 177.457 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.497 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 1.8 Cg_endo -83.39 105.51 1.27 Allowed 'Trans proline' 0 C--O 1.243 0.743 0 C-N-CA 122.964 2.443 . . . . 0.0 111.192 179.196 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 66.3 mtt -129.32 153.18 48.1 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.082 0.467 . . . . 0.0 110.385 -177.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.8 m -89.67 119.72 30.32 Favored 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 107.646 -1.242 . . . . 0.0 107.646 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -101.52 150.18 23.33 Favored 'General case' 0 C--N 1.282 -2.357 0 CA-C-O 121.654 0.74 . . . . 0.0 111.629 -176.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.615 ' HB2' ' NH1' ' A' ' 87' ' ' ARG . 9.7 mmt85 -127.43 127.07 43.51 Favored 'General case' 0 C--N 1.283 -2.295 0 N-CA-C 103.541 -2.763 . . . . 0.0 103.541 171.263 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.426 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 9.3 mt -68.72 133.08 47.89 Favored 'General case' 0 C--N 1.289 -2.038 0 O-C-N 123.709 0.631 . . . . 0.0 109.995 -173.444 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.4 mt -61.4 137.03 58.23 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.891 176.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 67.5 mt 73.92 14.35 4.02 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 124.391 1.057 . . . . 0.0 113.056 175.325 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 85.3 t -110.74 126.46 68.08 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.569 0 CA-C-O 121.109 0.48 . . . . 0.0 110.662 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -125.01 108.24 11.63 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 115.421 -0.808 . . . . 0.0 109.549 175.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.401 ' HB ' ' O ' ' A' ' 43' ' ' GLU . 1.5 p -88.31 126.54 60.17 Favored Pre-proline 0 C--N 1.29 -1.985 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.935 176.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -78.53 -24.85 7.21 Favored 'Trans proline' 0 C--O 1.236 0.402 0 C-N-CA 121.988 1.792 . . . . 0.0 110.373 178.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.401 ' O ' ' HB ' ' A' ' 41' ' ' THR . 55.1 mt-10 -130.14 151.96 50.1 Favored 'General case' 0 N--CA 1.407 -2.582 0 CA-C-N 114.363 -1.29 . . . . 0.0 107.549 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.456 ' H ' HG11 ' A' ' 51' ' ' VAL . 6.9 t -145.92 164.49 31.84 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 -174.641 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -8.68 37.64 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -176.132 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -59.52 117.84 26.01 Favored Pre-proline 0 C--N 1.315 -0.916 0 C-N-CA 123.618 0.767 . . . . 0.0 110.478 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -62.68 156.33 53.61 Favored 'Trans proline' 0 C--O 1.247 0.954 0 C-N-CA 122.974 2.449 . . . . 0.0 112.467 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.623 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 5.5 mmpt? 82.26 2.16 1.3 Allowed 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 125.41 1.484 . . . . 0.0 113.102 179.155 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.513 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 8.7 mmpt? -95.15 -7.6 38.77 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.207 178.211 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 59.0 47.72 89.41 Favored Glycine 0 N--CA 1.469 0.836 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.287 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.456 HG11 ' H ' ' A' ' 44' ' ' THR . 27.0 m -80.77 65.48 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 CA-C-O 122.933 1.349 . . . . 0.0 112.214 -174.41 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -92.57 -15.68 26.64 Favored 'General case' 0 C--N 1.29 -2.011 0 CA-C-N 114.462 -1.244 . . . . 0.0 112.528 -176.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.538 ' HE2' ' HA ' ' A' ' 53' ' ' LYS . 7.2 mmpt? -87.72 -66.49 0.91 Allowed 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 113.475 0.916 . . . . 0.0 113.475 -169.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -121.05 -18.03 7.62 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.326 -171.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -48.8 -58.6 7.46 Favored Glycine 0 CA--C 1.538 1.492 0 CA-C-O 119.077 -0.846 . . . . 0.0 114.844 -178.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -60.09 -38.99 73.65 Favored 'Trans proline' 0 C--N 1.366 1.462 0 C-N-CA 122.65 2.233 . . . . 0.0 112.663 -179.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -62.43 -47.9 82.03 Favored 'General case' 0 C--O 1.245 0.868 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.624 -177.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.93 -43.79 87.05 Favored 'General case' 0 C--O 1.242 0.709 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.772 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.407 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 22.7 p -64.8 -46.07 83.6 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -67.86 -36.04 79.6 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 120.589 0.233 . . . . 0.0 111.421 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -61.49 -47.37 85.93 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.076 178.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.443 ' O ' HG22 ' A' ' 66' ' ' VAL . 40.8 m -60.47 -44.93 95.39 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.688 -178.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.478 ' HG2' ' HB3' ' A' ' 17' ' ' ALA . 44.4 mtpt -59.22 -49.79 76.51 Favored 'General case' 0 C--N 1.345 0.402 0 O-C-N 123.23 0.331 . . . . 0.0 110.468 178.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -55.42 -44.48 76.29 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.986 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.9 mmt -71.02 -38.38 72.6 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -177.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.443 HG22 ' O ' ' A' ' 62' ' ' THR . 35.3 m -80.67 -31.83 12.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 -178.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -76.09 -27.71 57.28 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 121.4 0.619 . . . . 0.0 110.36 177.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -67.42 -31.39 71.56 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.905 176.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.539 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -69.89 131.31 44.25 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.737 -177.031 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -78.95 -41.34 29.56 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 171.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.3 mtmt -113.96 131.42 56.33 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 114.832 -1.076 . . . . 0.0 108.664 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 3.9 mp -111.43 117.92 56.24 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.364 0 N-CA-C 105.221 -2.14 . . . . 0.0 105.221 174.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.536 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 23.2 mt-10 -112.75 140.01 47.89 Favored 'General case' 0 C--N 1.295 -1.776 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.875 -172.283 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.48 HG12 ' CD1' ' A' ' 92' ' ' ILE . 10.1 m -116.38 117.66 56.23 Favored 'Isoleucine or valine' 0 C--O 1.25 1.092 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.398 178.659 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.408 ' HB2' ' HB3' ' A' ' 9' ' ' LYS . 23.8 tt0 -109.14 143.5 38.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.842 0.353 . . . . 0.0 111.188 -176.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.413 ' O ' ' HB2' ' A' ' 7' ' ' LEU . 47.0 t80 -94.14 147.81 22.79 Favored 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 124.7 1.2 . . . . 0.0 110.31 -176.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.74 ' OD1' ' HA ' ' B' ' 131' ' ' ASN . 11.8 t70 -116.29 -175.81 2.82 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 176.441 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.52 -26.73 68.03 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.409 0.684 . . . . 0.0 112.16 -175.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -72.64 -115.43 0.06 OUTLIER Glycine 0 N--CA 1.445 -0.719 0 CA-C-N 115.888 -0.596 . . . . 0.0 113.436 -177.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -124.64 165.09 18.51 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 122.28 -0.541 . . . . 0.0 109.761 -178.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 44.2 ttt85 -104.65 -13.18 16.04 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-O 121.783 0.801 . . . . 0.0 108.987 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.8 p -133.07 133.29 42.8 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.176 178.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 48.4 t0 -87.85 144.87 26.35 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 179.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -68.33 -16.71 64.04 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 121.395 0.617 . . . . 0.0 109.946 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -65.36 -30.31 71.12 Favored 'General case' 0 C--O 1.221 -0.429 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 173.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 105.21 49.65 0.98 Allowed Glycine 0 N--CA 1.437 -1.252 0 CA-C-N 115.718 -0.673 . . . . 0.0 111.506 -178.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.615 ' NH1' ' HB2' ' A' ' 35' ' ' ARG . 0.8 OUTLIER -151.25 160.37 43.86 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.521 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -80.82 144.89 25.54 Favored Glycine 0 C--N 1.305 -1.185 0 C-N-CA 121.031 -0.604 . . . . 0.0 113.281 -177.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.0 mt -117.48 97.9 6.12 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.172 -1.048 . . . . 0.0 108.172 177.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.63 161.64 39.89 Favored 'General case' 0 C--N 1.313 -0.999 0 C-N-CA 120.223 -0.591 . . . . 0.0 111.414 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -88.86 127.4 35.63 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 105.951 -1.87 . . . . 0.0 105.951 170.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.48 ' CD1' HG12 ' A' ' 74' ' ' VAL . 45.7 mm -99.55 123.75 52.48 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.072 -179.405 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.536 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 77.5 m-85 -109.18 132.51 54.05 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 175.399 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.539 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -105.35 100.54 10.11 Favored 'General case' 0 C--N 1.285 -2.234 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 176.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.498 ' OD2' ' HA ' ' A' ' 69' ' ' ALA . 3.0 p30 46.32 29.97 0.95 Allowed 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 124.928 1.291 . . . . 0.0 113.472 -174.089 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.44 -9.8 38.67 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.852 -0.613 . . . . 0.0 113.435 -179.201 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -83.53 121.87 27.79 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 175.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 34.2 ttp -80.68 99.47 8.2 Favored 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 179.185 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 48.7 t -58.36 -43.62 86.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 114.781 -1.1 . . . . 0.0 112.795 -169.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.426 ' HB3' ' HB3' ' A' ' 36' ' ' LEU . 24.7 p-10 -66.5 -31.4 72.1 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.499 -176.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -77.61 -40.64 41.35 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.94 -39.25 77.58 Favored 'General case' 0 C--O 1.222 -0.351 0 O-C-N 123.741 0.651 . . . . 0.0 110.737 179.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.17 -44.66 94.83 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.915 177.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 95.0 t -70.26 -47.57 66.19 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.302 -178.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 11.5 ttp85 -60.45 -37.82 82.2 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 177.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -82.3 0.93 39.31 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-O 120.678 0.275 . . . . 0.0 111.575 177.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.85 38.06 93.95 Favored Glycine 0 C--O 1.221 -0.712 0 CA-C-N 116.276 -0.42 . . . . 0.0 113.688 177.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.4 mt -100.62 -13.66 18.48 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.377 0.608 . . . . 0.0 110.22 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -152.13 160.19 43.47 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -105.56 164.15 12.11 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 106.759 -1.571 . . . . 0.0 106.759 177.082 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.457 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 82.5 t -71.38 128.39 34.44 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.507 177.331 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.48 146.38 25.22 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 176.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -80.14 149.37 30.59 Favored 'General case' 0 C--N 1.289 -2.039 0 CA-C-O 121.383 0.611 . . . . 0.0 111.692 -172.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 71.6 t -87.61 119.03 34.55 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.611 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.906 -173.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -80.27 137.74 36.67 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 115.356 -0.838 . . . . 0.0 108.859 176.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -84.07 126.38 70.21 Favored Pre-proline 0 C--N 1.292 -1.899 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -172.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -87.02 -163.76 0.18 Allowed 'Trans proline' 0 N--CA 1.444 -1.403 0 C-N-CA 122.572 2.181 . . . . 0.0 106.903 167.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -108.22 -57.36 2.13 Favored 'General case' 0 C--N 1.288 -2.068 0 C-N-CA 118.839 -1.144 . . . . 0.0 110.201 177.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 61.85 76.95 0.35 Allowed 'General case' 0 C--O 1.25 1.105 0 CA-C-O 122.818 1.294 . . . . 0.0 110.166 -176.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.1 m -69.29 95.64 0.79 Allowed 'General case' 0 N--CA 1.422 -1.871 0 CA-C-N 112.737 -2.029 . . . . 0.0 111.599 -174.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 9.7 t-80 . . . . . 0 C--O 1.246 0.874 0 C-N-CA 125.37 1.468 . . . . 0.0 107.37 174.716 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.686 0 N-CA-C 111.17 -0.772 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 61.8 p 51.88 -89.1 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.136 1.774 . . . . 0.0 114.178 179.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 22.3 m -82.53 -32.24 10.18 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.679 0 CA-C-O 120.777 0.322 . . . . 0.0 111.112 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -106.38 94.87 5.38 Favored 'General case' 0 N--CA 1.428 -1.53 0 CA-C-O 121.205 0.526 . . . . 0.0 109.969 -177.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.6 p90 -143.65 15.54 1.79 Allowed 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 177.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 18.9 m -64.82 122.16 15.2 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.089 0 N-CA-C 115.019 1.488 . . . . 0.0 115.019 -169.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.27 99.07 8.42 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.134 170.309 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -65.34 -35.62 12.67 Favored Pre-proline 0 C--N 1.296 -1.759 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -58.53 -176.04 0.08 OUTLIER 'Trans proline' 0 C--N 1.384 2.398 0 C-N-CA 122.028 1.819 . . . . 0.0 114.898 176.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 131' ' ' ASN . . . . . 0.74 ' HA ' ' OD1' ' A' ' 77' ' ' ASP . 87.7 m-20 -64.45 118.16 8.35 Favored 'General case' 0 CA--C 1.5 -0.979 0 CA-C-N 114.958 -1.019 . . . . 0.0 110.612 -178.175 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.465 ' HA ' ' CB ' ' B' ' 135' ' ' GLU . 2.3 p-10 -152.01 -2.84 0.28 Allowed 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -179.03 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 133' ' ' THR . . . . . 0.429 HG21 ' CD1' ' A' ' 7' ' ' LEU . 69.3 p -60.63 -48.75 80.38 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -170.229 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -112.01 5.03 18.49 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.465 ' CB ' ' HA ' ' B' ' 132' ' ' ASN . 0.9 OUTLIER -65.3 -38.7 91.02 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.988 -1.005 . . . . 0.0 109.689 -175.977 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -61.79 -33.92 74.96 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.981 178.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 88.4 mt -66.12 -46.43 77.57 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.618 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 7.8 mp -65.98 -29.13 69.46 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.367 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -61.85 -41.41 97.79 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.334 0.587 . . . . 0.0 109.866 175.166 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -70.65 -39.73 73.46 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.32 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 50.3 m -63.88 -46.18 86.05 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.487 177.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.586 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 41.7 tt0 -61.73 -50.75 71.18 Favored 'General case' 0 C--O 1.204 -1.326 0 O-C-N 123.469 0.481 . . . . 0.0 109.825 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.15 -38.15 73.12 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 123.48 0.488 . . . . 0.0 111.243 -179.156 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 144' ' ' GLN . . . . . 0.499 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 14.6 tt0 -66.47 -48.81 68.72 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -65.34 -33.61 76.39 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.483 -176.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 146' ' ' LYS . . . . . 0.586 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 88.1 mttt -59.33 -51.33 70.38 Favored 'General case' 0 C--N 1.345 0.409 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 176.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -69.7 -34.41 73.88 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.375 -0.83 . . . . 0.0 112.052 -177.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 148' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 57.6 mm-40 -74.08 -18.63 60.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.644 177.643 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 23.4 mtpp 59.28 48.17 10.55 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 125.234 1.414 . . . . 0.0 110.437 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 99.4 mt -84.45 119.99 25.78 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.233 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 53.9 -93.43 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.229 0 O-C-N 124.781 1.3 . . . . 0.0 112.6 176.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 152' ' ' ILE . . . . . 0.509 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 29.5 mt -60.34 -43.8 94.5 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.654 0 C-N-CA 122.121 0.168 . . . . 0.0 111.331 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -71.48 -4.03 24.36 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.987 0.899 . . . . 0.0 112.774 -172.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 27.9 t -80.35 -5.23 56.05 Favored 'General case' 0 C--N 1.291 -1.942 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.45 171.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 155' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 21.4 pt-20 -69.93 -25.08 63.49 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 121.543 0.687 . . . . 0.0 109.704 175.36 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.5 t70 . . . . . 0 C--N 1.309 -1.166 0 CA-C-N 114.843 -1.072 . . . . 0.0 109.654 -178.175 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.453 0 CA-C-O 121.052 0.453 . . . . 0.0 110.235 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.457 HG22 HG22 ' A' ' 4' ' ' THR . 14.2 m -80.63 104.24 11.02 Favored 'General case' 0 N--CA 1.432 -1.338 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.7 m -84.5 76.29 10.18 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-O 121.944 0.878 . . . . 0.0 113.037 -174.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.457 HG22 HG22 ' A' ' 2' ' ' THR . 5.7 t -158.26 71.46 0.58 Allowed 'General case' 0 N--CA 1.415 -2.187 0 CA-C-O 122.785 1.279 . . . . 0.0 110.429 174.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.613 ' HE2' ' HA ' ' A' ' 5' ' ' LYS . 7.0 mmpt? -107.02 19.08 20.95 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 172.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -155.0 159.56 40.42 Favored 'General case' 0 N--CA 1.413 -2.322 0 N-CA-C 102.408 -3.182 . . . . 0.0 102.408 177.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 91.0 mt -95.62 173.48 7.46 Favored 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 119.967 -0.693 . . . . 0.0 112.214 -176.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 45.3 m80 -79.3 104.01 9.63 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.87 -178.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.7 ttmt -105.14 127.1 52.75 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 172.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -114.0 149.35 41.76 Favored Pre-proline 0 C--N 1.296 -1.749 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 173.027 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -80.16 141.1 14.41 Favored 'Trans proline' 0 C--N 1.311 -1.408 0 C-N-CA 121.928 1.752 . . . . 0.0 110.399 174.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.447 ' HB1' ' HB3' ' A' ' 25' ' ' LEU . . . -136.19 155.98 49.35 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 121.103 0.477 . . . . 0.0 112.156 -178.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.415 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 72.7 m -111.86 140.76 46.25 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 176.639 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.446 ' HB2' ' CD1' ' A' ' 72' ' ' ILE . 52.3 tp -83.14 125.48 31.56 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 118.312 0.505 . . . . 0.0 110.424 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 44.5 mm -89.18 -53.18 9.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 174.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -164.36 145.83 8.44 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -105.99 119.44 39.19 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 49.5 mm -90.56 -55.77 5.88 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -177.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.497 ' HB2' ' H ' ' A' ' 22' ' ' THR . 32.4 m-20 -125.83 -166.56 1.58 Allowed 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -85.2 -13.61 70.88 Favored Glycine 0 C--O 1.21 -1.397 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 173.038 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.579 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 0.4 OUTLIER -101.29 -54.03 2.87 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 122.485 1.136 . . . . 0.0 108.099 -178.864 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.497 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 6.8 m -82.49 105.81 13.85 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 114.268 -1.333 . . . . 0.0 111.334 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.3 m -129.27 137.27 57.46 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.609 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 177.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.505 ' HA ' ' HA ' ' A' ' 33' ' ' THR . 46.6 tttp -101.19 119.1 38.24 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.61 -0.682 . . . . 0.0 110.144 -176.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.447 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 3.3 mm? -116.25 146.73 42.13 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 121.453 0.644 . . . . 0.0 110.765 -177.464 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.484 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 26.5 ttt -107.01 108.59 20.17 Favored 'General case' 0 C--N 1.286 -2.17 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 175.019 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 10.8 p90 -115.55 116.88 28.91 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 -177.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 99.3 mttt 57.51 32.59 22.04 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 124.131 0.895 . . . . 0.0 110.921 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.96 3.76 61.87 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 114.738 -1.119 . . . . 0.0 114.142 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.484 ' O ' ' HA ' ' A' ' 26' ' ' MET . 69.8 mt-30 -107.53 103.86 50.53 Favored Pre-proline 0 C--N 1.311 -1.08 0 O-C-N 122.401 -0.47 . . . . 0.0 111.224 -179.544 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -80.85 95.26 0.97 Allowed 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 122.757 2.304 . . . . 0.0 111.268 177.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 26.5 mmt -119.78 145.49 46.53 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.745 -176.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.505 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 11.4 m -86.52 118.76 26.15 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -109.21 162.07 14.64 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 123.551 0.74 . . . . 0.0 111.071 -176.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.579 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 20.7 mtp180 -133.23 142.6 48.65 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 169.63 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.6 mp -61.48 119.55 8.8 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -175.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.1 mt -55.36 128.08 32.52 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.767 176.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.0 mt 68.17 23.2 8.0 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 124.829 1.331 . . . . 0.0 112.211 174.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.524 ' O ' ' HB ' ' A' ' 44' ' ' THR . 90.6 t -128.75 131.53 68.42 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.155 0 O-C-N 122.101 -0.374 . . . . 0.0 110.301 -179.337 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -107.33 106.87 17.51 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 105.634 -1.987 . . . . 0.0 105.634 168.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.64 ' HB ' ' CD ' ' A' ' 42' ' ' PRO . 11.5 m -83.23 -77.82 0.04 OUTLIER Pre-proline 0 CA--C 1.567 1.612 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 175.617 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.64 ' CD ' ' HB ' ' A' ' 41' ' ' THR . 38.0 Cg_endo -80.26 -27.65 3.46 Favored 'Trans proline' 0 C--N 1.39 2.711 0 N-CA-C 107.588 -1.735 . . . . 0.0 107.588 164.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.41 ' OE2' ' HG2' ' A' ' 42' ' ' PRO . 0.1 OUTLIER 174.15 173.79 0.18 Allowed 'General case' 0 N--CA 1.423 -1.781 0 C-N-CA 128.262 2.625 . . . . 0.0 104.033 177.486 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.524 ' HB ' ' O ' ' A' ' 39' ' ' VAL . 12.0 t -110.14 -51.97 2.82 Favored 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 119.579 -0.848 . . . . 0.0 108.785 167.436 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -98.52 -51.82 3.82 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 175.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -148.19 135.38 10.49 Favored Pre-proline 0 C--N 1.314 -0.942 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 -178.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -61.79 119.9 7.25 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.382 2.054 . . . . 0.0 111.543 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -88.53 -50.32 6.36 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.025 -176.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.508 ' NZ ' ' HA ' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -113.81 -28.51 7.39 Favored 'General case' 0 CA--C 1.49 -1.352 0 C-N-CA 120.315 -0.554 . . . . 0.0 111.978 174.804 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 97.21 108.12 2.56 Favored Glycine 0 N--CA 1.414 -2.797 0 N-CA-C 109.921 -1.272 . . . . 0.0 109.921 -175.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.448 ' HB ' ' HA ' ' A' ' 42' ' ' PRO . 27.3 t -97.84 30.53 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.175 0 CA-C-O 123.655 1.693 . . . . 0.0 106.638 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -40.9 -43.62 2.12 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 128.686 2.794 . . . . 0.0 113.296 -178.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.5 mtmm -86.88 -22.87 25.47 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -175.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -104.16 -24.66 13.14 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.769 -0.372 . . . . 0.0 111.952 -173.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.45 ' N ' ' HD2' ' A' ' 56' ' ' PRO . . . -47.97 -51.78 18.26 Favored Glycine 0 CA--C 1.534 1.254 0 O-C-N 123.9 0.75 . . . . 0.0 113.322 177.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' ' 55' ' ' GLY . 4.7 Cg_endo -49.64 -34.31 34.3 Favored 'Trans proline' 0 CA--C 1.553 1.427 0 C-N-CA 123.44 2.76 . . . . 0.0 114.016 175.628 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -83.39 -39.4 20.7 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 121.864 -0.523 . . . . 0.0 110.921 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.95 -40.25 94.74 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.929 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.437 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 9.0 p -65.33 -43.53 90.65 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.461 179.089 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.92 -47.38 85.24 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 123.614 0.571 . . . . 0.0 109.885 177.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -57.26 -49.83 74.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.14 178.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 36.8 m -59.94 -50.83 72.2 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.827 -177.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.518 ' HE3' ' OE1' ' A' ' 67' ' ' GLU 0.339 0.1 OUTLIER -64.38 -38.23 90.3 Favored 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -179.482 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.411 ' HG3' ' HD3' ' A' ' 63' ' ' LYS . 28.9 mtpp -66.45 -40.67 89.55 Favored 'General case' 0 N--CA 1.436 -1.169 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 177.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 14.7 tpt -62.68 -45.85 90.87 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.266 -178.401 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.8 m -80.71 -31.44 12.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -176.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.518 ' OE1' ' HE3' ' A' ' 63' ' ' LYS . 45.1 mt-10 -77.66 -33.42 53.41 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.146 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -78.1 -20.81 51.46 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.461 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -64.22 147.74 51.68 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.793 179.143 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -71.12 -61.34 1.8 Allowed 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.853 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.0 mtmm -125.55 150.91 47.04 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 178.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.446 ' CD1' ' HB2' ' A' ' 14' ' ' LEU . 69.2 mt -105.58 134.26 47.6 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.231 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 175.009 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.547 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 1.5 mm-40 -111.92 133.24 54.24 Favored 'General case' 0 N--CA 1.424 -1.771 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -178.177 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 31.4 m -111.52 118.19 56.91 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 174.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -114.22 137.33 51.91 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.153 0.501 . . . . 0.0 109.756 -178.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -106.86 138.99 41.99 Favored 'General case' 0 C--N 1.282 -2.338 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.176 -178.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.563 ' HB3' ' OD1' ' B' ' 131' ' ' ASN . 6.0 t70 -86.51 -174.27 4.92 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -179.533 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -76.31 -2.5 31.9 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -176.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.59 -119.25 1.15 Allowed Glycine 0 N--CA 1.442 -0.927 0 C-N-CA 121.576 -0.345 . . . . 0.0 112.857 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 70.6 mm-40 -99.75 164.04 12.21 Favored 'General case' 0 C--N 1.293 -1.869 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -175.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -108.89 -37.96 5.72 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.6 p -141.14 150.18 42.47 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.363 -0.835 . . . . 0.0 108.827 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -100.89 155.88 17.7 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -57.83 -28.51 64.16 Favored 'General case' 0 C--O 1.247 0.946 0 C-N-CA 125.496 1.519 . . . . 0.0 111.722 -178.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -66.5 -19.41 65.78 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.495 -177.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 92.01 64.33 1.14 Allowed Glycine 0 CA--C 1.487 -1.684 0 N-CA-C 108.434 -1.866 . . . . 0.0 108.434 -176.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.416 ' HD3' ' O ' ' A' ' 33' ' ' THR . 3.3 tpp180 -161.46 127.55 3.77 Favored 'General case' 0 N--CA 1.415 -2.176 0 N-CA-C 106.759 -1.571 . . . . 0.0 106.759 -175.384 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -78.66 151.58 36.11 Favored Glycine 0 N--CA 1.428 -1.867 0 N-CA-C 111.209 -0.757 . . . . 0.0 111.209 -179.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 85.6 mt -119.94 105.04 10.68 Favored 'General case' 0 C--N 1.288 -2.093 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -138.76 152.48 47.98 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-O 121.279 0.561 . . . . 0.0 111.689 -176.021 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -95.21 123.57 38.79 Favored 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 105.078 -2.193 . . . . 0.0 105.078 175.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 47.4 mm -99.27 129.06 50.29 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-O 121.452 0.644 . . . . 0.0 112.131 -171.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.547 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 26.1 m-85 -114.83 142.94 45.87 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 172.292 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.461 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -105.38 98.85 8.49 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 175.411 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.4 t70 45.71 40.04 5.79 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.179 1.392 . . . . 0.0 110.544 -173.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.69 -22.07 31.02 Favored Glycine 0 N--CA 1.444 -0.811 0 CA-C-N 115.182 -0.917 . . . . 0.0 114.509 178.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -80.83 132.98 35.52 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 117.975 0.888 . . . . 0.0 110.772 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 51.9 mtm -77.78 100.86 6.45 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -175.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 57.9 t -66.83 -48.02 81.02 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.618 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -56.63 -44.75 81.54 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.659 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -68.2 -42.53 79.74 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.3 -179.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.74 -45.13 86.26 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.066 0.546 . . . . 0.0 111.407 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 89.3 mt -57.82 -50.25 73.91 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.95 0.405 . . . . 0.0 111.297 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.6 t -69.89 -36.55 69.77 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.778 -178.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 14.3 tpp85 -62.69 -37.93 88.4 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.96 0.904 . . . . 0.0 111.18 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -91.07 3.9 53.54 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.976 -177.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.1 36.21 92.69 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 121.278 -0.487 . . . . 0.0 112.16 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 97.8 mt -102.28 -11.36 18.77 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 120.896 0.379 . . . . 0.0 110.031 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -153.19 161.13 42.77 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -107.15 152.4 24.11 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 177.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.3 p -82.88 130.17 36.19 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.439 0 CA-C-O 121.106 0.479 . . . . 0.0 109.932 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -89.78 120.97 31.49 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.568 ' HB2' ' CE2' ' A' ' 115' ' ' TYR . 35.2 p90 -86.95 127.21 35.08 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.349 0.595 . . . . 0.0 112.178 -177.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 83.2 t -134.67 120.06 30.71 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 N-CA-C 105.596 -2.001 . . . . 0.0 105.596 175.118 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.568 ' CE2' ' HB2' ' A' ' 113' ' ' TYR . 92.4 m-85 -122.26 -70.87 0.76 Allowed 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 120.162 -0.615 . . . . 0.0 112.398 -177.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.585 ' HD3' ' H ' ' A' ' 118' ' ' ASN . 0.0 OUTLIER -94.72 149.4 36.37 Favored Pre-proline 0 N--CA 1.415 -2.208 0 O-C-N 123.923 0.764 . . . . 0.0 111.812 -173.278 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.434 ' HB3' ' HA ' ' B' ' 129' ' ' LYS . 42.5 Cg_endo -84.77 22.32 0.96 Allowed 'Trans proline' 0 N--CA 1.483 0.907 0 C-N-CA 124.223 3.282 . . . . 0.0 113.294 -171.092 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ASN . . . . . 0.585 ' H ' ' HD3' ' A' ' 116' ' ' LYS . 5.6 t30 66.97 -73.46 0.08 Allowed 'General case' 0 C--N 1.297 -1.694 0 C-N-CA 126.578 1.951 . . . . 0.0 112.125 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -103.95 -20.85 13.74 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -176.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.4 m -78.97 35.55 0.26 Allowed 'General case' 0 CA--C 1.568 1.636 0 CA-C-O 121.624 0.726 . . . . 0.0 112.172 -174.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 . . . . . 0 C--N 1.31 -1.11 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 178.54 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.318 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 18.9 m -68.51 148.76 50.11 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 48.5 t -79.88 101.11 4.78 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.035 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -149.88 150.52 32.04 Favored 'General case' 0 C--N 1.289 -2.059 0 CA-C-N 115.147 -0.933 . . . . 0.0 108.536 -177.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -137.43 139.69 40.82 Favored 'General case' 0 C--N 1.293 -1.852 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 18.9 m -76.66 84.15 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.159 0 CA-C-O 121.981 0.896 . . . . 0.0 112.093 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -66.9 -33.37 75.44 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.573 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.434 ' HA ' ' HB3' ' A' ' 117' ' ' PRO . 57.9 mtmt 71.31 156.05 0.16 Allowed Pre-proline 0 N--CA 1.473 0.698 0 C-N-CA 124.712 1.205 . . . . 0.0 110.736 -174.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -55.57 102.9 0.1 OUTLIER 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.159 1.906 . . . . 0.0 111.596 175.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 131' ' ' ASN . . . . . 0.563 ' OD1' ' HB3' ' A' ' 77' ' ' ASP . 5.0 t30 -113.97 80.35 1.37 Allowed 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 106.268 -1.753 . . . . 0.0 106.268 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 30.9 m-20 -129.82 0.63 4.85 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 120.126 -0.63 . . . . 0.0 112.045 -169.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 1.5 m -70.34 -9.65 56.77 Favored 'General case' 0 CA--C 1.56 1.361 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -168.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 72.9 m80 -126.84 4.79 6.62 Favored 'General case' 0 C--N 1.315 -0.912 0 O-C-N 121.47 -0.769 . . . . 0.0 110.042 175.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.422 ' O ' ' HG2' ' B' ' 139' ' ' ARG . 13.0 tm-20 -67.27 -47.48 70.54 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.411 -172.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 2.9 tm0? -72.51 -33.6 67.03 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -176.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 72.4 mt -57.6 -49.68 75.61 Favored 'General case' 0 C--O 1.254 1.338 0 CA-C-O 121.824 0.821 . . . . 0.0 109.256 177.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 11.2 mp -69.14 -28.89 66.85 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.591 177.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 139' ' ' ARG . . . . . 0.422 ' HG2' ' O ' ' B' ' 135' ' ' GLU . 31.2 mmt180 -60.8 -42.76 98.27 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.443 0.535 . . . . 0.0 112.443 176.287 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -64.08 -35.29 80.28 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.639 0.733 . . . . 0.0 110.028 178.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.3 m -70.12 -43.17 71.54 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.149 178.05 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.605 ' O ' ' HG2' ' B' ' 146' ' ' LYS . 34.5 tt0 -60.47 -45.29 94.26 Favored 'General case' 0 C--O 1.22 -0.467 0 O-C-N 123.862 0.726 . . . . 0.0 109.677 177.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.75 -46.26 77.89 Favored 'General case' 0 CA--C 1.514 -0.419 0 O-C-N 124.007 0.817 . . . . 0.0 111.41 -177.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -70.51 -41.7 72.28 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.454 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -62.87 -39.98 96.12 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.709 -179.184 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 146' ' ' LYS . . . . . 0.605 ' HG2' ' O ' ' B' ' 142' ' ' GLU . 18.4 ptpt -73.28 -35.69 66.2 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 176.509 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -59.77 -47.58 85.12 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 122.023 0.916 . . . . 0.0 109.599 176.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -89.33 -3.2 58.57 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 113.88 -1.509 . . . . 0.0 112.123 -173.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 149' ' ' LYS . . . . . 0.446 ' O ' ' HB2' ' B' ' 154' ' ' SER . 34.1 mmtp 54.24 47.54 22.87 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.048 0.939 . . . . 0.0 111.113 178.132 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 90.5 mt -78.96 117.64 20.22 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.201 -176.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 48.7 -89.8 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.303 1.841 . . . . 0.0 113.646 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 41.6 mt -59.38 -49.18 84.49 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.989 0 C-N-CA 122.988 0.515 . . . . 0.0 111.764 -177.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -69.33 -10.41 57.75 Favored 'General case' 0 CA--C 1.495 -1.139 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -171.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 154' ' ' SER . . . . . 0.446 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 23.0 t -72.52 2.33 6.54 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.037 174.382 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -60.5 -32.86 71.85 Favored 'General case' 0 C--N 1.355 0.809 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 168.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.6 t70 . . . . . 0 C--O 1.24 0.566 0 C-N-CA 125.593 1.557 . . . . 0.0 111.241 178.05 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.409 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.3 m -61.42 -24.41 66.5 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 123.851 0.86 . . . . 0.0 110.55 176.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.2 m -128.18 164.66 22.01 Favored 'General case' 0 N--CA 1.427 -1.615 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 175.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 20.7 m -58.6 -40.95 84.68 Favored 'General case' 0 C--O 1.25 1.118 0 CA-C-O 121.363 0.601 . . . . 0.0 111.005 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.412 ' NZ ' ' HB3' ' A' ' 5' ' ' LYS . 2.0 ttpm? -132.79 91.45 2.9 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.51 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -140.31 74.25 1.46 Allowed 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 175.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -126.31 -167.59 1.74 Allowed 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 114.284 -1.326 . . . . 0.0 108.816 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -115.95 113.86 23.86 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -110.24 150.97 27.92 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-O 121.317 0.579 . . . . 0.0 110.481 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.435 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 11.5 pt-20 -138.86 143.97 39.58 Favored Pre-proline 0 C--N 1.277 -2.558 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.823 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 10.8 Cg_exo -73.75 138.81 26.9 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.788 2.326 . . . . 0.0 113.625 -177.16 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.416 ' O ' ' HB ' ' A' ' 72' ' ' ILE . . . -125.68 153.94 43.13 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.191 -178.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.419 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 42.8 m -105.34 135.5 46.59 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 177.389 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.1 tp -80.35 137.9 36.62 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 118.143 0.429 . . . . 0.0 110.711 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 72.6 mt -107.11 -49.81 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 172.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -161.67 138.01 8.11 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.289 -177.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -101.93 107.46 18.62 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 174.123 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 56.3 mt -89.5 -52.64 10.52 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-O 120.778 0.323 . . . . 0.0 111.367 -173.026 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.497 ' HA ' ' HB3' ' A' ' 59' ' ' SER . 28.1 m-20 -138.15 -176.22 4.37 Favored 'General case' 0 CA--C 1.499 -0.997 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -178.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -92.95 54.38 2.58 Favored Glycine 0 CA--C 1.489 -1.543 0 N-CA-C 107.348 -2.301 . . . . 0.0 107.348 178.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -177.59 -54.67 0.01 OUTLIER 'General case' 0 CA--C 1.486 -1.502 0 C-N-CA 125.271 1.428 . . . . 0.0 107.222 -171.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.673 ' HA ' ' O ' ' A' ' 34' ' ' PHE . 1.9 m -101.88 113.06 25.94 Favored 'General case' 0 N--CA 1.407 -2.597 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.465 -173.147 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 35.4 m -124.71 167.05 19.27 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.803 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 173.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -121.47 114.13 20.82 Favored 'General case' 0 C--N 1.27 -2.855 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 176.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.493 ' O ' ' HA ' ' A' ' 31' ' ' PRO . 2.4 pp -136.11 159.41 41.8 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -176.294 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.441 ' HA ' ' HA ' ' A' ' 31' ' ' PRO . 47.4 ttm -117.51 114.98 24.25 Favored 'General case' 0 C--N 1.295 -1.775 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.536 -176.462 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -119.14 126.71 52.25 Favored 'General case' 0 C--N 1.281 -2.392 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 176.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt 59.97 27.21 16.56 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 123.804 0.69 . . . . 0.0 110.67 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.46 9.11 82.24 Favored Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.9 -178.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -111.7 102.2 52.91 Favored Pre-proline 0 C--N 1.312 -1.043 0 O-C-N 122.57 -0.37 . . . . 0.0 110.411 178.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.493 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 4.9 Cg_exo -81.47 134.77 8.99 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.379 2.72 . . . . 0.0 111.834 178.168 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 48.1 mtt -140.83 156.09 46.21 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 178.491 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 85.4 m -85.13 118.29 24.6 Favored 'General case' 0 N--CA 1.423 -1.819 0 N-CA-C 103.047 -2.946 . . . . 0.0 103.047 170.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.673 ' O ' ' HA ' ' A' ' 22' ' ' THR . 34.0 t80 -112.22 151.78 29.18 Favored 'General case' 0 C--N 1.271 -2.83 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -162.297 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.1 mmt180 -117.76 131.57 56.58 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 127.494 2.317 . . . . 0.0 106.186 172.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.621 ' HB2' HG21 ' A' ' 39' ' ' VAL . 32.6 mt -80.75 140.16 35.68 Favored 'General case' 0 C--N 1.289 -2.024 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 177.494 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.461 ' HB3' HD12 ' A' ' 38' ' ' LEU . 41.2 mt -65.68 133.45 51.12 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 178.061 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.52 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 2.9 mp 66.44 48.92 1.46 Allowed 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 125.674 1.59 . . . . 0.0 111.821 177.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.621 HG21 ' HB2' ' A' ' 36' ' ' LEU . 96.4 t -122.73 125.29 72.24 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.063 0 CA-C-O 121.035 0.445 . . . . 0.0 110.461 177.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.652 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 12.2 t70 -102.25 107.13 18.07 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.702 -1.222 . . . . 0.0 107.702 175.23 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.526 ' H ' ' CD ' ' A' ' 42' ' ' PRO . 30.0 p -121.08 -33.4 0.05 OUTLIER Pre-proline 0 C--N 1.307 -1.249 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.267 172.574 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.526 ' CD ' ' H ' ' A' ' 41' ' ' THR . 42.8 Cg_exo -62.59 128.02 22.34 Favored 'Trans proline' 0 C--N 1.398 3.136 0 N-CA-C 106.467 -2.167 . . . . 0.0 106.467 166.614 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.473 ' OE2' ' HB3' ' A' ' 45' ' ' LYS . 0.1 OUTLIER -68.86 131.19 44.72 Favored 'General case' 0 C--N 1.302 -1.484 0 C-N-CA 119.821 -0.751 . . . . 0.0 112.753 -170.572 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.0 p -111.71 -9.32 14.13 Favored 'General case' 0 N--CA 1.422 -1.829 0 CA-C-N 114.978 -1.01 . . . . 0.0 112.37 -178.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.473 ' HB3' ' OE2' ' A' ' 43' ' ' GLU . 82.5 tttt -92.44 -51.88 4.93 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 175.693 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 18.8 t-80 -142.19 90.32 8.29 Favored Pre-proline 0 C--N 1.305 -1.336 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 176.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -78.03 100.95 1.42 Allowed 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.944 2.429 . . . . 0.0 114.115 -175.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -138.7 -51.04 0.55 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.8 0.333 . . . . 0.0 110.837 172.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -114.16 -7.46 13.02 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.434 0.635 . . . . 0.0 110.554 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.401 ' C ' ' H ' ' A' ' 52' ' ' GLU . . . 88.43 -162.28 31.84 Favored Glycine 0 N--CA 1.442 -0.924 0 N-CA-C 108.069 -2.012 . . . . 0.0 108.069 -173.43 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 26.9 m -81.39 35.77 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.311 -1.097 0 CA-C-N 118.653 1.227 . . . . 0.0 110.217 174.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.401 ' H ' ' C ' ' A' ' 50' ' ' GLY . 37.0 tt0 -43.51 -45.17 6.4 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.292 1.837 . . . . 0.0 113.617 -174.649 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.508 ' HE2' ' HA ' ' A' ' 53' ' ' LYS . 8.1 mmpt? -68.58 -23.46 64.49 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.821 -175.848 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -101.54 -13.89 17.7 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.252 0.548 . . . . 0.0 109.839 -178.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -50.95 -58.48 9.38 Favored Glycine 0 CA--C 1.527 0.843 0 CA-C-N 114.85 -1.068 . . . . 0.0 114.663 -178.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.408 ' HA ' ' OG ' ' A' ' 59' ' ' SER . 34.8 Cg_exo -64.8 -12.77 35.72 Favored 'Trans proline' 0 C--N 1.371 1.737 0 C-N-CA 123.006 2.471 . . . . 0.0 113.164 -178.438 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -89.92 -43.45 10.58 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.86 -43.62 87.89 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.753 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.497 ' HB3' ' HA ' ' A' ' 19' ' ' ASP . 35.3 p -66.56 -36.11 81.85 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.824 -179.307 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.82 -44.51 96.83 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -66.27 -46.89 75.46 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.531 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.496 ' O ' HG23 ' A' ' 66' ' ' VAL . 60.3 m -55.37 -51.68 66.01 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 123.684 0.615 . . . . 0.0 111.394 -178.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 39.4 mttp -53.69 -51.87 61.85 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 120.926 0.393 . . . . 0.0 111.432 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -64.62 -40.9 96.31 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.535 -177.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.92 -47.02 61.38 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.964 -176.077 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 62' ' ' THR . 36.3 t -66.52 -38.07 80.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 120.965 0.412 . . . . 0.0 110.669 -177.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -75.0 -22.99 58.18 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.374 -0.531 . . . . 0.0 111.571 178.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -83.11 -24.42 32.64 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 121.204 0.526 . . . . 0.0 110.199 177.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.18 151.89 30.17 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.16 179.078 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -84.49 -65.35 1.02 Allowed 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.158 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -118.15 136.5 53.57 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 -176.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.416 ' HB ' ' O ' ' A' ' 12' ' ' ALA . 69.8 mt -104.84 112.96 40.61 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.508 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 22.1 mt-10 -112.8 133.48 54.78 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -177.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.439 HG12 ' CD1' ' A' ' 92' ' ' ILE . 29.2 m -110.82 123.1 66.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 178.17 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -120.1 122.31 40.76 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -92.99 145.77 24.12 Favored 'General case' 0 N--CA 1.422 -1.868 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -87.04 -175.35 5.31 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.1 mtpm? -78.13 14.07 1.27 Allowed 'General case' 0 C--N 1.313 -0.99 0 O-C-N 121.935 -0.478 . . . . 0.0 111.915 -176.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -95.69 -130.67 6.34 Favored Glycine 0 N--CA 1.436 -1.331 0 N-CA-C 112.247 -0.341 . . . . 0.0 112.247 -179.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -97.23 145.79 25.73 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 -177.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.451 HH11 ' HG2' ' A' ' 81' ' ' ARG . 11.8 ttt-85 -90.15 -13.71 35.11 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 119.09 -1.044 . . . . 0.0 109.472 -178.621 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 23.2 p -128.2 140.86 51.68 Favored 'General case' 0 N--CA 1.432 -1.331 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.523 176.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -69.09 153.73 43.25 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 178.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -65.5 -15.88 63.11 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 121.58 0.705 . . . . 0.0 110.332 179.292 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -76.34 -12.95 60.15 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.838 177.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 83.25 63.11 1.75 Allowed Glycine 0 CA--C 1.505 -0.534 0 N-CA-C 109.314 -1.515 . . . . 0.0 109.314 -176.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 -156.16 147.61 22.63 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 105.755 -1.943 . . . . 0.0 105.755 -169.095 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -75.72 134.64 16.64 Favored Glycine 0 C--O 1.206 -1.594 0 C-N-CA 120.539 -0.839 . . . . 0.0 113.777 -173.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 62.7 mt -112.22 110.66 21.04 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 123.26 0.624 . . . . 0.0 111.741 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.471 ' HB3' ' HZ ' ' A' ' 34' ' ' PHE . . . -157.58 163.44 38.33 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 171.672 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.46 ' OH ' ' HB3' ' A' ' 98' ' ' MET . 35.6 t80 -95.14 141.73 28.42 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.439 ' CD1' HG12 ' A' ' 74' ' ' VAL . 49.5 mm -99.69 123.57 52.54 Favored 'Isoleucine or valine' 0 C--O 1.252 1.198 0 CA-C-O 121.206 0.526 . . . . 0.0 111.096 -179.475 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.508 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 96.2 m-85 -111.05 131.35 55.13 Favored 'General case' 0 C--N 1.29 -1.999 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 172.287 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.29 100.42 10.01 Favored 'General case' 0 C--N 1.286 -2.177 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 177.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.6 t70 47.57 57.32 6.02 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 122.474 1.131 . . . . 0.0 110.526 -177.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 77.27 -5.15 52.13 Favored Glycine 0 CA--C 1.53 0.989 0 CA-C-N 114.605 -1.18 . . . . 0.0 114.86 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 32.7 mtmm -104.37 124.25 48.86 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 117.625 0.712 . . . . 0.0 111.144 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' MET . . . . . 0.46 ' HB3' ' OH ' ' A' ' 91' ' ' TYR . 2.1 mpt? -63.23 112.82 2.84 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 123.907 0.883 . . . . 0.0 112.059 -176.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 91.9 t -73.2 -46.16 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.23 -177.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.457 ' O ' HG22 ' A' ' 104' ' ' VAL . 46.2 t30 -63.93 -37.23 86.65 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.121 -178.167 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -54.94 -44.13 74.0 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.157 176.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.91 -44.22 93.6 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.504 179.26 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 97.2 mt -58.03 -52.22 66.45 Favored 'General case' 0 C--O 1.244 0.779 0 CA-C-O 121.389 0.614 . . . . 0.0 111.209 178.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.475 HG11 ' CG1' ' A' ' 111' ' ' VAL . 27.2 m -70.78 -38.0 71.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.496 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -176.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.414 ' HG3' ' HB3' ' B' ' 141' ' ' SER . 82.4 mtp180 -65.0 -16.22 63.18 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 175.663 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -93.62 -5.6 48.38 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.766 174.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.29 25.1 69.27 Favored Glycine 0 CA--C 1.507 -0.438 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.68 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 90.4 mt -88.87 -15.97 33.13 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.744 0.307 . . . . 0.0 111.047 -178.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -157.26 174.3 15.66 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -178.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.652 ' HB2' ' HB3' ' A' ' 40' ' ' ASP . 18.4 mttt -119.28 170.98 8.63 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 176.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.52 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 32.8 m -108.05 107.32 22.53 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -177.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -141.32 118.08 11.05 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 119.599 -0.84 . . . . 0.0 112.92 176.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -122.99 98.0 5.7 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 105.293 -2.114 . . . . 0.0 105.293 164.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 97.9 t -133.2 116.21 25.15 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 N-CA-C 114.522 1.305 . . . . 0.0 114.522 -169.034 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -135.44 -9.96 2.18 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.984 169.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.412 ' HE3' ' OXT' ' A' ' 121' ' ' HIS . 5.0 mptp? 65.57 161.81 0.13 Allowed Pre-proline 0 N--CA 1.496 1.872 0 C-N-CA 123.74 0.816 . . . . 0.0 111.724 -175.489 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -70.3 -76.68 0.01 OUTLIER 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 121.159 1.24 . . . . 0.0 110.593 173.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -136.63 88.38 2.37 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 173.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -174.62 -32.19 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.576 -177.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 31.3 m 76.97 -48.38 0.53 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.043 1.337 . . . . 0.0 113.479 177.105 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' HIS . . . . . 0.412 ' OXT' ' HE3' ' A' ' 116' ' ' LYS . 66.4 t-80 . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.264 -177.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -0.973 0 N-CA-C 111.365 -0.694 . . . . 0.0 111.365 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 30.6 m -88.04 96.7 10.61 Favored 'General case' 0 N--CA 1.423 -1.822 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 6.1 p -78.4 93.65 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.544 0 CA-C-O 122.605 1.193 . . . . 0.0 111.024 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -133.43 74.17 1.55 Allowed 'General case' 0 C--N 1.292 -1.901 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 178.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -85.52 91.47 8.25 Favored 'General case' 0 N--CA 1.418 -2.046 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.418 -173.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 25.0 t -121.6 84.8 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.286 -2.163 0 N-CA-C 105.423 -2.065 . . . . 0.0 105.423 172.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -126.04 106.52 9.66 Favored 'General case' 0 C--N 1.292 -1.898 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.739 -175.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -87.02 167.66 20.9 Favored Pre-proline 0 C--N 1.294 -1.811 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 172.482 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -55.76 152.19 36.28 Favored 'Trans proline' 0 C--O 1.248 1.016 0 C-N-CA 121.47 1.447 . . . . 0.0 110.3 171.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -89.56 91.79 8.83 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 120.087 -0.645 . . . . 0.0 110.974 -176.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -171.68 61.82 0.03 OUTLIER 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 106.341 -1.725 . . . . 0.0 106.341 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 75.5 p -63.72 -8.66 11.01 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 114.292 1.219 . . . . 0.0 114.292 -173.097 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -85.68 2.17 46.4 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.824 -0.548 . . . . 0.0 111.289 173.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -37.76 -61.68 0.61 Allowed 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 126.731 2.012 . . . . 0.0 113.087 -178.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -47.58 -54.32 12.13 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.475 1.11 . . . . 0.0 113.883 -173.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.1 mt -60.54 -43.75 96.85 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.815 -177.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 138' ' ' LEU . . . . . 0.437 ' HB3' HG11 ' A' ' 111' ' ' VAL . 4.1 mm? -69.36 -38.03 77.88 Favored 'General case' 0 N--CA 1.432 -1.355 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.477 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -57.16 -45.6 83.48 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-O 120.859 0.361 . . . . 0.0 110.39 176.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -62.48 -43.4 98.92 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.931 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 141' ' ' SER . . . . . 0.414 ' HB3' ' HG3' ' A' ' 105' ' ' ARG . 25.2 m -65.24 -41.24 94.56 Favored 'General case' 0 N--CA 1.438 -1.03 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.539 -178.531 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.438 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 34.4 tt0 -67.06 -50.77 60.78 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.198 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.88 -34.78 70.13 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.819 0.699 . . . . 0.0 111.908 -177.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 144' ' ' GLN . . . . . 0.453 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 57.8 tt0 -61.94 -48.01 82.31 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -70.56 -32.66 70.16 Favored 'General case' 0 C--O 1.245 0.853 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.771 -178.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 146' ' ' LYS . . . . . 0.438 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 81.6 mttt -57.9 -51.21 70.56 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 123.661 0.601 . . . . 0.0 109.645 176.692 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -71.07 -22.87 62.06 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.548 -176.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 148' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 22.8 mm-40 -87.24 -4.35 59.09 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 121.073 -0.251 . . . . 0.0 111.588 178.586 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 149' ' ' LYS . . . . . 0.596 ' O ' ' HB3' ' B' ' 154' ' ' SER . 10.0 mmpt? 54.71 57.36 5.78 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.076 0.95 . . . . 0.0 108.855 -176.049 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 98.2 mt -95.49 119.3 33.74 Favored 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 120.084 -0.646 . . . . 0.0 112.539 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 50.9 -84.41 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 127.633 2.373 . . . . 0.0 114.181 175.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 152' ' ' ILE . . . . . 0.568 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 58.5 mt -68.56 -34.06 63.27 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.41 0 CA-C-O 121.764 0.792 . . . . 0.0 109.784 178.118 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 60.0 m95 -81.53 -11.1 59.3 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.767 -172.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 154' ' ' SER . . . . . 0.596 ' HB3' ' O ' ' B' ' 149' ' ' LYS . 79.6 p -91.14 0.86 57.45 Favored 'General case' 0 N--CA 1.423 -1.803 0 C-N-CA 119.73 -0.788 . . . . 0.0 112.438 -178.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 155' ' ' GLU . . . . . 0.568 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 5.6 pt-20 -93.82 -17.76 22.74 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 174.307 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 13.7 t70 . . . . . 0 N--CA 1.431 -1.409 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.3 -170.984 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.426 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.6 p -90.91 -40.67 11.59 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 121.396 0.617 . . . . 0.0 110.024 177.235 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.7 m -88.45 78.43 7.89 Favored 'General case' 0 N--CA 1.424 -1.749 0 CA-C-O 121.541 0.686 . . . . 0.0 110.222 178.497 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.5 p -91.23 -56.9 2.97 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.939 177.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.477 ' HB3' ' H ' ' B' ' 134' ' ' HIS . 61.4 mttp -131.5 22.83 4.73 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 177.031 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -123.77 124.39 42.6 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 105.116 -2.179 . . . . 0.0 105.116 -178.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.438 ' CD1' ' HA ' ' A' ' 77' ' ' ASP . 96.1 mt -104.7 -149.89 0.42 Allowed 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 117.917 0.326 . . . . 0.0 111.244 -177.465 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.6 m-70 -100.25 116.24 31.77 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 122.173 -0.329 . . . . 0.0 110.957 -177.3 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 21.2 pttp -110.42 141.92 42.85 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 176.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -139.34 143.75 37.36 Favored Pre-proline 0 C--N 1.276 -2.607 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.29 177.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -62.04 147.91 94.2 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.825 2.35 . . . . 0.0 113.487 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.02 166.09 25.41 Favored 'General case' 0 C--N 1.307 -1.266 0 C-N-CA 124.499 1.12 . . . . 0.0 108.965 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.45 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 57.2 m -100.76 132.03 46.36 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 178.658 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.452 ' HA ' HD13 ' A' ' 25' ' ' LEU . 54.2 tp -79.98 126.23 30.77 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 120.995 0.426 . . . . 0.0 110.316 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.3 mm -92.07 -54.62 7.12 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.674 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 175.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -166.42 149.08 6.88 Favored 'General case' 0 N--CA 1.425 -1.702 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.809 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -82.45 128.84 34.66 Favored 'General case' 0 N--CA 1.438 -1.075 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 171.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 47.5 mm -102.79 -51.8 8.71 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.719 0 CA-C-O 121.057 0.456 . . . . 0.0 109.961 -174.291 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -133.65 -176.8 4.28 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.66 50.54 4.01 Favored Glycine 0 C--O 1.222 -0.643 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 175.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.623 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 5.6 t70 -178.61 -59.91 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 -170.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.544 ' HA ' ' O ' ' A' ' 34' ' ' PHE . 21.5 m -82.32 120.14 25.03 Favored 'General case' 0 N--CA 1.409 -2.507 0 CA-C-N 113.597 -1.638 . . . . 0.0 111.246 -176.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.6 m -126.9 144.56 36.69 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.353 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 177.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -98.25 119.57 37.14 Favored 'General case' 0 C--N 1.292 -1.893 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -176.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.601 HD11 HG21 ' A' ' 72' ' ' ILE . 3.1 mm? -120.42 158.27 27.54 Favored 'General case' 0 CA--C 1.5 -0.963 0 CA-C-O 121.462 0.648 . . . . 0.0 111.985 -176.699 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.45 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 27.0 ttt -124.07 105.98 9.99 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 174.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -113.8 116.46 29.38 Favored 'General case' 0 C--N 1.292 -1.909 0 C-N-CA 119.191 -1.004 . . . . 0.0 110.086 -178.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 94.6 mttt 57.73 38.14 27.41 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.482 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 91.77 -1.52 75.11 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-N 114.354 -1.294 . . . . 0.0 113.83 175.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -107.74 106.22 57.97 Favored Pre-proline 0 C--N 1.314 -0.963 0 CA-C-N 117.183 0.492 . . . . 0.0 110.437 -177.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.558 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 33.9 Cg_endo -90.89 125.22 1.02 Allowed 'Trans proline' 0 N--CA 1.448 -1.149 0 C-N-CA 123.007 2.471 . . . . 0.0 112.908 178.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 63.6 mtt -141.32 156.23 45.87 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.016 178.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.3 m -90.67 103.83 16.48 Favored 'General case' 0 C--N 1.294 -1.844 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 178.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.544 ' O ' ' HA ' ' A' ' 22' ' ' THR . 73.5 m-85 -95.29 125.25 39.79 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 -170.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.623 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 6.7 mmm180 -95.68 146.12 24.75 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 125.417 1.487 . . . . 0.0 108.281 175.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.46 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 93.3 mt -82.65 125.21 30.95 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 121.631 0.729 . . . . 0.0 111.484 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 69.3 mt -79.0 139.38 38.21 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.333 174.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.555 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 87.9 mt 73.77 10.99 4.66 Favored 'General case' 0 C--O 1.218 -0.598 0 C-N-CA 125.158 1.383 . . . . 0.0 111.919 178.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.42 ' CG2' HD22 ' A' ' 100' ' ' ASN . 66.6 t -128.85 136.32 60.08 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.242 0 CA-C-O 121.084 0.468 . . . . 0.0 110.093 -179.497 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -121.68 107.87 12.87 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.0 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.447 ' H ' ' CD ' ' A' ' 42' ' ' PRO . 8.7 m -123.26 -49.66 0.04 OUTLIER Pre-proline 0 C--N 1.31 -1.122 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.778 176.136 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.447 ' CD ' ' H ' ' A' ' 41' ' ' THR . 34.2 Cg_exo -61.61 156.84 45.1 Favored 'Trans proline' 0 C--N 1.391 2.808 0 C-N-CA 121.572 1.514 . . . . 0.0 111.64 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 71.02 175.41 0.29 Allowed 'General case' 0 C--O 1.236 0.359 0 O-C-N 124.16 0.913 . . . . 0.0 111.205 -179.167 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 23.2 m 70.29 74.4 0.21 Allowed 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 123.855 0.862 . . . . 0.0 111.01 178.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.556 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 0.0 OUTLIER -96.52 -51.8 4.2 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 118.43 -1.308 . . . . 0.0 111.01 176.662 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 87.0 m-70 34.21 73.19 0.62 Allowed Pre-proline 0 N--CA 1.498 1.967 0 C-N-CA 125.247 1.419 . . . . 0.0 113.004 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_exo -65.27 97.08 0.29 Allowed 'Trans proline' 0 C--O 1.241 0.641 0 C-N-CA 122.118 1.879 . . . . 0.0 114.167 -176.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.444 ' HB2' ' OE1' ' A' ' 52' ' ' GLU . 10.3 mtmp? -115.35 -45.97 2.9 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 172.459 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -97.15 -34.53 11.1 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 172.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 132.78 72.73 0.09 OUTLIER Glycine 0 CA--C 1.492 -1.349 0 N-CA-C 108.946 -1.661 . . . . 0.0 108.946 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.556 ' HA ' ' O ' ' A' ' 45' ' ' LYS . 52.6 t 61.56 89.5 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 -171.419 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.444 ' OE1' ' HB2' ' A' ' 48' ' ' LYS . 4.5 mm-40 -56.09 -32.41 64.12 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 113.938 -1.483 . . . . 0.0 113.264 -169.375 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.503 ' HE2' HD12 ' B' ' 152' ' ' ILE . 13.9 ptmm? -85.41 -13.1 50.4 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.416 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 74.91 91.79 0.08 Allowed 'General case' 0 CA--C 1.509 -0.6 0 C-N-CA 124.659 1.184 . . . . 0.0 112.2 -175.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -71.44 -58.59 5.38 Favored Glycine 0 C--O 1.246 0.857 0 CA-C-N 114.401 -1.272 . . . . 0.0 112.833 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -46.06 -54.84 4.19 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 124.006 3.137 . . . . 0.0 113.125 177.151 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -60.3 -46.59 89.33 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.04 -44.57 96.41 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.271 0.558 . . . . 0.0 110.853 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.6 m -69.17 -44.61 71.87 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.928 -178.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.503 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -65.19 -41.63 94.39 Favored 'General case' 0 C--O 1.209 -1.044 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.924 -178.772 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -59.96 -43.7 94.89 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 122.588 0.355 . . . . 0.0 110.315 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.2 m -60.7 -50.99 71.25 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.624 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.76 -36.83 85.59 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.837 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.503 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 98.2 mttt -56.96 -46.83 81.89 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 174.674 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.1 mmt -65.65 -51.5 59.02 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 32.9 m -74.36 -31.61 28.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -174.086 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -81.12 -28.22 35.23 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 119.536 -0.866 . . . . 0.0 110.944 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -82.01 -25.56 34.59 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.83 177.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.402 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -58.74 145.86 38.82 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 123.209 0.604 . . . . 0.0 111.683 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -79.46 -37.29 37.26 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.401 ' HE3' ' HB2' ' A' ' 71' ' ' LYS . 44.2 mtmt -133.59 145.48 50.09 Favored 'General case' 0 CA--C 1.484 -1.563 0 CA-C-N 114.625 -1.171 . . . . 0.0 108.85 -178.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.601 HG21 HD11 ' A' ' 25' ' ' LEU . 4.2 mp -117.52 118.54 58.84 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.612 0 N-CA-C 105.348 -2.094 . . . . 0.0 105.348 171.426 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.606 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 31.5 mt-10 -112.84 141.36 46.74 Favored 'General case' 0 C--N 1.28 -2.453 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -173.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.516 HG12 ' CD1' ' A' ' 92' ' ' ILE . 30.6 m -112.71 124.57 69.5 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.277 -178.179 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 91' ' ' TYR . 35.5 tt0 -109.75 115.56 30.07 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 175.53 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -87.94 127.46 35.37 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-O 121.397 0.617 . . . . 0.0 111.639 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.438 ' HA ' ' CD1' ' A' ' 7' ' ' LEU . 11.4 t70 -95.8 166.44 11.8 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.086 -0.961 . . . . 0.0 111.798 -174.519 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -62.31 -24.05 67.09 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 125.847 1.659 . . . . 0.0 110.904 -177.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -55.05 -84.07 0.04 OUTLIER Glycine 0 CA--C 1.493 -1.315 0 O-C-N 123.549 0.531 . . . . 0.0 114.309 -175.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.558 ' HB2' HD12 ' A' ' 89' ' ' LEU . 98.0 mt-30 -149.86 149.61 30.72 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 178.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -84.37 -34.64 23.57 Favored 'General case' 0 C--N 1.285 -2.205 0 CA-C-O 121.599 0.714 . . . . 0.0 109.092 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.446 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 6.9 p -144.48 148.27 34.32 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-N 114.922 -1.035 . . . . 0.0 108.809 -179.451 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.449 ' HB2' HD11 ' A' ' 89' ' ' LEU . 24.4 t70 -110.67 158.28 18.78 Favored 'General case' 0 C--N 1.294 -1.83 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -63.46 -16.9 61.96 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.047 0.939 . . . . 0.0 111.13 -179.43 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -65.3 -20.51 66.44 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 121.373 0.606 . . . . 0.0 109.37 176.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 102.54 24.69 8.12 Favored Glycine 0 N--CA 1.443 -0.846 0 CA-C-N 115.584 -0.734 . . . . 0.0 112.947 176.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -130.07 159.21 37.44 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.446 ' HA2' ' HA ' ' A' ' 82' ' ' THR . . . -88.55 161.18 30.89 Favored Glycine 0 N--CA 1.427 -1.922 0 N-CA-C 109.118 -1.593 . . . . 0.0 109.118 177.235 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.558 HD12 ' HB2' ' A' ' 80' ' ' GLN . 91.1 mt -130.24 118.37 21.26 Favored 'General case' 0 C--N 1.286 -2.174 0 CA-C-N 117.38 0.59 . . . . 0.0 110.318 -177.485 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.17 168.01 28.63 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.239 0.543 . . . . 0.0 110.716 -178.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.459 ' HB3' ' HB3' ' A' ' 75' ' ' GLU . 18.2 t80 -97.79 126.47 43.16 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 105.363 -2.088 . . . . 0.0 105.363 173.509 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.516 ' CD1' HG12 ' A' ' 74' ' ' VAL . 47.8 mm -99.84 129.97 49.66 Favored 'Isoleucine or valine' 0 C--O 1.246 0.874 0 C-N-CA 119.75 -0.78 . . . . 0.0 112.912 -176.425 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.606 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 41.1 m-85 -110.62 145.32 38.1 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.434 173.567 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.402 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -109.41 99.35 8.6 Favored 'General case' 0 C--N 1.29 -1.982 0 N-CA-C 106.417 -1.697 . . . . 0.0 106.417 173.271 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.317 3.7 p30 42.13 57.42 3.28 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 114.228 1.196 . . . . 0.0 114.228 -176.509 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.62 -18.49 52.48 Favored Glycine 0 N--CA 1.432 -1.594 0 CA-C-N 114.948 -1.024 . . . . 0.0 113.992 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -90.47 147.35 23.46 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-N 117.114 0.457 . . . . 0.0 110.069 -177.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 57.4 mtt -92.4 108.1 19.71 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-O 121.471 0.653 . . . . 0.0 111.853 -177.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 62.4 t -67.67 -42.32 86.34 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 CA-C-N 114.51 -1.223 . . . . 0.0 109.763 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.46 ' ND2' ' HB3' ' A' ' 36' ' ' LEU . 11.8 m120 -54.13 -49.08 70.01 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.828 177.09 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -54.08 -56.08 21.42 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.377 175.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.83 -41.08 73.71 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 89.6 mt -65.06 -46.58 80.62 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 57.8 t -73.12 -38.26 54.66 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.158 0 CA-C-O 120.588 0.232 . . . . 0.0 110.866 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.513 ' CZ ' ' HA ' ' B' ' 141' ' ' SER . 12.7 tpp180 -65.33 -34.89 79.4 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.556 0.743 . . . . 0.0 110.898 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -84.94 -3.34 58.7 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.205 177.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.543 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 70.69 38.26 67.25 Favored Glycine 0 N--CA 1.432 -1.614 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.661 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 82.8 mt -103.79 -10.9 17.91 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 121.628 0.728 . . . . 0.0 109.287 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -150.18 169.9 20.23 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 114.475 -1.238 . . . . 0.0 108.923 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.432 ' HG3' HD13 ' B' ' 152' ' ' ILE . 93.4 mttt -123.21 159.01 29.57 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 176.86 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.5 p -83.79 124.24 39.52 Favored 'Isoleucine or valine' 0 C--O 1.246 0.913 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.846 177.274 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.555 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . -101.33 121.83 42.6 Favored 'General case' 0 C--N 1.305 -1.331 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -95.84 116.19 28.54 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -176.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 72.3 t -124.01 105.67 15.82 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 N-CA-C 107.643 -1.244 . . . . 0.0 107.643 174.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.419 ' HB2' ' ND2' ' A' ' 119' ' ' ASN . 93.8 m-85 -99.56 46.87 0.96 Allowed 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 178.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 55.6 mmtt 68.92 134.86 0.04 OUTLIER Pre-proline 0 C--O 1.212 -0.903 0 C-N-CA 124.821 1.248 . . . . 0.0 110.465 -169.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.75 -17.13 41.23 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 122.824 2.35 . . . . 0.0 113.12 -175.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -83.67 3.98 30.62 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 179.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ASN . . . . . 0.443 ' ND2' ' HB3' ' A' ' 121' ' ' HIS . 25.7 p-10 -78.95 -26.07 43.55 Favored 'General case' 0 C--O 1.223 -0.297 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 176.313 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 7.7 m 66.68 38.09 4.08 Favored 'General case' 0 CA--C 1.557 1.215 0 CA-C-O 122.536 1.16 . . . . 0.0 109.689 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' HIS . . . . . 0.443 ' HB3' ' ND2' ' A' ' 119' ' ' ASN . 27.9 t60 . . . . . 0 C--O 1.246 0.891 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.497 -1.062 0 N-CA-C 110.664 -0.974 . . . . 0.0 110.664 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 40.1 p -80.59 112.66 18.16 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.395 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 51.2 t -78.17 90.19 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.967 0 CA-C-O 121.685 0.755 . . . . 0.0 109.919 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -148.37 126.32 12.0 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.186 -0.915 . . . . 0.0 108.866 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -93.36 96.58 10.03 Favored 'General case' 0 C--N 1.298 -1.671 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 178.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 127' ' ' VAL . . . . . 0.477 ' C ' ' H ' ' B' ' 129' ' ' LYS . 26.3 m -121.49 -52.05 3.22 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 CA-C-N 116.026 -0.534 . . . . 0.0 112.228 -178.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . 0.27 44.5 m-85 62.79 -27.39 0.07 Allowed 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 125.272 1.429 . . . . 0.0 114.834 -175.6 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.477 ' H ' ' C ' ' B' ' 127' ' ' VAL . 35.3 mtmm -73.8 115.56 43.28 Favored Pre-proline 0 C--N 1.291 -1.968 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 170.659 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 130' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' B' ' 129' ' ' LYS . 1.6 Cg_endo -75.56 -175.65 2.56 Favored 'Trans proline' 0 N--CA 1.437 -1.823 0 C-N-CA 122.073 1.849 . . . . 0.0 113.838 -173.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -81.32 88.53 6.08 Favored 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 175.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 26.0 p-10 -109.21 10.92 25.71 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 113.75 -1.568 . . . . 0.0 108.474 -175.06 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 133' ' ' THR . . . . . 0.401 HG22 ' CD2' ' B' ' 134' ' ' HIS . 17.3 m -56.97 97.46 0.02 OUTLIER 'General case' 0 N--CA 1.412 -2.373 0 C-N-CA 125.737 1.615 . . . . 0.0 112.417 -176.569 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 134' ' ' HIS . . . . . 0.477 ' H ' ' HB3' ' A' ' 5' ' ' LYS . 79.6 m-70 69.46 18.69 7.79 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.833 1.653 . . . . 0.0 111.577 179.072 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -47.01 -49.68 20.6 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.865 0.866 . . . . 0.0 111.967 -178.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 136' ' ' GLN . . . . . 0.496 ' O ' ' HG3' ' B' ' 140' ' ' LYS . 9.4 pt20 -51.48 -48.77 62.74 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.738 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 85.0 mt -70.35 -44.88 67.24 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.427 -177.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.65 -34.06 77.4 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.422 -178.169 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 139' ' ' ARG . . . . . 0.558 ' O ' ' HD3' ' B' ' 139' ' ' ARG . 0.0 OUTLIER -76.31 -36.35 58.35 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.574 -179.905 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 140' ' ' LYS . . . . . 0.496 ' HG3' ' O ' ' B' ' 136' ' ' GLN . 29.6 mtpp -69.24 -29.69 67.67 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-O 121.066 0.46 . . . . 0.0 110.132 177.722 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 141' ' ' SER . . . . . 0.513 ' HA ' ' CZ ' ' A' ' 105' ' ' ARG . 22.6 t -61.2 -55.05 36.58 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-N 114.806 -1.088 . . . . 0.0 108.342 175.273 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.481 ' HG3' ' CH2' ' B' ' 153' ' ' TRP . 33.2 tt0 -59.48 -53.15 61.39 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.63 -1.168 . . . . 0.0 111.087 178.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.6 -42.58 75.06 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -176.062 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -71.72 -46.97 56.95 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.052 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -65.0 -31.92 73.39 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.919 -177.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 146' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 87.7 mttt -59.62 -47.98 83.48 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.247 0.546 . . . . 0.0 110.363 175.014 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -70.52 -31.8 69.02 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.548 -176.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -76.25 -22.1 55.54 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.6 177.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 149' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' B' ' 154' ' ' SER . 51.0 mtpt 56.47 65.13 1.49 Allowed 'General case' 0 N--CA 1.441 -0.902 0 C-N-CA 124.434 1.093 . . . . 0.0 110.477 -174.281 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 89.5 mt -94.96 122.02 37.18 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.239 -179.041 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 151' ' ' ASN . . . . . 0.543 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 39.6 m-80 46.4 -89.16 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 126.25 1.82 . . . . 0.0 114.191 179.279 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 152' ' ' ILE . . . . . 0.503 HD12 ' HE2' ' A' ' 53' ' ' LYS . 13.3 tt -70.29 -30.94 45.28 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.751 0 CA-C-O 121.3 0.571 . . . . 0.0 110.027 -177.269 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 153' ' ' TRP . . . . . 0.481 ' CH2' ' HG3' ' B' ' 142' ' ' GLU . 65.9 m95 -78.26 -7.22 56.92 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 121.683 0.754 . . . . 0.0 110.172 -178.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 154' ' ' SER . . . . . 0.423 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 8.2 t -102.85 19.4 19.4 Favored 'General case' 0 N--CA 1.408 -2.542 0 CA-C-N 115.394 -0.821 . . . . 0.0 108.905 179.083 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -71.34 -16.38 62.43 Favored 'General case' 0 C--N 1.351 0.673 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 174.34 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 15.7 t70 . . . . . 0 N--CA 1.436 -1.139 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.362 176.169 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.412 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 29.6 m -134.89 111.0 9.51 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 121.356 0.598 . . . . 0.0 109.695 179.11 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 45.6 m -138.9 112.19 8.09 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 176.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.8 m -125.2 -38.41 2.31 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.915 -175.709 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -86.54 -19.43 29.48 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.444 0.64 . . . . 0.0 109.518 178.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -118.61 122.98 43.87 Favored 'General case' 0 N--CA 1.435 -1.223 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 170.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.468 HD13 ' HA ' ' A' ' 77' ' ' ASP . 96.6 mt -106.2 165.11 11.47 Favored 'General case' 0 C--N 1.286 -2.167 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 54.6 m80 -77.55 103.22 7.36 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 121.181 0.515 . . . . 0.0 110.441 -178.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 74' ' ' VAL . 27.7 ttpp -115.32 131.38 56.95 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.012 179.267 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.59 163.83 46.94 Favored Pre-proline 0 C--N 1.296 -1.749 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -79.72 150.36 21.36 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.192 1.928 . . . . 0.0 112.185 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.25 156.84 46.79 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.109 177.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.468 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 18.0 m -101.32 138.41 38.38 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 177.507 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 61.7 tp -76.11 126.52 31.15 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 -179.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 48.2 mm -98.41 -55.11 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 175.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 58.5 pttt -175.12 148.09 0.97 Allowed 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 122.432 0.293 . . . . 0.0 111.198 178.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -104.32 115.64 30.75 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 174.074 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.6 mp -86.91 -47.31 16.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.195 0 CA-C-O 121.416 0.627 . . . . 0.0 109.744 -175.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -138.95 175.71 9.32 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.279 -176.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.03 52.96 4.45 Favored Glycine 0 C--N 1.316 -0.581 0 N-CA-C 108.572 -1.811 . . . . 0.0 108.572 172.439 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.478 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 7.7 t70 -172.53 -58.97 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 -172.406 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 23.8 m -98.41 117.46 32.88 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 114.438 -1.255 . . . . 0.0 110.89 -176.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.4 m -133.45 156.43 41.66 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.427 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -121.24 125.08 46.21 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.467 -0.77 . . . . 0.0 109.965 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.0 mp -131.16 159.11 38.63 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.093 0.473 . . . . 0.0 110.436 -178.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.468 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 49.0 ttm -116.09 115.92 26.94 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.105 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -121.92 132.45 54.56 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 59.3 mttp 60.83 26.34 16.19 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.958 0.903 . . . . 0.0 110.586 -176.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 82.62 3.41 90.52 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 121.148 -0.548 . . . . 0.0 112.047 -177.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -105.24 113.03 64.94 Favored Pre-proline 0 C--N 1.315 -0.918 0 O-C-N 122.541 -0.388 . . . . 0.0 110.914 -178.398 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -85.93 120.22 1.94 Allowed 'Trans proline' 0 N--CA 1.443 -1.472 0 C-N-CA 122.389 2.059 . . . . 0.0 112.047 177.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 49.7 mtt -132.35 156.09 47.25 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.021 176.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.4 m -88.48 115.97 26.38 Favored 'General case' 0 N--CA 1.418 -2.043 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -102.14 166.88 10.36 Favored 'General case' 0 N--CA 1.414 -2.225 0 CA-C-O 122.127 0.965 . . . . 0.0 111.157 -177.071 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.478 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 18.4 ttp180 -139.2 136.63 35.23 Favored 'General case' 0 N--CA 1.405 -2.714 0 N-CA-C 107.124 -1.435 . . . . 0.0 107.124 172.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.0 mp -69.8 119.08 13.49 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 123.997 0.811 . . . . 0.0 110.23 -176.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.0 mt -57.66 131.47 50.36 Favored 'General case' 0 CA--C 1.499 -0.991 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.145 177.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.467 ' HB2' HD22 ' B' ' 138' ' ' LEU . 87.5 mt 73.19 19.92 3.46 Favored 'General case' 0 C--O 1.217 -0.648 0 O-C-N 125.205 1.565 . . . . 0.0 112.696 175.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.7 t -111.15 125.9 68.51 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 177.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -125.47 110.13 13.54 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.9 p -114.41 91.09 22.96 Favored Pre-proline 0 C--N 1.306 -1.297 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 169.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -101.95 -155.0 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.088 0 C-N-CA 123.137 2.558 . . . . 0.0 113.739 -173.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -128.19 153.39 46.95 Favored 'General case' 0 N--CA 1.423 -1.79 0 N-CA-C 103.533 -2.766 . . . . 0.0 103.533 174.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.1 t -150.59 -175.52 5.14 Favored 'General case' 0 C--N 1.29 -1.996 0 C-N-CA 119.179 -1.008 . . . . 0.0 110.156 -174.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.478 ' O ' ' HD3' ' A' ' 45' ' ' LYS . 8.9 tmtt? -64.38 -33.47 75.92 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.637 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 42.8 m80 -68.11 127.7 93.28 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 172.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -33.32 130.0 0.13 Allowed 'Trans proline' 0 C--N 1.36 1.144 0 C-N-CA 125.11 3.873 . . . . 0.0 115.702 -174.335 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.48 ' O ' ' HB2' ' A' ' 52' ' ' GLU . 36.7 ttmt -50.21 -49.4 52.79 Favored 'General case' 0 CA--C 1.491 -1.295 0 C-N-CA 124.76 1.224 . . . . 0.0 110.205 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.1 mtpp -85.76 10.47 13.51 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 122.078 0.942 . . . . 0.0 111.269 -174.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -97.64 -49.38 1.82 Allowed Glycine 0 C--N 1.291 -1.95 0 N-CA-C 109.221 -1.552 . . . . 0.0 109.221 174.391 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 26.9 m -86.76 -6.28 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 CA-C-O 121.391 0.615 . . . . 0.0 111.044 178.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.48 ' HB2' ' O ' ' A' ' 48' ' ' LYS . 39.9 tt0 -58.37 -34.55 70.81 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 124.151 0.98 . . . . 0.0 111.753 -178.233 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 57' ' ' GLU . 47.5 pttt -57.8 -19.8 31.09 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -177.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -78.38 -21.58 49.16 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.041 -177.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -64.46 -59.23 8.55 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 120.976 -0.63 . . . . 0.0 112.612 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.453 ' HA ' ' OG ' ' A' ' 59' ' ' SER . 20.2 Cg_exo -69.79 -12.45 32.85 Favored 'Trans proline' 0 C--N 1.369 1.651 0 C-N-CA 122.454 2.103 . . . . 0.0 111.755 176.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 53' ' ' LYS . 6.7 tp10 -78.48 -48.71 14.79 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 177.655 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.41 -37.68 80.55 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.862 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.453 ' OG ' ' HA ' ' A' ' 56' ' ' PRO . 26.1 p -68.17 -36.98 80.47 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.16 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -67.8 -43.63 79.23 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 176.099 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.29 -48.41 81.73 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.659 -179.439 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.453 HG23 HD21 ' A' ' 103' ' ' LEU . 12.2 p -62.94 -48.85 77.12 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.907 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -56.77 -46.92 81.16 Favored 'General case' 0 CA--C 1.509 -0.621 0 O-C-N 123.349 0.406 . . . . 0.0 111.8 179.289 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -56.76 -46.17 81.59 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.423 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 49.1 ttm -68.46 -46.47 69.69 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 123.366 0.416 . . . . 0.0 111.881 -177.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.8 m -70.33 -36.65 67.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -177.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -71.95 -34.88 69.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.733 0.302 . . . . 0.0 110.834 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -71.95 -37.77 69.91 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.152 0.501 . . . . 0.0 110.79 -178.409 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.68 153.73 40.87 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.304 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -86.22 -18.22 32.72 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-O 121.125 0.488 . . . . 0.0 110.766 179.039 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -130.46 125.74 35.16 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.382 -175.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 64.0 mt -106.86 112.74 41.13 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.84 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 170.04 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.6 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 26.8 mt-10 -115.42 137.23 52.27 Favored 'General case' 0 C--N 1.285 -2.229 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.365 -172.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.466 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 18.9 m -110.89 121.23 63.22 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 175.199 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.482 ' HB3' ' HB2' ' A' ' 91' ' ' TYR . 40.6 tt0 -110.76 121.09 44.47 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.455 ' O ' ' HB3' ' A' ' 7' ' ' LEU . 88.3 m-85 -95.84 147.0 24.11 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 178.161 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.53 ' HB3' ' HB2' ' B' ' 131' ' ' ASN . 10.8 t70 -85.0 -179.36 7.04 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 -177.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.529 ' HG2' ' OD1' ' A' ' 77' ' ' ASP . 21.2 pttp -73.05 -16.15 61.49 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 123.115 0.566 . . . . 0.0 112.084 -172.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.498 ' HA3' ' HB3' ' B' ' 131' ' ' ASN . . . -89.99 -107.15 1.25 Allowed Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.865 -179.373 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -110.9 165.06 12.16 Favored 'General case' 0 C--N 1.309 -1.193 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.826 -173.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 63.2 mtp180 -109.57 -21.4 12.47 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.83 -174.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 22.9 p -130.39 155.64 46.06 Favored 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.8 p30 -98.91 -167.65 1.52 Allowed 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 178.238 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -111.21 7.96 21.4 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 121.931 0.872 . . . . 0.0 109.305 177.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -86.84 -25.62 24.44 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 114.344 -1.298 . . . . 0.0 107.878 -178.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 105.46 49.12 0.99 Allowed Glycine 0 CA--C 1.487 -1.694 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 177.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.428 ' HG2' ' HB2' ' A' ' 35' ' ' ARG . 10.4 tpp85 -151.74 153.59 34.63 Favored 'General case' 0 N--CA 1.414 -2.268 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 -177.177 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -95.63 133.49 11.51 Favored Glycine 0 N--CA 1.432 -1.591 0 N-CA-C 108.595 -1.802 . . . . 0.0 108.595 173.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.2 pp -112.84 125.66 54.59 Favored 'General case' 0 N--CA 1.411 -2.415 0 CA-C-N 118.138 0.969 . . . . 0.0 112.91 -177.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -152.63 162.29 41.43 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.313 -179.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.482 ' HB2' ' HB3' ' A' ' 75' ' ' GLU . 83.6 m-85 -87.49 128.6 35.23 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 105.58 -2.007 . . . . 0.0 105.58 174.057 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 48.4 mm -99.32 123.9 52.29 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.663 0 C-N-CA 120.029 -0.668 . . . . 0.0 109.241 -177.082 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.6 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 6.1 m-85 -116.84 143.56 45.54 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.536 178.522 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -121.55 100.24 6.91 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 175.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.1 t70 46.77 58.72 4.45 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 124.802 1.241 . . . . 0.0 111.323 -175.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.96 -22.5 11.73 Favored Glycine 0 N--CA 1.444 -0.829 0 CA-C-N 114.818 -1.083 . . . . 0.0 114.475 179.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -80.32 129.55 34.58 Favored 'General case' 0 CA--C 1.501 -0.92 0 CA-C-N 117.475 0.638 . . . . 0.0 111.309 -178.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -75.68 105.84 6.93 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.214 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 52.2 t -73.19 -39.18 56.1 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.09 0 CA-C-O 121.452 0.644 . . . . 0.0 109.554 -178.253 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -64.61 -44.41 90.68 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.689 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -66.42 -33.78 76.48 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.995 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.42 -37.81 84.82 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.09 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.453 HD21 HG23 ' A' ' 62' ' ' THR . 84.9 mt -63.13 -44.45 95.57 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.042 177.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 44.0 t -69.7 -37.78 74.71 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.156 0 CA-C-O 121.549 0.69 . . . . 0.0 109.591 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -61.72 -44.85 96.12 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 124.953 1.301 . . . . 0.0 111.693 179.344 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -83.59 2.12 38.83 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.27 -177.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.463 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 66.04 35.87 91.2 Favored Glycine 0 N--CA 1.43 -1.759 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 -179.042 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.6 mt -96.69 -18.61 19.56 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -151.19 164.85 35.6 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 115.232 -0.895 . . . . 0.0 108.816 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.415 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 94.5 mttt -104.39 168.79 8.87 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 176.409 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.443 HG12 ' OE2' ' B' ' 142' ' ' GLU . 7.4 p -79.12 132.54 31.9 Favored 'Isoleucine or valine' 0 C--O 1.251 1.173 0 C-N-CA 118.205 -1.398 . . . . 0.0 107.937 175.289 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.82 158.16 18.22 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.546 -178.409 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -88.31 149.73 23.62 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-O 121.595 0.712 . . . . 0.0 112.144 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.713 HG21 ' HB3' ' B' ' 132' ' ' ASN . 18.2 t -88.8 134.36 28.55 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.013 0 CA-C-N 114.512 -1.222 . . . . 0.0 109.799 -174.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.45 ' O ' ' HD3' ' A' ' 117' ' ' PRO . 88.5 t80 -83.6 140.63 32.1 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 175.337 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -101.38 104.76 35.75 Favored Pre-proline 0 C--N 1.302 -1.49 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.45 ' HD3' ' O ' ' A' ' 115' ' ' TYR . 91.9 Cg_endo -89.65 -157.97 0.07 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.56 0 C-N-CA 122.368 2.046 . . . . 0.0 108.976 175.431 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -80.72 69.25 7.21 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.597 0.713 . . . . 0.0 111.177 -179.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -127.75 -6.36 5.68 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 176.165 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.445 ' HA ' ' HB3' ' B' ' 129' ' ' LYS . 9.0 t -71.24 114.99 9.87 Favored 'General case' 0 N--CA 1.425 -1.716 0 CA-C-N 115.264 -0.88 . . . . 0.0 112.303 -172.56 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 . . . . . 0 N--CA 1.43 -1.465 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 176.838 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.529 0 N-CA-C 111.934 -0.466 . . . . 0.0 111.934 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 51.1 m -87.05 179.93 6.59 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 39.4 t -85.57 88.26 2.63 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.199 0 C-N-CA 120.543 -0.463 . . . . 0.0 111.403 -177.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . 50.97 -91.74 0.02 OUTLIER 'General case' 0 C--O 1.253 1.285 0 C-N-CA 126.129 1.771 . . . . 0.0 114.975 174.567 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -91.31 101.23 13.93 Favored 'General case' 0 N--CA 1.433 -1.282 0 N-CA-C 107.41 -1.329 . . . . 0.0 107.41 -177.003 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 22.0 t -86.24 -22.3 7.25 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 CA-C-O 121.913 0.863 . . . . 0.0 110.812 -174.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -85.02 46.63 1.3 Allowed 'General case' 0 C--N 1.292 -1.932 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.221 -175.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.445 ' HB3' ' HA ' ' A' ' 120' ' ' THR . 60.8 mttm -59.71 -46.35 98.51 Favored Pre-proline 0 CA--C 1.564 1.513 0 CA-C-N 114.653 -1.158 . . . . 0.0 113.318 -176.603 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -78.38 -164.01 0.25 Allowed 'Trans proline' 0 CA--C 1.557 1.644 0 C-N-CA 121.638 1.558 . . . . 0.0 112.629 176.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 131' ' ' ASN . . . . . 0.53 ' HB2' ' HB3' ' A' ' 77' ' ' ASP . 1.7 p-10 -109.3 98.4 7.82 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.147 0.499 . . . . 0.0 110.975 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.713 ' HB3' HG21 ' A' ' 114' ' ' VAL . 3.0 p-10 -171.24 39.57 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.158 -171.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 133' ' ' THR . . . . . 0.407 HG22 ' OD2' ' A' ' 77' ' ' ASP . 12.3 t -66.56 -11.13 51.52 Favored 'General case' 0 CA--C 1.56 1.342 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 -170.141 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 14.0 p80 -134.21 34.05 3.32 Favored 'General case' 0 C--O 1.266 1.925 0 CA-C-O 121.76 0.791 . . . . 0.0 112.005 176.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.466 ' OE1' ' HG2' ' B' ' 136' ' ' GLN . 0.2 OUTLIER -65.44 -33.52 76.13 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.855 179.334 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 136' ' ' GLN . . . . . 0.566 ' O ' ' HG2' ' B' ' 140' ' ' LYS . 15.2 mm100 -57.8 -34.17 69.35 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.799 177.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 64.1 mt -66.24 -42.68 88.28 Favored 'General case' 0 C--O 1.242 0.689 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 138' ' ' LEU . . . . . 0.467 HD22 ' HB2' ' A' ' 38' ' ' LEU . 6.8 mp -69.54 -30.94 68.88 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 120.352 -0.539 . . . . 0.0 111.75 175.801 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -69.85 -28.19 65.47 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 176.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 140' ' ' LYS . . . . . 0.566 ' HG2' ' O ' ' B' ' 136' ' ' GLN . 3.9 mmmp? -61.63 -42.34 98.76 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 174.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 2.6 p -71.89 -41.17 68.28 Favored 'General case' 0 N--CA 1.426 -1.641 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.904 176.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.578 ' HG3' ' CZ2' ' B' ' 153' ' ' TRP . 39.4 tt0 -61.39 -58.02 9.91 Favored 'General case' 0 C--O 1.211 -0.931 0 O-C-N 123.244 0.34 . . . . 0.0 111.839 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 143' ' ' ALA . . . . . 0.423 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -56.34 -39.21 72.47 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 123.477 0.485 . . . . 0.0 111.435 -176.239 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 144' ' ' GLN . . . . . 0.415 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 52.0 tt0 -70.21 -45.25 66.96 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.179 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -69.48 -28.18 65.85 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.492 -178.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 146' ' ' LYS . . . . . 0.508 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 92.8 mttt -58.9 -44.31 91.18 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 174.338 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 147' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 74.7 mmtt -71.8 -35.27 69.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.898 -178.698 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 148' ' ' GLU . . . . . 0.445 ' HB2' ' HG ' ' B' ' 150' ' ' LEU . 20.4 mm-40 -66.61 -29.84 69.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.822 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 149' ' ' LYS . . . . . 0.438 ' O ' ' HB2' ' B' ' 154' ' ' SER . 46.5 mtpt 59.75 57.42 3.18 Favored 'General case' 0 CA--C 1.505 -0.757 0 C-N-CA 124.737 1.215 . . . . 0.0 109.03 -174.442 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 150' ' ' LEU . . . . . 0.445 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 87.9 mt -87.85 117.67 26.86 Favored 'General case' 0 CA--C 1.489 -1.392 0 CA-C-N 114.291 -1.322 . . . . 0.0 110.659 -178.593 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 151' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 88.3 m-20 52.52 -89.46 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.903 0 O-C-N 124.673 1.233 . . . . 0.0 114.127 172.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 13.0 tt -72.98 -25.8 22.38 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.222 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -178.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 153' ' ' TRP . . . . . 0.578 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 55.2 m95 -79.39 -7.94 58.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.892 0.853 . . . . 0.0 109.459 178.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 154' ' ' SER . . . . . 0.438 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 35.2 t -103.79 26.73 8.25 Favored 'General case' 0 N--CA 1.419 -1.988 0 CA-C-N 114.457 -1.247 . . . . 0.0 108.426 174.535 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -62.23 -34.11 75.87 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 174.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 5.6 t70 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 127.71 2.404 . . . . 0.0 114.17 170.756 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.265 0 CA-C-O 121.017 0.437 . . . . 0.0 109.993 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 89.1 m -155.16 -64.88 0.12 Allowed 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 178.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.4 p -154.08 -75.85 0.11 Allowed 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 39.6 m -154.42 67.32 0.71 Allowed 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 106.552 -1.647 . . . . 0.0 106.552 171.689 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -142.44 90.2 2.21 Favored 'General case' 0 CA--C 1.497 -1.068 0 CA-C-N 114.416 -1.266 . . . . 0.0 110.265 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -85.3 173.11 10.59 Favored 'General case' 0 N--CA 1.422 -1.838 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 173.425 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.537 ' HB2' ' CG ' ' A' ' 75' ' ' GLU . 3.0 mm? -91.53 166.18 12.97 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -95.19 114.54 26.34 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 120.389 -0.524 . . . . 0.0 109.871 -178.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.415 ' HB3' ' HB2' ' A' ' 75' ' ' GLU . 21.3 pttp -111.48 153.58 25.96 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 115.26 -0.882 . . . . 0.0 108.869 177.634 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -138.68 162.18 54.4 Favored Pre-proline 0 C--N 1.278 -2.51 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 176.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.568 ' HA ' ' O ' ' A' ' 72' ' ' ILE . 19.5 Cg_exo -74.51 155.77 45.32 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 122.294 1.996 . . . . 0.0 111.629 178.028 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -138.83 166.64 23.91 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.477 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 30.6 m -104.32 139.79 38.81 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 177.81 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.4 tp -88.69 133.52 34.19 Favored 'General case' 0 C--N 1.306 -1.301 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.234 -177.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 66.6 mt -92.55 -59.22 3.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.549 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 175.094 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -174.49 161.6 3.34 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.949 -1.023 . . . . 0.0 108.562 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.466 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -97.75 151.23 20.38 Favored 'General case' 0 C--N 1.29 -2.004 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 174.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.0 mm -112.89 -56.56 4.21 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -135.3 -160.59 1.07 Allowed 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 -176.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -76.45 -38.04 34.27 Favored Glycine 0 C--N 1.303 -1.298 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.134 -179.366 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.509 ' OD2' HG22 ' A' ' 41' ' ' THR . 4.0 p30 -106.42 -12.33 15.68 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 120.788 0.327 . . . . 0.0 111.603 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.43 111.87 24.63 Favored 'General case' 0 N--CA 1.425 -1.676 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.521 -174.674 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.9 m -136.91 147.43 27.18 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 C-N-CA 122.66 0.384 . . . . 0.0 110.48 -177.316 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -103.14 118.39 36.68 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 121.426 0.631 . . . . 0.0 111.188 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.9 mp -127.44 156.29 42.32 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.949 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.477 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 26.2 ttt -118.01 98.92 6.57 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 178.447 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.406 ' CD1' ' HZ ' ' A' ' 34' ' ' PHE . 7.6 p90 -98.67 111.76 24.03 Favored 'General case' 0 C--N 1.308 -1.204 0 C-N-CA 119.896 -0.722 . . . . 0.0 111.159 -174.518 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 37.4 mtpt 57.96 37.75 26.78 Favored 'General case' 0 C--O 1.245 0.862 0 CA-C-N 114.106 -1.406 . . . . 0.0 109.871 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 90.83 6.63 67.18 Favored Glycine 0 N--CA 1.436 -1.36 0 CA-C-N 114.001 -1.454 . . . . 0.0 113.703 177.192 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -112.59 106.17 55.7 Favored Pre-proline 0 C--N 1.311 -1.077 0 O-C-N 122.112 -0.64 . . . . 0.0 110.772 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -77.38 124.86 7.35 Favored 'Trans proline' 0 CA--C 1.534 0.504 0 C-N-CA 123.243 2.629 . . . . 0.0 112.648 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 53.7 mtt -145.57 156.54 43.75 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 122.948 0.499 . . . . 0.0 110.734 176.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.6 m -89.53 117.5 28.48 Favored 'General case' 0 N--CA 1.422 -1.866 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 172.307 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.406 ' HZ ' ' CD1' ' A' ' 27' ' ' TYR . 39.2 m-85 -95.96 145.64 25.26 Favored 'General case' 0 C--N 1.281 -2.379 0 CA-C-O 121.645 0.736 . . . . 0.0 112.488 -175.722 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.451 HH11 ' HD2' ' A' ' 35' ' ' ARG . 3.1 tpp85 -115.13 125.11 53.08 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 170.206 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.449 ' HA ' ' O ' ' A' ' 90' ' ' ALA . 71.3 mt -71.98 119.2 15.83 Favored 'General case' 0 C--N 1.288 -2.078 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.192 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.489 HD21 ' HB3' ' A' ' 89' ' ' LEU . 74.1 mt -60.42 139.57 57.63 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.756 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.522 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 88.2 mt 74.0 -0.38 3.37 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.924 1.29 . . . . 0.0 112.684 -178.705 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.5 t -115.21 133.8 60.32 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -179.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.448 ' HB2' ' HB2' ' A' ' 112' ' ' ALA . 16.4 t70 -142.28 108.39 5.22 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 175.385 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.509 HG22 ' OD2' ' A' ' 21' ' ' ASP . 14.1 t -112.63 4.27 0.09 OUTLIER Pre-proline 0 CA--C 1.6 2.868 0 N-CA-C 115.009 1.485 . . . . 0.0 115.009 -178.029 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.469 ' HD3' ' N ' ' A' ' 41' ' ' THR . 48.5 Cg_endo -106.55 13.56 0.16 Allowed 'Trans proline' 0 C--N 1.384 2.437 0 CA-C-N 123.52 2.293 . . . . 0.0 113.409 177.172 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -125.39 122.45 36.81 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 119.866 -0.733 . . . . 0.0 111.841 -174.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.415 ' OG1' HG22 ' A' ' 51' ' ' VAL . 26.4 m -161.23 135.07 6.78 Favored 'General case' 0 C--N 1.31 -1.132 0 N-CA-C 105.886 -1.894 . . . . 0.0 105.886 174.058 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -87.12 -38.08 16.79 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -175.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.443 ' HB3' ' HD3' ' A' ' 47' ' ' PRO 0.269 26.9 t-80 -62.26 -60.93 8.68 Favored Pre-proline 0 CA--C 1.56 1.335 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -173.91 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.443 ' HD3' ' HB3' ' A' ' 46' ' ' HIS . 16.9 Cg_exo -69.86 138.34 37.26 Favored 'Trans proline' 0 C--N 1.357 1.014 0 CA-C-N 121.412 1.54 . . . . 0.0 110.217 173.6 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -64.22 -23.42 67.3 Favored 'General case' 0 C--N 1.308 -1.234 0 C-N-CA 123.94 0.896 . . . . 0.0 113.023 -173.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.489 ' HB2' ' HB2' ' A' ' 52' ' ' GLU . 30.1 mmmt -97.85 4.74 49.62 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 120.912 0.387 . . . . 0.0 110.386 -178.596 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 90.44 -112.47 4.08 Favored Glycine 0 N--CA 1.433 -1.549 0 N-CA-C 108.602 -1.799 . . . . 0.0 108.602 -174.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.415 HG22 ' OG1' ' A' ' 44' ' ' THR . 21.6 t -95.24 77.08 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 177.19 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.489 ' HB2' ' HB2' ' A' ' 49' ' ' LYS . 44.2 tt0 -75.28 -57.28 3.99 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.918 -176.46 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.3 mtpp -69.23 -35.53 76.25 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 113.758 1.022 . . . . 0.0 113.758 -170.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -117.48 9.57 13.28 Favored 'General case' 0 C--N 1.311 -1.083 0 C-N-CA 120.327 -0.549 . . . . 0.0 112.243 -172.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -63.78 -56.31 19.72 Favored Glycine 0 CA--C 1.526 0.732 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.566 179.206 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -52.26 -36.57 68.24 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.805 2.336 . . . . 0.0 112.506 176.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -61.48 -50.54 72.32 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.84 -50.96 66.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.71 -177.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.5 m -59.89 -38.79 83.23 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 120.919 0.39 . . . . 0.0 111.463 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.42 -36.18 76.45 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.113 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -61.92 -50.03 73.81 Favored 'General case' 0 C--O 1.241 0.605 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.46 ' O ' HG22 ' A' ' 66' ' ' VAL . 27.9 m -57.49 -49.72 75.37 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 123.972 0.795 . . . . 0.0 110.03 177.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.466 ' HG2' ' HB3' ' A' ' 17' ' ' ALA . 25.1 mtpp -54.98 -52.99 61.37 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 178.659 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -59.23 -40.18 85.08 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 120.676 0.274 . . . . 0.0 111.601 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.6 mmt -72.45 -50.96 22.4 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 62' ' ' THR . 22.2 m -77.08 -28.89 16.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -174.289 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -77.86 -35.51 50.92 Favored 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 119.848 -0.741 . . . . 0.0 111.28 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -79.26 -14.7 58.87 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 121.267 0.556 . . . . 0.0 110.737 177.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.59 133.82 56.45 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.112 -178.028 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -80.25 -62.93 1.53 Allowed 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 176.049 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -106.42 118.86 37.76 Favored 'General case' 0 N--CA 1.425 -1.724 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.568 ' O ' ' HA ' ' A' ' 11' ' ' PRO . 64.9 mt -99.62 118.72 46.64 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.497 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 178.371 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.503 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 3.5 mm-40 -111.24 133.64 53.43 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -175.55 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.6 m -110.92 118.5 57.45 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.725 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 174.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.537 ' CG ' ' HB2' ' A' ' 7' ' ' LEU . 34.2 tt0 -107.76 121.24 44.31 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 120.638 0.256 . . . . 0.0 110.408 -177.203 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -98.59 129.7 45.12 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 -177.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.474 ' OD2' HD13 ' A' ' 37' ' ' LEU . 2.2 p30 -94.8 -173.86 3.11 Favored 'General case' 0 N--CA 1.426 -1.631 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -176.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.404 ' HB2' ' ND2' ' B' ' 131' ' ' ASN . 75.6 mmtt -75.76 -8.02 55.84 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.573 0.749 . . . . 0.0 112.288 -174.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -79.88 -70.88 1.3 Allowed Glycine 0 N--CA 1.428 -1.885 0 N-CA-C 111.696 -0.562 . . . . 0.0 111.696 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -145.61 150.57 36.6 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 -176.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -102.36 -39.07 7.34 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 122.033 0.921 . . . . 0.0 109.048 176.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 15.2 p -143.55 142.63 31.18 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.407 -178.075 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.505 ' HB3' ' HB3' ' A' ' 87' ' ' ARG . 11.5 t70 -76.87 141.42 40.61 Favored 'General case' 0 C--N 1.284 -2.257 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.737 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -51.26 -36.99 44.69 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 124.319 1.047 . . . . 0.0 112.605 -177.472 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -89.4 10.46 22.48 Favored 'General case' 0 CA--C 1.559 1.294 0 CA-C-O 121.598 0.713 . . . . 0.0 111.209 -171.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 94.93 41.5 4.05 Favored Glycine 0 CA--C 1.507 -0.41 0 C-N-CA 120.568 -0.825 . . . . 0.0 114.206 172.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.505 ' HB3' ' HB3' ' A' ' 83' ' ' ASP . 48.4 ttp180 -125.88 138.84 53.82 Favored 'General case' 0 C--N 1.292 -1.893 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 177.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -82.17 143.66 23.12 Favored Glycine 0 C--N 1.305 -1.191 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.489 ' HB3' HD21 ' A' ' 37' ' ' LEU . 91.5 mt -127.36 108.46 10.86 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -179.127 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.449 ' O ' ' HA ' ' A' ' 36' ' ' LEU . . . -156.63 166.19 34.11 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.851 -177.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -91.61 142.38 27.69 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 170.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 14.0 tt -113.3 135.7 51.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.453 0 C-N-CA 118.316 -1.354 . . . . 0.0 111.559 -178.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.503 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 8.5 m-85 -116.46 139.03 50.9 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.675 176.735 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -109.0 100.17 9.4 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.7 t70 46.35 57.88 5.0 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 124.725 1.21 . . . . 0.0 111.431 -177.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.63 -23.55 12.68 Favored Glycine 0 CA--C 1.52 0.393 0 CA-C-N 114.846 -1.07 . . . . 0.0 114.02 177.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.2 mtmm -90.57 119.39 30.78 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -177.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' MET . . . . . 0.45 ' HA ' ' HA ' ' A' ' 93' ' ' TYR . 41.7 ttp -83.98 103.68 13.43 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 121.951 0.881 . . . . 0.0 112.991 -175.108 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 43.7 t -67.02 -29.18 45.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.653 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.443 HD22 ' HB3' ' A' ' 36' ' ' LEU . 24.1 t-20 -53.54 -52.17 60.54 Favored 'General case' 0 C--O 1.258 1.517 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.106 -178.645 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.664 ' O ' ' HG2' ' A' ' 105' ' ' ARG . 6.9 pt-20 -77.31 -30.29 54.06 Favored 'General case' 0 N--CA 1.412 -2.365 0 C-N-CA 118.216 -1.394 . . . . 0.0 110.123 -179.344 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -56.83 -38.98 73.4 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 122.779 0.432 . . . . 0.0 110.904 -179.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 99.1 mt -60.84 -46.7 89.52 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.172 175.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.404 HG21 HD23 ' B' ' 138' ' ' LEU . 66.1 t -70.15 -37.35 71.51 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.186 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.492 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.664 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 33.9 mmm-85 -58.22 -41.62 84.46 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.23 0.612 . . . . 0.0 110.481 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -83.49 -4.68 58.74 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.719 -177.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.88 33.89 80.96 Favored Glycine 0 N--CA 1.439 -1.152 0 C-N-CA 120.156 -1.021 . . . . 0.0 111.092 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.3 mt -91.05 -6.24 54.11 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 122.16 0.981 . . . . 0.0 108.667 178.162 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -152.13 165.69 34.0 Favored 'General case' 0 N--CA 1.405 -2.701 0 CA-C-N 114.295 -1.321 . . . . 0.0 107.775 -179.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -103.82 152.09 22.31 Favored 'General case' 0 N--CA 1.409 -2.5 0 N-CA-C 105.136 -2.172 . . . . 0.0 105.136 176.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.7 p -77.28 128.99 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 118.384 -1.326 . . . . 0.0 109.601 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.522 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . -91.44 120.26 32.13 Favored 'General case' 0 C--N 1.293 -1.882 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 173.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 28.3 p90 -89.18 146.76 24.57 Favored 'General case' 0 C--N 1.29 -2.009 0 C-N-CA 119.892 -0.723 . . . . 0.0 109.388 -178.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 41.0 t -89.0 152.87 3.27 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 N-CA-C 106.827 -1.546 . . . . 0.0 106.827 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.452 ' O ' ' HB2' ' A' ' 116' ' ' LYS . 81.8 m-85 -96.92 -54.35 3.22 Favored 'General case' 0 C--N 1.291 -1.944 0 C-N-CA 120.257 -0.577 . . . . 0.0 112.514 -178.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 115' ' ' TYR . 50.2 mmtt 74.8 125.52 0.03 OUTLIER Pre-proline 0 C--O 1.24 0.588 0 O-C-N 124.359 1.037 . . . . 0.0 109.557 -165.038 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.404 ' HD2' ' HD3' ' A' ' 116' ' ' LYS . 5.9 Cg_endo -46.07 -25.61 3.03 Favored 'Trans proline' 0 N--CA 1.488 1.19 0 C-N-CA 124.984 3.789 . . . . 0.0 117.24 -169.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ASN . . . . . 0.543 ' HA ' ' OXT' ' A' ' 121' ' ' HIS . 2.9 t-20 -140.02 32.62 1.96 Allowed 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.469 0.652 . . . . 0.0 110.69 -177.1 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -61.13 -60.44 3.76 Favored 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 121.499 0.666 . . . . 0.0 110.383 176.453 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 14.6 t -140.42 19.69 2.39 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 175.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' HIS . . . . . 0.543 ' OXT' ' HA ' ' A' ' 118' ' ' ASN . 46.1 t-80 . . . . . 0 N--CA 1.428 -1.564 0 CA-C-N 113.525 -1.671 . . . . 0.0 108.014 -177.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.698 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 18.1 m 64.54 19.75 11.92 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.216 1.006 . . . . 0.0 113.067 175.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 7.1 p -80.4 -35.01 15.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-O 121.539 0.685 . . . . 0.0 109.311 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -132.96 66.43 1.56 Allowed 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 177.244 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -107.65 -45.0 4.13 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.47 178.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 58.4 t -75.01 102.86 2.52 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 -178.059 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -92.53 86.57 5.66 Favored 'General case' 0 N--CA 1.421 -1.888 0 CA-C-O 121.926 0.869 . . . . 0.0 109.758 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -102.12 -177.11 0.51 Allowed Pre-proline 0 C--N 1.292 -1.907 0 N-CA-C 105.61 -1.996 . . . . 0.0 105.61 177.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -55.1 164.48 3.54 Favored 'Trans proline' 0 CA--C 1.556 1.596 0 C-N-CA 121.508 1.472 . . . . 0.0 111.805 174.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 131' ' ' ASN . . . . . 0.404 ' ND2' ' HB2' ' A' ' 78' ' ' LYS . 1.5 t-20 -59.26 -56.94 15.71 Favored 'General case' 0 C--N 1.307 -1.269 0 O-C-N 122.119 -0.363 . . . . 0.0 110.044 176.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 17.3 m120 81.9 -22.59 0.25 Allowed 'General case' 0 N--CA 1.501 2.102 0 C-N-CA 126.002 1.721 . . . . 0.0 113.531 169.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 133' ' ' THR . . . . . 0.464 HG21 ' HB2' ' A' ' 77' ' ' ASP . 21.1 p -36.5 -74.23 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 125.389 1.476 . . . . 0.0 114.187 -169.16 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -116.06 2.39 13.41 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 170.232 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -62.37 -45.43 93.21 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 114.23 -1.35 . . . . 0.0 113.005 -168.294 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -60.05 -42.94 95.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.033 0.444 . . . . 0.0 110.082 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.85 -50.17 73.32 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.623 -177.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 138' ' ' LEU . . . . . 0.404 HD23 HG21 ' A' ' 104' ' ' VAL . 9.1 mp -68.86 -38.49 79.76 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 -179.042 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -61.77 -41.73 98.08 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.977 0.417 . . . . 0.0 109.948 176.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 140' ' ' LYS . . . . . 0.482 ' HA ' ' HE3' ' B' ' 140' ' ' LYS . 1.4 tpmt? -71.2 -37.77 72.09 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.704 -179.137 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.4 m -65.78 -37.17 85.6 Favored 'General case' 0 C--O 1.244 0.811 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.488 178.238 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.658 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 29.8 tt0 -65.52 -41.86 92.65 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.445 175.558 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -54.24 -46.01 72.47 Favored 'General case' 0 CA--C 1.518 -0.281 0 O-C-N 123.555 0.534 . . . . 0.0 110.399 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 144' ' ' GLN . . . . . 0.475 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 2.6 mp0 -64.78 -46.19 83.14 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.172 175.236 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -58.31 -36.22 73.02 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 123.038 0.535 . . . . 0.0 112.369 -179.222 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 146' ' ' LYS . . . . . 0.658 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 50.8 mttm -59.76 -47.67 84.73 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 176.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -65.32 -41.91 93.5 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.636 -178.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 148' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 20.8 mm-40 -71.89 -18.27 62.05 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.914 -178.505 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 149' ' ' LYS . . . . . 0.581 ' O ' ' HB2' ' B' ' 154' ' ' SER . 29.6 mtpp 56.77 65.57 1.37 Allowed 'General case' 0 N--CA 1.437 -1.079 0 C-N-CA 124.098 0.959 . . . . 0.0 110.698 -176.313 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 94.4 mt -99.76 126.81 45.89 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.146 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 46.67 -93.96 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 125.549 1.54 . . . . 0.0 114.563 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 65.1 mt -63.88 -31.33 52.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 CA-C-O 121.586 0.708 . . . . 0.0 110.708 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 153' ' ' TRP . . . . . 0.443 ' CG ' ' HA ' ' B' ' 146' ' ' LYS . 49.1 m95 -83.98 -3.68 58.17 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.778 0.799 . . . . 0.0 110.247 -179.032 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 154' ' ' SER . . . . . 0.581 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 11.8 t -115.0 28.75 8.5 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 177.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -75.06 -25.48 58.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.043 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 9.8 t70 . . . . . 0 C--N 1.298 -1.656 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 -176.836 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.773 0 CA-C-O 120.54 0.21 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 90.3 m 63.83 -81.42 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.806 0.842 . . . . 0.0 109.861 -173.543 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.452 ' C ' ' H ' ' A' ' 5' ' ' LYS . 16.4 m -145.39 -4.58 0.69 Allowed 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 178.281 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 87.2 m 68.69 -41.76 0.47 Allowed 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 124.343 1.057 . . . . 0.0 111.774 -173.166 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.452 ' H ' ' C ' ' A' ' 3' ' ' SER . 23.1 ttmt 81.75 105.79 0.06 Allowed 'General case' 0 CA--C 1.503 -0.84 0 C-N-CA 127.896 2.478 . . . . 0.0 111.001 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.679 ' HE2' ' O ' ' A' ' 7' ' ' LEU . 13.9 ptmt -89.5 174.14 7.95 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 106.965 -1.495 . . . . 0.0 106.965 172.001 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.679 ' O ' ' HE2' ' A' ' 6' ' ' LYS . 73.7 mt -67.71 147.62 52.4 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.384 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.2 m170 -91.47 118.37 30.51 Favored 'General case' 0 C--N 1.294 -1.843 0 C-N-CA 119.805 -0.758 . . . . 0.0 112.279 -172.315 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.494 ' HG2' ' HB2' ' A' ' 75' ' ' GLU . 46.4 mtmt -89.64 109.68 20.63 Favored 'General case' 0 N--CA 1.432 -1.362 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 170.413 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.476 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 7.2 pt-20 -112.73 138.24 22.02 Favored Pre-proline 0 C--N 1.273 -2.759 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.651 178.476 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 17.3 Cg_exo -67.37 136.65 40.73 Favored 'Trans proline' 0 C--O 1.24 0.605 0 C-N-CA 122.575 2.183 . . . . 0.0 113.199 -176.346 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -128.31 159.46 35.21 Favored 'General case' 0 N--CA 1.425 -1.676 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.753 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.415 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 72.9 m -110.93 128.7 55.91 Favored 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 177.722 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 57.4 tp -69.38 128.13 35.49 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 120.631 0.253 . . . . 0.0 110.638 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.4 mm -95.05 -55.1 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 173.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -171.54 137.91 1.1 Allowed 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.437 179.097 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.513 ' HA ' HG13 ' A' ' 23' ' ' VAL . . . -86.67 105.75 17.13 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 175.56 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.4 mm -74.41 -49.16 32.85 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.594 -175.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.479 ' HB3' ' H ' ' A' ' 22' ' ' THR . 5.3 t70 -142.91 -163.71 1.69 Allowed 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 106.851 -1.537 . . . . 0.0 106.851 -173.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -110.8 44.69 1.45 Allowed Glycine 0 C--N 1.293 -1.818 0 N-CA-C 107.555 -2.218 . . . . 0.0 107.555 176.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -167.21 -52.23 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 113.144 -1.528 . . . . 0.0 107.905 -170.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.479 ' H ' ' HB3' ' A' ' 19' ' ' ASP . 31.1 m -105.88 122.34 45.91 Favored 'General case' 0 N--CA 1.428 -1.567 0 CA-C-N 114.281 -1.327 . . . . 0.0 108.931 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.513 HG13 ' HA ' ' A' ' 17' ' ' ALA . 22.9 t -133.89 145.08 33.9 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.678 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 -178.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -107.19 125.21 50.81 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 119.589 1.086 . . . . 0.0 109.804 -179.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.431 ' O ' ' HA ' ' A' ' 31' ' ' PRO . 4.7 mp -136.12 158.41 44.47 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-O 121.076 0.465 . . . . 0.0 110.74 -178.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.416 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 59.4 ttp -110.31 106.05 15.29 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 11.1 p90 -111.94 121.33 44.73 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 178.123 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp 58.29 27.71 15.63 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 123.627 0.771 . . . . 0.0 111.002 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.439 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 94.1 3.25 63.75 Favored Glycine 0 N--CA 1.444 -0.772 0 CA-C-N 115.796 -0.638 . . . . 0.0 113.167 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.416 ' O ' ' HA ' ' A' ' 26' ' ' MET . 14.1 mm100 -103.67 101.39 23.93 Favored Pre-proline 0 C--N 1.313 -1.007 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 179.268 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.439 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 2.0 Cg_endo -81.85 85.08 1.76 Allowed 'Trans proline' 0 N--CA 1.448 -1.196 0 C-N-CA 122.532 2.155 . . . . 0.0 109.783 175.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 29.5 mmt -100.29 156.27 17.32 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.757 -175.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.401 ' O ' ' HB3' ' A' ' 87' ' ' ARG . 9.1 m -84.27 113.23 20.97 Favored 'General case' 0 N--CA 1.409 -2.493 0 N-CA-C 105.916 -1.883 . . . . 0.0 105.916 174.549 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -95.61 148.16 22.81 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-O 121.78 0.8 . . . . 0.0 111.842 -176.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.2 tpp85 -122.2 129.77 52.57 Favored 'General case' 0 C--N 1.278 -2.541 0 N-CA-C 105.758 -1.941 . . . . 0.0 105.758 173.713 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.422 ' HB3' HD22 ' A' ' 100' ' ' ASN . 86.0 mt -72.37 119.2 16.24 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 175.428 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.435 HD21 ' HB3' ' A' ' 89' ' ' LEU . 17.9 mt -55.89 129.03 37.93 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 -177.629 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 11.1 mt 69.77 33.45 2.92 Favored 'General case' 0 C--N 1.356 0.873 0 O-C-N 124.787 1.304 . . . . 0.0 112.424 164.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.417 HG13 ' HB1' ' A' ' 109' ' ' ALA . 69.2 t -110.56 128.93 66.52 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.185 0 CA-C-N 114.678 -1.146 . . . . 0.0 108.09 178.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.45 ' HB2' ' HB2' ' A' ' 112' ' ' ALA . 16.8 t70 -103.84 108.27 19.51 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -179.581 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.456 ' OG1' ' HD3' ' A' ' 42' ' ' PRO . 36.7 p -120.31 -43.25 0.04 OUTLIER Pre-proline 0 CA--C 1.561 1.385 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 176.499 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.456 ' HD3' ' OG1' ' A' ' 41' ' ' THR . 23.7 Cg_exo -67.26 95.43 0.38 Allowed 'Trans proline' 0 C--N 1.398 3.14 0 C-N-CA 121.672 1.582 . . . . 0.0 111.666 179.604 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -128.42 143.88 51.06 Favored 'General case' 0 N--CA 1.409 -2.483 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.113 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.3 p -104.93 94.7 5.4 Favored 'General case' 0 N--CA 1.415 -2.203 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 170.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.467 ' O ' ' HB2' ' A' ' 46' ' ' HIS . 19.6 ttmm -90.52 -54.48 3.98 Favored 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 120.389 -0.525 . . . . 0.0 109.796 -171.316 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.467 ' HB2' ' O ' ' A' ' 45' ' ' LYS . 36.3 t-80 159.95 -55.4 0.0 OUTLIER Pre-proline 0 N--CA 1.486 1.331 0 C-N-CA 125.517 1.527 . . . . 0.0 110.49 178.63 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.43 ' HD3' ' HB3' ' A' ' 46' ' ' HIS . 1.5 Cg_endo -82.13 94.79 0.89 Allowed 'Trans proline' 0 C--N 1.38 2.223 0 C-N-CA 121.63 1.553 . . . . 0.0 110.701 -178.802 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.554 ' HA ' ' HG2' ' A' ' 52' ' ' GLU . 58.3 mtmt -70.25 -26.66 63.93 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.159 -0.928 . . . . 0.0 113.479 -174.577 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.402 ' HD3' ' HA ' ' A' ' 49' ' ' LYS . 74.2 mmtt -99.5 3.83 45.77 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 122.094 0.95 . . . . 0.0 109.571 175.325 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -88.68 -2.14 79.37 Favored Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 108.404 -1.878 . . . . 0.0 108.404 171.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.588 HG12 ' H ' ' A' ' 54' ' ' TYR . 57.9 t 73.34 89.64 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.212 0 C-N-CA 126.329 1.852 . . . . 0.0 111.242 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.554 ' HG2' ' HA ' ' A' ' 48' ' ' LYS . 4.8 mm-40 -61.75 -45.64 93.05 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.626 1.571 . . . . 0.0 111.378 -178.167 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.2 mmmm -76.63 -27.7 55.79 Favored 'General case' 0 CA--C 1.497 -1.062 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 -175.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.588 ' H ' HG12 ' A' ' 51' ' ' VAL . 77.5 m-85 63.06 14.08 7.32 Favored 'General case' 0 N--CA 1.484 1.227 0 O-C-N 124.043 0.839 . . . . 0.0 110.23 -170.749 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -50.84 -58.22 9.7 Favored Glycine 0 C--O 1.211 -1.302 0 CA-C-N 114.676 -1.147 . . . . 0.0 113.813 -178.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -51.07 -45.45 36.62 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 122.755 2.304 . . . . 0.0 112.406 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -63.75 -48.1 78.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.854 -179.13 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.33 -41.65 66.26 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.276 -177.445 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.3 p -63.23 -43.6 97.62 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -178.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.99 -41.05 95.76 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-O 120.937 0.398 . . . . 0.0 110.519 179.067 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -64.98 -50.92 64.47 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.458 177.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.539 ' O ' HG22 ' A' ' 66' ' ' VAL . 61.5 m -55.87 -46.97 78.13 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 123.9 0.75 . . . . 0.0 110.975 -179.085 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -56.54 -53.97 51.29 Favored 'General case' 0 C--O 1.214 -0.775 0 O-C-N 123.395 0.435 . . . . 0.0 111.608 178.529 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -64.2 -32.31 73.84 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 120.91 0.386 . . . . 0.0 111.52 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 11.4 tpt -67.74 -45.83 73.87 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.706 -178.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.539 HG22 ' O ' ' A' ' 62' ' ' THR . 28.8 m -89.61 -31.77 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 -175.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -75.96 -20.42 57.93 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.987 0.423 . . . . 0.0 111.552 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -90.38 -15.21 31.46 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.327 0.584 . . . . 0.0 110.504 175.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.437 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -77.58 149.16 34.87 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.747 -176.575 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -76.66 -65.62 0.91 Allowed 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.626 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.4 mtmm -109.52 135.43 50.53 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 -178.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 69.6 mt -104.74 119.93 54.44 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.091 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 175.295 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.452 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 32.9 mt-10 -113.32 136.56 52.62 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -177.261 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.47 HG12 HG12 ' A' ' 92' ' ' ILE . 33.1 m -110.41 126.15 67.68 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.873 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 176.011 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.494 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 40.8 tt0 -115.62 115.55 26.61 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -92.2 148.98 21.73 Favored 'General case' 0 C--N 1.287 -2.126 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.574 ' HA ' HD13 ' A' ' 7' ' ' LEU . 6.3 t70 -84.63 -178.78 6.98 Favored 'General case' 0 C--O 1.245 0.817 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 -176.494 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -8.07 54.94 Favored 'General case' 0 N--CA 1.44 -0.946 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 -172.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.406 ' CA ' ' HB3' ' A' ' 117' ' ' PRO . . . -93.32 -98.75 1.49 Allowed Glycine 0 N--CA 1.421 -2.364 0 C-N-CA 120.213 -0.994 . . . . 0.0 112.148 178.686 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.524 ' NE2' ' HA ' ' A' ' 117' ' ' PRO . 21.9 mp0 -98.71 127.11 44.53 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.295 0.569 . . . . 0.0 112.378 -176.5 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -89.2 -27.9 20.34 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 174.126 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.43 ' O ' ' HB3' ' A' ' 80' ' ' GLN . 11.0 p -120.92 148.09 44.55 Favored 'General case' 0 N--CA 1.422 -1.825 0 CA-C-N 114.618 -1.174 . . . . 0.0 109.952 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.498 ' CB ' ' HB2' ' A' ' 87' ' ' ARG . 9.9 t0 -84.37 151.95 24.38 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 106.803 -1.555 . . . . 0.0 106.803 178.053 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -62.38 -20.46 64.46 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 179.114 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -83.39 -3.68 57.77 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.893 0.378 . . . . 0.0 111.656 175.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 90.71 28.76 15.13 Favored Glycine 0 C--N 1.313 -0.722 0 C-N-CA 120.543 -0.837 . . . . 0.0 111.642 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.498 ' HB2' ' CB ' ' A' ' 83' ' ' ASP . 69.8 mtt180 -100.89 176.98 5.1 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 178.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -104.21 128.96 9.67 Favored Glycine 0 N--CA 1.431 -1.65 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 174.735 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.435 ' HB3' HD21 ' A' ' 37' ' ' LEU . 76.6 mt -110.01 108.35 18.55 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 117.154 0.477 . . . . 0.0 109.754 -179.493 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.11 167.33 30.76 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-O 121.654 0.74 . . . . 0.0 111.913 -178.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -96.94 127.48 42.95 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 104.332 -2.47 . . . . 0.0 104.332 170.43 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.47 HG12 HG12 ' A' ' 74' ' ' VAL . 55.3 mt -98.55 126.83 51.58 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.108 0 C-N-CA 117.684 -1.607 . . . . 0.0 111.578 -178.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.452 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 6.2 m-85 -105.77 127.1 52.89 Favored 'General case' 0 N--CA 1.428 -1.555 0 N-CA-C 107.478 -1.305 . . . . 0.0 107.478 176.497 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.437 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -104.34 99.93 9.64 Favored 'General case' 0 C--N 1.28 -2.451 0 N-CA-C 106.676 -1.601 . . . . 0.0 106.676 179.119 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 12.5 t70 45.39 57.73 4.67 Favored 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 125.797 1.639 . . . . 0.0 110.725 -172.063 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.87 -25.73 7.29 Favored Glycine 0 CA--C 1.526 0.722 0 CA-C-N 114.475 -1.239 . . . . 0.0 113.952 179.174 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -81.33 114.38 20.07 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -178.093 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 33.3 ttm -73.99 108.88 7.07 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 120.519 -0.472 . . . . 0.0 110.163 -176.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.0 t -66.12 -34.85 72.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 -178.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.422 HD22 ' HB3' ' A' ' 36' ' ' LEU . 26.8 t-20 -57.76 -50.59 72.72 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.938 178.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.437 ' HG3' ' OG ' ' B' ' 141' ' ' SER . 22.4 tt0 -65.86 -42.74 90.03 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.647 175.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.74 -44.11 77.26 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 122.92 0.488 . . . . 0.0 112.286 -178.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 90.0 mt -62.93 -44.09 97.01 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.844 0.354 . . . . 0.0 110.865 178.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.449 ' HA ' ' O ' ' A' ' 109' ' ' ALA . 58.6 t -70.43 -37.4 70.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.25 -179.086 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 10.3 tpp180 -67.16 -25.78 66.33 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.803 0.841 . . . . 0.0 110.2 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.457 ' O ' ' HB3' ' B' ' 150' ' ' LEU . 25.5 mm-40 -95.42 0.1 53.04 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.501 178.521 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.467 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 65.09 22.99 69.35 Favored Glycine 0 C--O 1.218 -0.848 0 C-N-CA 121.245 -0.502 . . . . 0.0 112.523 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 82.2 mt -81.67 -21.07 38.35 Favored 'General case' 0 CA--C 1.495 -1.139 0 CA-C-O 121.743 0.782 . . . . 0.0 108.981 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.449 ' O ' ' HA ' ' A' ' 104' ' ' VAL . . . -154.86 159.15 40.32 Favored 'General case' 0 N--CA 1.409 -2.524 0 N-CA-C 106.673 -1.603 . . . . 0.0 106.673 -179.343 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.411 ' HG3' ' HB3' ' A' ' 40' ' ' ASP . 15.4 pttp -121.23 157.86 29.36 Favored 'General case' 0 N--CA 1.416 -2.126 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.7 p -92.77 120.81 42.74 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 119.725 -0.79 . . . . 0.0 112.099 -172.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.45 ' HB2' ' HB2' ' A' ' 40' ' ' ASP . . . -119.0 119.25 33.73 Favored 'General case' 0 N--CA 1.436 -1.148 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.495 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.58 ' HB3' HD22 ' B' ' 132' ' ' ASN . 8.9 p90 -120.11 95.47 4.76 Favored 'General case' 0 N--CA 1.434 -1.228 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 78.0 t -141.5 105.18 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 169.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -174.03 126.11 0.36 Allowed 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.7 mppt? -106.66 144.9 29.96 Favored Pre-proline 0 C--N 1.31 -1.142 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 177.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.524 ' HA ' ' NE2' ' A' ' 80' ' ' GLN . 21.2 Cg_endo -81.68 -85.45 0.0 OUTLIER 'Trans proline' 0 N--CA 1.44 -1.644 0 C-N-CA 121.746 1.63 . . . . 0.0 112.741 177.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -130.22 -46.15 1.11 Allowed 'General case' 0 C--N 1.307 -1.253 0 N-CA-C 107.626 -1.249 . . . . 0.0 107.626 175.453 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -145.96 -75.82 0.21 Allowed 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.471 177.32 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 44.3 m -108.7 -40.48 5.06 Favored 'General case' 0 C--O 1.249 1.035 0 N-CA-C 105.425 -2.065 . . . . 0.0 105.425 171.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 4.6 p-80 . . . . . 0 N--CA 1.416 -2.132 0 N-CA-C 105.562 -2.014 . . . . 0.0 105.562 164.317 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -0.97 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 123' ' ' SER . . . . . 0.426 ' HA ' ' HB3' ' B' ' 126' ' ' TYR . 49.1 m -87.72 86.16 7.14 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-O 121.416 0.627 . . . . 0.0 111.033 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 56.6 t -109.7 -64.58 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 177.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -87.36 -26.01 23.56 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 175.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 126' ' ' TYR . . . . . 0.426 ' HB3' ' HA ' ' B' ' 123' ' ' SER . 62.1 t80 -75.43 98.71 3.97 Favored 'General case' 0 N--CA 1.427 -1.578 0 CA-C-N 114.364 -1.289 . . . . 0.0 108.325 176.57 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 16.6 m -109.15 26.64 2.32 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 CA-C-O 121.416 0.627 . . . . 0.0 110.695 -178.005 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -71.69 93.93 1.31 Allowed 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 114.943 -1.026 . . . . 0.0 111.856 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.458 ' HA ' ' HD3' ' B' ' 130' ' ' PRO . 20.6 pttp -135.56 122.15 14.43 Favored Pre-proline 0 C--N 1.274 -2.703 0 CA-C-N 113.901 -1.5 . . . . 0.0 107.073 167.704 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 130' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' B' ' 129' ' ' LYS . 1.4 Cg_endo -80.66 -148.85 0.04 OUTLIER 'Trans proline' 0 C--O 1.245 0.867 0 C-N-CA 123.088 2.525 . . . . 0.0 112.225 -173.187 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -80.07 94.65 6.0 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 171.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.58 HD22 ' HB3' ' A' ' 113' ' ' TYR . 40.8 t-20 173.65 76.54 0.0 OUTLIER 'General case' 0 CA--C 1.495 -1.138 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 -179.426 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 9.2 m -83.34 30.12 0.48 Allowed 'General case' 0 C--N 1.275 -2.669 0 CA-C-O 122.668 1.223 . . . . 0.0 108.569 177.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 134' ' ' HIS . . . . . 0.429 ' H ' ' C ' ' B' ' 132' ' ' ASN . 72.7 m80 -143.49 13.74 1.77 Allowed 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' B' ' 139' ' ' ARG . 12.3 pt-20 -51.7 -46.33 63.87 Favored 'General case' 0 C--N 1.358 0.946 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -171.399 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -66.37 -38.52 87.75 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 123.091 0.244 . . . . 0.0 111.236 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 79.4 mt -60.93 -48.43 81.86 Favored 'General case' 0 C--O 1.246 0.871 0 CA-C-O 121.913 0.863 . . . . 0.0 109.616 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 44.7 mt -69.69 -37.28 76.55 Favored 'General case' 0 N--CA 1.42 -1.93 0 N-CA-C 113.888 1.069 . . . . 0.0 113.888 -178.204 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 139' ' ' ARG . . . . . 0.554 ' HG2' ' O ' ' B' ' 135' ' ' GLU . 16.7 ptt-85 -70.7 -28.01 64.43 Favored 'General case' 0 N--CA 1.435 -1.205 0 C-N-CA 119.333 -0.947 . . . . 0.0 112.392 177.05 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -67.57 -41.24 84.46 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 173.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 141' ' ' SER . . . . . 0.437 ' OG ' ' HG3' ' A' ' 101' ' ' GLU . 43.3 m -59.11 -44.78 92.0 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.418 177.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.668 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 40.8 tt0 -66.13 -45.43 81.1 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 115.043 -0.981 . . . . 0.0 109.994 179.385 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -51.46 -47.3 63.16 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.894 0.877 . . . . 0.0 112.692 -178.313 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -64.55 -46.68 81.78 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 123.225 0.328 . . . . 0.0 111.024 177.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -61.07 -37.3 82.2 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.101 -178.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 146' ' ' LYS . . . . . 0.668 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 86.7 mttt -57.71 -48.85 78.42 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.136 0.493 . . . . 0.0 109.819 177.482 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -72.53 -37.15 68.39 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.439 -174.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -72.64 -12.21 60.95 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.603 178.04 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 149' ' ' LYS . . . . . 0.622 ' O ' ' HB2' ' B' ' 154' ' ' SER . 29.0 mmmt 59.74 53.33 4.94 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 -178.112 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 150' ' ' LEU . . . . . 0.457 ' HB3' ' O ' ' A' ' 106' ' ' GLN . 79.7 mt -92.17 121.42 33.68 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.09 -177.116 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 151' ' ' ASN . . . . . 0.467 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 45.9 m-80 50.46 -90.55 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.236 1.815 . . . . 0.0 113.704 176.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 152' ' ' ILE . . . . . 0.521 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 55.1 mt -63.48 -38.0 81.04 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.945 0 CA-C-O 121.407 0.622 . . . . 0.0 109.957 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 153' ' ' TRP . . . . . 0.468 ' CG ' ' HA ' ' B' ' 146' ' ' LYS . 60.5 m95 -79.77 -4.91 54.07 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-O 121.225 0.536 . . . . 0.0 111.574 -176.22 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 154' ' ' SER . . . . . 0.622 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 32.5 t -95.62 9.54 39.88 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.724 175.405 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 155' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 9.2 pt-20 -70.19 -30.56 67.7 Favored 'General case' 0 C--N 1.35 0.59 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 173.26 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 18.0 t70 . . . . . 0 N--CA 1.447 -0.614 0 C-N-CA 126.153 1.781 . . . . 0.0 110.267 178.936 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.497 -1.091 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 20.0 m -80.86 96.98 7.19 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.452 ' O ' ' HE2' ' A' ' 9' ' ' LYS . 16.9 m -95.45 125.93 40.39 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.355 -174.074 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.8 p -132.27 153.93 50.17 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 177.185 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -87.34 -39.06 15.66 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.684 0.754 . . . . 0.0 109.878 178.264 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 36.2 ttmt 166.72 -39.35 0.0 OUTLIER 'General case' 0 CA--C 1.49 -1.344 0 N-CA-C 102.661 -3.088 . . . . 0.0 102.661 -171.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 20.5 mt -78.22 167.83 20.78 Favored 'General case' 0 N--CA 1.418 -2.033 0 CA-C-N 110.952 -2.84 . . . . 0.0 106.98 176.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 -125.2 103.11 7.79 Favored 'General case' 0 C--N 1.3 -1.578 0 C-N-CA 120.297 -0.561 . . . . 0.0 111.165 -176.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.452 ' HE2' ' O ' ' A' ' 3' ' ' SER . 64.6 pttt -71.39 154.91 41.21 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.65 176.123 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -139.41 152.52 69.3 Favored Pre-proline 0 C--N 1.277 -2.558 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.529 176.142 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -77.02 140.36 20.05 Favored 'Trans proline' 0 N--CA 1.447 -1.209 0 C-N-CA 121.989 1.793 . . . . 0.0 111.268 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -119.57 166.79 12.69 Favored 'General case' 0 C--N 1.288 -2.079 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.482 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 11.7 m -105.01 134.43 48.13 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 178.637 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.467 ' HB2' HD12 ' A' ' 72' ' ' ILE . 64.5 tp -72.99 133.61 44.36 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 120.931 0.396 . . . . 0.0 110.793 -179.131 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 64.8 mt -106.01 -59.11 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.751 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 172.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.4 pttt -170.95 134.02 0.94 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.162 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -95.5 106.25 18.31 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 107.759 -1.201 . . . . 0.0 107.759 174.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 48.3 mm -71.3 -50.13 43.16 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-O 121.399 0.619 . . . . 0.0 109.528 -176.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.498 ' HA ' ' CB ' ' A' ' 59' ' ' SER . 7.5 t70 -139.89 -162.33 1.32 Allowed 'General case' 0 C--N 1.294 -1.83 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 -178.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -91.84 -7.59 64.35 Favored Glycine 0 C--N 1.302 -1.314 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 177.196 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.456 ' HB2' ' OG1' ' A' ' 41' ' ' THR . 13.8 t70 -95.18 -56.97 2.55 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 113.813 -1.193 . . . . 0.0 110.117 -179.145 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -111.46 130.12 55.81 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.014 -176.467 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.3 p -137.92 138.35 43.96 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 C-N-CA 124.461 1.105 . . . . 0.0 108.281 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.8 tttp -100.11 122.5 43.06 Favored 'General case' 0 C--N 1.293 -1.878 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 -175.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.0 mp -125.71 159.4 32.39 Favored 'General case' 0 CA--C 1.497 -1.066 0 CA-C-O 121.358 0.599 . . . . 0.0 110.477 -178.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.482 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 43.6 ttm -118.0 120.03 36.58 Favored 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 114.737 -1.119 . . . . 0.0 108.368 177.159 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.8 p90 -120.41 114.13 21.36 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.46 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 59.1 mttp 60.95 27.45 17.31 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.821 0.848 . . . . 0.0 111.856 -177.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.13 2.76 64.01 Favored Glycine 0 C--N 1.314 -0.669 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.684 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 26' ' ' MET . 42.5 mt-30 -97.97 109.27 50.78 Favored Pre-proline 0 C--N 1.313 -0.983 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 177.578 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 30' ' ' GLN . 14.0 Cg_endo -88.86 106.4 0.45 Allowed 'Trans proline' 0 N--CA 1.443 -1.46 0 C-N-CA 122.732 2.288 . . . . 0.0 111.949 179.261 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -119.81 145.45 46.61 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.037 178.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 10.6 m -85.47 104.5 15.31 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 175.696 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -95.19 142.77 27.23 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-O 121.481 0.658 . . . . 0.0 111.155 -174.338 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.41 ' HD3' ' OD1' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -113.12 132.85 55.28 Favored 'General case' 0 C--N 1.275 -2.635 0 N-CA-C 104.416 -2.438 . . . . 0.0 104.416 174.016 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.511 ' HB2' ' HB ' ' A' ' 39' ' ' VAL . 6.6 mp -66.57 130.33 42.82 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -175.334 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.2 mt -62.11 127.36 30.98 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.787 174.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.404 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 74.4 mt 75.18 8.22 4.02 Favored 'General case' 0 C--O 1.221 -0.429 0 O-C-N 124.751 1.282 . . . . 0.0 113.062 176.665 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.511 ' HB ' ' HB2' ' A' ' 36' ' ' LEU . 84.9 t -118.12 125.8 74.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -135.56 123.57 22.79 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 178.359 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.456 ' OG1' ' HB2' ' A' ' 21' ' ' ASP . 73.8 p -108.19 -44.18 0.11 Allowed Pre-proline 0 CA--C 1.569 1.701 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 178.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -87.08 89.75 0.6 Allowed 'Trans proline' 0 C--N 1.378 2.095 0 C-N-CA 121.405 1.403 . . . . 0.0 111.271 -178.269 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.49 171.75 10.3 Favored 'General case' 0 C--N 1.295 -1.776 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.271 178.417 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.7 t -156.85 83.19 0.95 Allowed 'General case' 0 N--CA 1.407 -2.591 0 CA-C-O 122.486 1.136 . . . . 0.0 109.9 170.584 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -74.71 -27.94 60.59 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 114.966 -1.015 . . . . 0.0 108.273 174.423 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 50.9 t-80 -169.83 -53.12 0.0 OUTLIER Pre-proline 0 C--N 1.309 -1.195 0 CA-C-N 114.321 -1.309 . . . . 0.0 109.921 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.54 149.32 82.83 Favored 'Trans proline' 0 C--N 1.384 2.439 0 C-N-CA 121.812 1.675 . . . . 0.0 111.714 176.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -83.24 -26.54 30.66 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 122.011 0.91 . . . . 0.0 109.067 -177.054 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -86.98 -10.58 52.85 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.784 -177.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.83 -107.81 2.32 Favored Glycine 0 N--CA 1.432 -1.604 0 N-CA-C 109.381 -1.488 . . . . 0.0 109.381 -175.079 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 23.6 t -107.58 95.46 3.82 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.648 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 176.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -46.94 -61.91 1.65 Allowed 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -170.142 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -84.92 -25.16 28.08 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -172.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -88.93 -23.78 22.61 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.983 -0.687 . . . . 0.0 112.316 -174.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -54.94 -51.27 54.69 Favored Glycine 0 CA--C 1.539 1.577 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.847 176.025 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -55.9 -22.99 40.39 Favored 'Trans proline' 0 C--N 1.37 1.675 0 C-N-CA 123.073 2.516 . . . . 0.0 114.237 176.219 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -86.3 -36.13 19.5 Favored 'General case' 0 C--O 1.209 -1.066 0 C-N-CA 120.113 -0.635 . . . . 0.0 109.817 178.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.35 -43.3 92.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.505 0.669 . . . . 0.0 110.16 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.498 ' CB ' ' HA ' ' A' ' 19' ' ' ASP . 8.8 p -68.05 -40.4 82.83 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.22 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.07 -46.63 64.55 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.13 -177.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -56.2 -44.78 79.77 Favored 'General case' 0 CA--C 1.507 -0.702 0 C-N-CA 123.795 0.838 . . . . 0.0 110.075 -179.575 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.442 ' O ' HG22 ' A' ' 66' ' ' VAL . 39.5 m -62.15 -45.17 94.61 Favored 'General case' 0 N--CA 1.439 -1.024 0 O-C-N 123.992 0.808 . . . . 0.0 110.591 179.091 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.533 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 49.1 mttp -58.0 -54.55 45.7 Favored 'General case' 0 C--O 1.212 -0.917 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 176.635 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -60.07 -33.86 72.65 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.509 -0.768 . . . . 0.0 112.046 -176.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.12 -51.44 21.39 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 179.741 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.442 HG22 ' O ' ' A' ' 62' ' ' THR . 32.8 m -71.5 -26.23 26.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -176.357 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.533 ' HG2' ' O ' ' A' ' 63' ' ' LYS . 79.9 mm-40 -71.9 -35.18 69.64 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.782 0.801 . . . . 0.0 109.191 174.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -73.59 -41.56 62.72 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.2 -178.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.13 146.64 54.05 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -177.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.8 mptt -78.09 -60.08 2.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.911 0.862 . . . . 0.0 108.714 179.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -107.06 128.08 54.05 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.521 -174.398 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.467 HD12 ' HB2' ' A' ' 14' ' ' LEU . 60.3 mt -100.56 124.11 53.91 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.345 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 170.382 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.568 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 21.5 mt-10 -112.34 133.38 54.47 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -173.465 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 28.9 m -111.97 129.51 67.3 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.187 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.969 179.431 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -128.93 142.58 50.89 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.121 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -110.13 116.29 31.28 Favored 'General case' 0 N--CA 1.423 -1.795 0 N-CA-C 110.552 -0.166 . . . . 0.0 110.552 177.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -102.29 -175.15 2.75 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 178.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.9 64.61 4.8 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 -172.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -128.27 -106.31 1.31 Allowed Glycine 0 C--N 1.292 -1.9 0 CA-C-N 114.779 -1.101 . . . . 0.0 110.477 174.156 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.44 ' HG2' ' HB2' ' A' ' 115' ' ' TYR . 14.5 mm100 -137.91 145.94 42.71 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 -99.3 -10.06 22.81 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 120.356 -0.538 . . . . 0.0 109.736 178.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.448 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 40.1 p -134.3 137.08 43.96 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-O 120.857 0.36 . . . . 0.0 110.528 177.051 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.507 ' HB3' ' HB2' ' A' ' 87' ' ' ARG . 24.5 t0 -94.8 127.43 40.8 Favored 'General case' 0 CA--C 1.493 -1.22 0 N-CA-C 104.697 -2.334 . . . . 0.0 104.697 172.865 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -74.9 62.35 1.1 Allowed 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 114.841 1.422 . . . . 0.0 114.841 -166.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -135.58 7.24 3.28 Favored 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 126.381 1.872 . . . . 0.0 107.236 173.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 86.33 28.86 26.45 Favored Glycine 0 N--CA 1.441 -1.027 0 N-CA-C 109.149 -1.58 . . . . 0.0 109.149 -171.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.507 ' HB2' ' HB3' ' A' ' 83' ' ' ASP . 98.4 mtt180 -110.34 177.66 4.63 Favored 'General case' 0 C--N 1.309 -1.169 0 C-N-CA 123.901 0.881 . . . . 0.0 110.311 -177.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.448 ' HA2' ' HA ' ' A' ' 82' ' ' THR . . . -119.01 162.5 13.47 Favored Glycine 0 N--CA 1.421 -2.351 0 N-CA-C 108.971 -1.652 . . . . 0.0 108.971 174.046 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 74.8 mt -134.16 129.51 35.93 Favored 'General case' 0 C--N 1.29 -1.993 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 176.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -153.16 157.66 40.64 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.078 0.466 . . . . 0.0 110.004 179.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -90.96 112.31 24.14 Favored 'General case' 0 C--N 1.294 -1.841 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 176.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 45.6 mm -98.81 126.56 51.97 Favored 'Isoleucine or valine' 0 C--O 1.257 1.451 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -170.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.568 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 4.4 m-85 -112.98 152.75 29.03 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 106.133 -1.803 . . . . 0.0 106.133 173.227 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -130.32 100.07 5.25 Favored 'General case' 0 C--N 1.28 -2.438 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 175.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.7 t70 45.63 58.02 4.57 Favored 'General case' 0 C--O 1.244 0.793 0 C-N-CA 125.017 1.327 . . . . 0.0 113.298 -179.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.86 -25.12 23.15 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.382 -0.913 . . . . 0.0 114.432 176.651 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -100.29 150.33 22.67 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 117.551 0.676 . . . . 0.0 109.304 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 58.6 mtm -97.13 119.87 36.43 Favored 'General case' 0 N--CA 1.414 -2.238 0 C-N-CA 120.336 -0.546 . . . . 0.0 111.429 178.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 38.4 t -63.38 -37.93 80.81 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.27 0 CA-C-N 114.621 -1.172 . . . . 0.0 108.404 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -59.24 -42.61 91.47 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 114.527 -1.215 . . . . 0.0 110.851 177.149 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -65.57 -56.09 14.17 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.034 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.85 -51.01 62.6 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.775 0.83 . . . . 0.0 112.636 -176.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 90.0 mt -58.15 -45.55 87.2 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 60.8 t -73.23 -36.81 50.66 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.04 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 30.0 mmt180 -65.97 -34.52 78.3 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 122.544 0.338 . . . . 0.0 111.541 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -87.14 2.16 50.73 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.645 178.271 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.04 33.19 86.51 Favored Glycine 0 C--O 1.226 -0.406 0 CA-C-N 116.34 -0.391 . . . . 0.0 112.995 177.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.3 mt -105.32 4.28 30.77 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 120.882 0.372 . . . . 0.0 110.559 -178.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -155.84 160.16 39.97 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.515 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -112.61 171.77 7.32 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 7.3 p -78.15 126.04 38.12 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.724 0 CA-C-O 121.476 0.655 . . . . 0.0 110.185 178.144 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -89.5 122.13 32.38 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.602 178.188 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.542 ' HB2' ' HG3' ' A' ' 116' ' ' LYS . 5.0 p90 -82.71 98.38 9.04 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.36 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 60.5 t -102.34 141.38 18.6 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.354 -174.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.514 ' O ' ' HB3' ' B' ' 130' ' ' PRO . 12.0 t80 59.1 54.81 4.71 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.224 1.41 . . . . 0.0 109.84 177.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' LYS . . . . . 0.542 ' HG3' ' HB2' ' A' ' 113' ' ' TYR . 71.5 mmtt -110.21 118.5 49.29 Favored Pre-proline 0 C--N 1.292 -1.912 0 CA-C-N 115.118 -0.946 . . . . 0.0 112.143 -172.637 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -89.07 20.14 1.16 Allowed 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.781 2.987 . . . . 0.0 110.707 178.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 66.35 62.95 0.55 Allowed 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 124.708 1.203 . . . . 0.0 109.565 -179.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 60.93 10.03 2.58 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 125.502 1.521 . . . . 0.0 112.06 179.532 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 13.7 m 65.4 29.7 11.27 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-O 122.954 1.359 . . . . 0.0 108.309 -175.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 64.3 t60 . . . . . 0 N--CA 1.425 -1.684 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 177.841 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.94 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 17.8 t -80.71 135.99 36.09 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 64.7 t -64.89 -39.51 85.92 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 CA-C-O 121.185 0.516 . . . . 0.0 110.231 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -116.74 106.17 13.21 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.405 179.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -78.03 96.58 5.13 Favored 'General case' 0 N--CA 1.422 -1.863 0 CA-C-O 121.899 0.857 . . . . 0.0 111.994 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 1.6 p -60.82 -33.92 57.2 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 113.565 -1.652 . . . . 0.0 111.531 179.187 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 33.2 t80 74.12 -15.21 0.62 Allowed 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 125.047 1.339 . . . . 0.0 113.394 171.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.445 ' HB3' ' HD3' ' B' ' 130' ' ' PRO . 41.2 ttmt -67.08 -48.27 49.72 Favored Pre-proline 0 CA--C 1.562 1.434 0 CA-C-O 119.294 -0.384 . . . . 0.0 111.829 174.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 130' ' ' PRO . . . . . 0.514 ' HB3' ' O ' ' A' ' 115' ' ' TYR . 25.1 Cg_exo -70.72 -172.73 0.71 Allowed 'Trans proline' 0 C--N 1.383 2.346 0 C-N-CA 122.183 1.922 . . . . 0.0 110.548 174.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -82.68 84.92 7.13 Favored 'General case' 0 N--CA 1.437 -1.104 0 C-N-CA 118.307 -1.357 . . . . 0.0 109.87 179.267 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.403 ' HA ' ' HB3' ' B' ' 135' ' ' GLU . 14.9 m120 -100.64 -19.36 16.13 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.957 176.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 6.9 p -50.93 -57.14 9.28 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 125.486 1.515 . . . . 0.0 113.446 -173.635 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 -99.1 -9.73 23.47 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.486 ' CG ' ' HE ' ' B' ' 139' ' ' ARG . 43.6 tt0 -62.28 -45.84 91.46 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.798 -177.823 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -57.86 -38.44 75.73 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.294 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 85.1 mt -67.02 -50.04 63.4 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.187 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.03 -26.51 65.91 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 139' ' ' ARG . . . . . 0.486 ' HE ' ' CG ' ' B' ' 135' ' ' GLU . 47.7 mtt180 -76.24 -22.25 55.4 Favored 'General case' 0 C--O 1.211 -0.971 0 C-N-CA 119.788 -0.765 . . . . 0.0 110.733 175.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -74.08 -32.0 63.06 Favored 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 172.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 13.6 m -65.85 -44.8 84.39 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.253 -0.885 . . . . 0.0 108.629 174.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.466 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 0.0 OUTLIER -64.99 -38.86 92.37 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.047 176.75 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -58.59 -39.79 81.36 Favored 'General case' 0 C--O 1.243 0.76 0 C-N-CA 122.7 0.4 . . . . 0.0 110.937 177.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 144' ' ' GLN . . . . . 0.445 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 53.8 tt0 -69.18 -48.56 61.86 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.836 179.022 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -64.25 -34.35 77.91 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.223 -175.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 146' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 80.7 mttt -58.32 -50.22 74.4 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.065 0.459 . . . . 0.0 111.124 174.35 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -70.46 -22.76 62.65 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.127 -177.259 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 148' ' ' GLU . . . . . 0.475 ' HB2' ' HG ' ' B' ' 150' ' ' LEU . 34.5 mm-40 -89.57 -7.71 54.25 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.31 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 149' ' ' LYS . . . . . 0.575 ' O ' ' HB2' ' B' ' 154' ' ' SER . 30.5 mmmt 52.08 52.51 14.23 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.543 1.137 . . . . 0.0 109.02 -177.024 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 150' ' ' LEU . . . . . 0.475 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 95.5 mt -88.36 113.38 23.9 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.23 -177.008 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 54.61 -89.26 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 125.841 1.656 . . . . 0.0 114.072 172.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 22.4 mt -65.01 -36.66 78.35 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.128 0 CA-C-O 121.049 0.452 . . . . 0.0 110.444 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 64.5 m95 -77.59 -9.25 58.84 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-O 121.523 0.678 . . . . 0.0 111.286 -177.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 154' ' ' SER . . . . . 0.575 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 32.9 t -92.66 10.59 29.95 Favored 'General case' 0 N--CA 1.428 -1.575 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.574 175.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 155' ' ' GLU . . . . . 0.413 ' HG3' ' N ' ' B' ' 156' ' ' ASP . 6.6 pt-20 -55.14 -37.7 67.29 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 121.24 0.543 . . . . 0.0 110.418 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 156' ' ' ASP . . . . . 0.413 ' N ' ' HG3' ' B' ' 155' ' ' GLU . 29.4 t70 . . . . . 0 N--CA 1.423 -1.805 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -177.048 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.508 -0.651 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.8 p -81.05 82.81 6.9 Favored 'General case' 0 N--CA 1.424 -1.749 0 CA-C-O 121.976 0.893 . . . . 0.0 111.789 -178.234 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.2 p -103.97 -22.1 13.52 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.234 177.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 21.3 m -134.85 139.53 45.12 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 6' ' ' LYS . 3.6 mptp? -86.52 -101.89 0.07 Allowed 'General case' 0 C--O 1.24 0.596 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 177.279 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 5' ' ' LYS . 22.9 tptm 165.23 125.66 0.01 OUTLIER 'General case' 0 CA--C 1.507 -0.698 0 C-N-CA 124.984 1.314 . . . . 0.0 107.64 178.347 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 88.2 mt -86.57 139.59 30.69 Favored 'General case' 0 C--N 1.292 -1.914 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 172.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -74.4 103.02 4.62 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -176.235 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.7 tptm -108.13 131.88 54.17 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 114.712 -1.131 . . . . 0.0 108.569 -177.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -128.38 144.76 53.15 Favored Pre-proline 0 C--N 1.303 -1.43 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_exo -81.09 138.48 11.36 Favored 'Trans proline' 0 N--CA 1.447 -1.215 0 C-N-CA 121.89 1.726 . . . . 0.0 108.762 170.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -130.36 141.0 50.58 Favored 'General case' 0 C--N 1.289 -2.043 0 CA-C-O 121.152 0.501 . . . . 0.0 111.747 -177.18 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.486 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 38.0 m -90.23 127.24 36.08 Favored 'General case' 0 N--CA 1.416 -2.149 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 176.219 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.0 tp -78.47 129.71 35.2 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-O 120.623 0.249 . . . . 0.0 111.317 -177.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 71.7 mt -93.83 -56.94 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.625 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 175.226 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.448 ' HE3' ' HA ' ' A' ' 16' ' ' LYS . 1.8 tpmt? -175.2 145.22 0.77 Allowed 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 179.006 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.438 ' HA ' HG23 ' A' ' 23' ' ' VAL . . . -94.71 112.72 24.46 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 173.168 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.4 mp -82.75 -63.31 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.04 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 -173.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.417 ' HA ' ' HB3' ' A' ' 59' ' ' SER . 8.1 t70 -114.47 -164.07 0.91 Allowed 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 -176.222 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.67 -29.58 38.82 Favored Glycine 0 C--N 1.304 -1.215 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 -178.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.619 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 2.4 p30 -104.62 -30.44 9.97 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 120.869 -0.332 . . . . 0.0 111.452 178.511 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.75 116.14 31.95 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-O 121.84 0.829 . . . . 0.0 112.472 -175.064 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.438 HG23 ' HA ' ' A' ' 17' ' ' ALA . 3.5 p -131.85 142.32 43.32 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 -178.499 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.2 tttp -104.34 118.89 37.71 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.607 -0.683 . . . . 0.0 109.561 -173.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.457 HD11 HG21 ' A' ' 72' ' ' ILE . 3.6 mm? -119.06 159.3 24.16 Favored 'General case' 0 CA--C 1.502 -0.892 0 CA-C-O 121.731 0.777 . . . . 0.0 111.6 -178.224 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.486 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 46.0 ttm -121.7 102.15 8.03 Favored 'General case' 0 C--N 1.285 -2.214 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 174.536 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -105.29 117.62 34.47 Favored 'General case' 0 C--N 1.292 -1.913 0 C-N-CA 119.23 -0.988 . . . . 0.0 109.473 -176.15 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.9 mttt 61.96 30.62 18.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.748 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.02 -2.55 69.14 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 115.139 -0.937 . . . . 0.0 113.488 177.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.404 ' O ' ' HA ' ' A' ' 26' ' ' MET . 34.4 tt0 -103.84 112.48 65.57 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 117.013 0.406 . . . . 0.0 111.091 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -79.64 116.09 3.47 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 122.52 2.147 . . . . 0.0 111.924 177.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 51.0 ttm -136.43 141.2 43.58 Favored 'General case' 0 N--CA 1.423 -1.82 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.9 m -82.79 122.56 28.36 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 176.131 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.458 ' HA ' ' O ' ' A' ' 88' ' ' GLY . 56.4 m-85 -112.2 160.78 17.26 Favored 'General case' 0 N--CA 1.423 -1.796 0 CA-C-O 121.852 0.834 . . . . 0.0 112.762 -176.059 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.619 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 37.7 mtt180 -119.54 148.31 43.45 Favored 'General case' 0 C--N 1.288 -2.086 0 CA-C-N 113.508 -1.678 . . . . 0.0 106.565 167.511 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.406 ' HB2' HG21 ' A' ' 39' ' ' VAL . 5.9 mp -77.49 135.96 38.3 Favored 'General case' 0 C--N 1.289 -2.057 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.982 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.517 HD21 HD13 ' A' ' 89' ' ' LEU . 22.9 mt -70.34 152.73 43.82 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.357 175.155 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.5 HD22 ' CD2' ' A' ' 113' ' ' TYR . 3.6 mt 68.28 19.86 8.9 Favored 'General case' 0 C--O 1.212 -0.919 0 C-N-CA 125.964 1.706 . . . . 0.0 110.98 177.116 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.406 HG21 ' HB2' ' A' ' 36' ' ' LEU . 66.0 t -110.04 125.12 67.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 CA-C-O 121.27 0.557 . . . . 0.0 109.671 -178.598 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.551 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 26.6 t70 -98.33 108.07 20.69 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 105.601 -2.0 . . . . 0.0 105.601 173.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.442 HG21 ' NH2' ' A' ' 35' ' ' ARG . 5.0 t -83.37 139.49 41.68 Favored Pre-proline 0 C--N 1.288 -2.09 0 CA-C-N 114.697 -1.138 . . . . 0.0 111.698 -173.627 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.55 -9.22 24.73 Favored 'Trans proline' 0 N--CA 1.452 -0.914 0 C-N-CA 122.424 2.083 . . . . 0.0 112.091 177.146 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -125.14 127.29 46.62 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-O 121.777 0.799 . . . . 0.0 110.535 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.0 t -175.44 -33.05 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 124.903 1.281 . . . . 0.0 107.984 177.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 55.3 mttp -71.65 -16.45 62.26 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.182 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . 0.28 43.7 m-70 61.51 80.89 0.25 Allowed Pre-proline 0 CA--C 1.495 -1.142 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 179.095 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -71.72 154.04 59.25 Favored 'Trans proline' 0 N--CA 1.441 -1.616 0 N-CA-C 105.615 -2.494 . . . . 0.0 105.615 164.787 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.6 mtpt -54.09 -49.51 68.91 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 -172.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -100.37 11.71 38.81 Favored 'General case' 0 C--N 1.287 -2.128 0 CA-C-O 121.458 0.647 . . . . 0.0 110.622 178.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 75.93 -167.25 54.66 Favored Glycine 0 N--CA 1.437 -1.282 0 CA-C-N 114.915 -1.039 . . . . 0.0 111.652 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 29.6 t -99.35 86.54 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.229 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 176.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -65.81 -26.12 67.54 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.734 -170.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.48 -14.58 58.15 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 177.699 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -115.01 -48.61 2.82 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -60.15 -59.43 10.4 Favored Glycine 0 CA--C 1.535 1.328 0 CA-C-O 119.229 -0.761 . . . . 0.0 114.545 -175.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -55.49 -34.03 88.18 Favored 'Trans proline' 0 C--N 1.364 1.351 0 C-N-CA 123.051 2.501 . . . . 0.0 113.514 178.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -71.26 -48.43 51.02 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.071 0.462 . . . . 0.0 110.446 178.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.525 ' HA ' HD13 ' A' ' 108' ' ' LEU . . . -65.07 -40.12 94.23 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.519 -178.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.476 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 29.8 p -65.28 -43.92 89.67 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.721 -178.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.27 -37.16 86.49 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.089 0.471 . . . . 0.0 110.706 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -67.95 -47.55 68.33 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.878 179.095 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.565 ' O ' HG22 ' A' ' 66' ' ' VAL . 58.5 m -58.84 -41.65 87.45 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.09 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 59' ' ' SER . 48.2 mttp -54.24 -54.71 36.29 Favored 'General case' 0 C--N 1.35 0.615 0 O-C-N 123.233 0.333 . . . . 0.0 110.848 178.353 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -66.39 -32.01 73.13 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.335 -176.409 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 17.4 tpt -67.0 -51.08 59.44 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.972 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 62' ' ' THR . 29.6 m -83.51 -27.53 7.6 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -175.267 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -81.46 -20.29 40.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -85.18 -20.63 29.92 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.585 0.707 . . . . 0.0 110.619 178.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -77.97 160.47 28.17 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.034 178.196 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -84.6 -57.95 2.92 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -105.46 144.19 32.57 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.081 -174.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.457 HG21 HD11 ' A' ' 25' ' ' LEU . 4.0 mp -116.86 120.39 64.9 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.811 0 N-CA-C 105.987 -1.857 . . . . 0.0 105.987 174.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.496 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 22.5 mt-10 -112.81 133.28 54.88 Favored 'General case' 0 C--N 1.279 -2.466 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -175.682 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 30.2 m -110.87 122.75 65.93 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.321 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -118.26 140.36 49.93 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-O 121.326 0.584 . . . . 0.0 111.374 -176.007 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.403 ' CD1' ' HB2' ' A' ' 81' ' ' ARG . 34.2 t80 -104.76 126.28 51.68 Favored 'General case' 0 N--CA 1.421 -1.923 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.897 179.485 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -85.68 -173.47 4.65 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 178.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -71.78 -12.29 61.23 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.903 -0.498 . . . . 0.0 112.091 -175.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -79.79 -118.05 0.31 Allowed Glycine 0 CA--C 1.525 0.708 0 N-CA-C 114.557 0.583 . . . . 0.0 114.557 -178.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -124.36 153.34 41.98 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 -176.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.403 ' HB2' ' CD1' ' A' ' 76' ' ' PHE . 43.0 ttm180 -106.97 -15.63 14.65 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 121.832 0.825 . . . . 0.0 108.876 174.441 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 2.2 p -101.87 133.79 46.09 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.96 178.796 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -100.05 149.3 23.63 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.214 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -61.84 -26.89 68.4 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 124.855 1.262 . . . . 0.0 112.478 -175.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -78.48 -5.49 52.7 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 121.464 0.65 . . . . 0.0 110.215 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 85.78 56.68 2.3 Favored Glycine 0 N--CA 1.431 -1.658 0 N-CA-C 109.407 -1.477 . . . . 0.0 109.407 -178.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 9.7 tpp180 -142.89 149.48 38.54 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 -177.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.458 ' O ' ' HA ' ' A' ' 34' ' ' PHE . . . -95.53 142.43 16.09 Favored Glycine 0 N--CA 1.432 -1.573 0 N-CA-C 109.18 -1.568 . . . . 0.0 109.18 175.446 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.517 HD13 HD21 ' A' ' 37' ' ' LEU . 0.4 OUTLIER -134.38 135.15 42.45 Favored 'General case' 0 N--CA 1.419 -1.987 0 CA-C-N 117.9 0.85 . . . . 0.0 112.504 177.06 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -152.49 156.49 39.51 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -83.31 130.73 35.08 Favored 'General case' 0 N--CA 1.434 -1.259 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 178.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 60.5 mt -103.72 126.54 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.025 0 CA-C-O 121.563 0.697 . . . . 0.0 112.02 -175.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.496 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 79.1 m-85 -107.43 132.44 53.18 Favored 'General case' 0 N--CA 1.423 -1.805 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 172.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.27 99.36 8.97 Favored 'General case' 0 C--N 1.285 -2.237 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 177.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.3 t70 45.83 53.25 9.04 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 125.155 1.382 . . . . 0.0 111.355 -176.429 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 84.1 -5.02 81.65 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 115.617 -0.72 . . . . 0.0 114.641 179.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -96.89 141.07 30.52 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 117.927 0.863 . . . . 0.0 109.681 177.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 62.9 mtm -84.29 110.58 18.69 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-O 121.37 0.605 . . . . 0.0 110.901 179.294 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 54.9 t -65.94 -42.2 91.4 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 CA-C-N 114.525 -1.216 . . . . 0.0 111.49 -176.23 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -69.41 -30.41 68.36 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.057 0.456 . . . . 0.0 110.46 -178.355 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -62.12 -38.47 89.07 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 175.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -69.58 -36.72 76.52 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.237 178.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 89.2 mt -64.02 -44.16 93.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.35 177.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 66.3 t -69.74 -32.5 52.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 121.018 0.437 . . . . 0.0 110.27 178.013 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.93 -17.25 64.4 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.265 0.555 . . . . 0.0 111.008 179.455 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -108.86 -3.68 17.44 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 121.086 0.469 . . . . 0.0 110.033 176.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.537 ' HA3' ' O ' ' B' ' 150' ' ' LEU . . . 63.08 42.47 99.54 Favored Glycine 0 N--CA 1.437 -1.244 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.034 -177.191 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.525 HD13 ' HA ' ' A' ' 58' ' ' ALA . 75.8 mt -90.68 -20.57 22.34 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 121.006 0.432 . . . . 0.0 110.39 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -155.1 173.51 16.49 Favored 'General case' 0 N--CA 1.433 -1.275 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.523 -177.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.551 ' HB2' ' HB3' ' A' ' 40' ' ' ASP . 89.6 mttt -118.14 168.78 10.25 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 105.472 -2.048 . . . . 0.0 105.472 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 11.6 m -106.83 127.84 62.07 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 C-N-CA 117.378 -1.729 . . . . 0.0 111.937 178.261 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.494 ' HB2' ' HB2' ' A' ' 40' ' ' ASP . . . -114.01 119.64 37.88 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 175.615 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.5 ' CD2' HD22 ' A' ' 38' ' ' LEU . 1.8 t80 -120.45 120.49 36.05 Favored 'General case' 0 C--N 1.286 -2.195 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 -176.28 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 90.7 t -88.63 108.43 18.84 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.79 0 C-N-CA 119.702 -0.799 . . . . 0.0 109.751 176.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.539 ' HA ' ' HB2' ' B' ' 131' ' ' ASN . 23.7 p90 -85.54 162.41 18.91 Favored 'General case' 0 N--CA 1.395 -3.19 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 170.006 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.8 mppt? 82.07 140.68 0.06 OUTLIER Pre-proline 0 C--N 1.318 -0.801 0 C-N-CA 125.151 1.38 . . . . 0.0 108.274 -164.739 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -53.23 -52.8 7.89 Favored 'Trans proline' 0 C--O 1.247 0.925 0 C-N-CA 122.106 1.871 . . . . 0.0 112.712 -178.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 61.24 22.08 12.47 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.761 0.824 . . . . 0.0 112.584 176.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -123.55 87.81 2.81 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 72.9 p 72.23 1.92 4.13 Favored 'General case' 0 C--N 1.308 -1.232 0 C-N-CA 127.111 2.164 . . . . 0.0 112.007 -176.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 10.6 p-80 . . . . . 0 N--CA 1.434 -1.261 0 N-CA-C 106.627 -1.619 . . . . 0.0 106.627 177.097 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.325 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 40.5 m 68.52 -57.04 0.5 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.971 1.309 . . . . 0.0 113.72 178.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 30.1 m -72.72 -45.09 58.35 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.092 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -176.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -116.06 94.78 4.8 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.477 0.656 . . . . 0.0 110.61 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -144.69 -64.42 0.35 Allowed 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.142 177.189 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 14.5 p -100.12 119.11 47.76 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.167 0 CA-C-O 121.972 0.891 . . . . 0.0 110.642 -173.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -101.27 -8.16 22.39 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.662 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -88.71 108.19 21.64 Favored Pre-proline 0 C--N 1.306 -1.284 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 173.318 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -52.36 -56.47 2.85 Favored 'Trans proline' 0 C--O 1.243 0.762 0 C-N-CA 122.373 2.049 . . . . 0.0 112.082 -177.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 131' ' ' ASN . . . . . 0.539 ' HB2' ' HA ' ' A' ' 115' ' ' TYR . 2.6 m-20 -101.49 95.08 6.24 Favored 'General case' 0 N--CA 1.427 -1.583 0 N-CA-C 107.605 -1.258 . . . . 0.0 107.605 178.201 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -142.26 12.66 1.98 Allowed 'General case' 0 C--N 1.293 -1.848 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 177.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 1.6 m -47.98 -44.34 30.42 Favored 'General case' 0 N--CA 1.441 -0.92 0 C-N-CA 126.784 2.033 . . . . 0.0 112.661 -172.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -128.19 11.3 6.44 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.689 179.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -67.45 -50.27 59.98 Favored 'General case' 0 CA--C 1.501 -0.904 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 -172.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 136' ' ' GLN . . . . . 0.489 ' O ' ' HG3' ' B' ' 140' ' ' LYS . 72.7 mt-30 -52.24 -45.33 65.3 Favored 'General case' 0 C--N 1.314 -0.939 0 O-C-N 124.07 0.856 . . . . 0.0 111.784 -175.429 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.9 mt -63.59 -50.3 69.98 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 120.828 0.346 . . . . 0.0 110.871 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.64 -38.9 87.84 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.688 -178.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 77.0 mtt-85 -75.24 -29.15 60.14 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -176.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 140' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' B' ' 136' ' ' GLN . 63.5 mttm -70.56 -34.42 72.2 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.546 174.307 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 47.4 m -67.13 -41.75 85.62 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.489 174.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.522 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 40.0 tt0 -57.47 -52.77 64.03 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.427 176.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -51.84 -49.38 62.96 Favored 'General case' 0 C--O 1.24 0.558 0 O-C-N 123.782 0.676 . . . . 0.0 111.525 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 144' ' ' GLN . . . . . 0.47 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 27.5 tt0 -61.93 -47.19 86.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.417 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -63.28 -36.77 84.79 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 123.536 0.734 . . . . 0.0 111.746 -177.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 146' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 87.7 mttt -57.62 -48.81 78.41 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.344 0.593 . . . . 0.0 109.844 176.541 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -66.11 -32.33 73.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.858 -178.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 148' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 22.4 mm-40 -73.51 -20.58 60.63 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.456 178.752 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt 54.93 65.01 1.62 Allowed 'General case' 0 CA--C 1.506 -0.733 0 C-N-CA 124.501 1.12 . . . . 0.0 110.615 -172.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 150' ' ' LEU . . . . . 0.537 ' O ' ' HA3' ' A' ' 107' ' ' GLY . 95.7 mt -89.33 108.19 19.49 Favored 'General case' 0 C--N 1.301 -1.528 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.092 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 151' ' ' ASN . . . . . 0.408 ' HB3' ' O ' ' A' ' 107' ' ' GLY . 61.5 t30 48.45 -81.64 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 126.635 1.974 . . . . 0.0 114.525 175.371 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 12.6 tt -72.85 -25.15 21.83 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.499 0 CA-C-O 121.475 0.655 . . . . 0.0 109.833 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 153' ' ' TRP . . . . . 0.494 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 52.4 m95 -82.08 -4.74 57.51 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 121.783 0.802 . . . . 0.0 109.243 178.013 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 11.7 t -110.27 31.92 5.54 Favored 'General case' 0 N--CA 1.407 -2.606 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 175.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -69.67 -26.52 64.42 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 119.61 -0.836 . . . . 0.0 109.636 176.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 . . . . . 0 C--O 1.237 0.435 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 173.237 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.612 0 CA-C-O 120.647 0.261 . . . . 0.0 111.043 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 34.5 m 63.29 67.7 0.65 Allowed 'General case' 0 C--O 1.248 1.022 0 CA-C-O 122.754 1.264 . . . . 0.0 109.385 -174.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 44.9 m -89.31 -175.52 4.78 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 114.202 -1.363 . . . . 0.0 109.973 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.9 m -72.76 91.18 1.46 Allowed 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -174.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -97.18 98.85 10.37 Favored 'General case' 0 N--CA 1.427 -1.609 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 170.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.415 ' HD3' ' O ' ' A' ' 6' ' ' LYS . 2.6 tmtp? -97.59 -36.38 10.3 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -178.733 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.528 HD13 ' HB2' ' A' ' 77' ' ' ASP . 40.3 mt -130.28 -149.76 0.41 Allowed 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 114.974 -1.012 . . . . 0.0 108.451 -176.172 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 67.7 t60 -98.13 104.84 16.91 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -179.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -106.83 153.56 22.3 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.158 0.504 . . . . 0.0 110.06 179.246 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 7.8 pt-20 -139.97 149.08 57.52 Favored Pre-proline 0 C--N 1.272 -2.785 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 172.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 8.0 Cg_exo -74.3 144.16 32.61 Favored 'Trans proline' 0 C--O 1.247 0.973 0 C-N-CA 121.924 1.749 . . . . 0.0 111.505 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.402 ' HB1' ' HB3' ' A' ' 25' ' ' LEU . . . -132.1 152.38 51.25 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.277 179.175 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.494 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 22.7 m -98.21 131.69 44.35 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.622 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.438 ' HA ' HD13 ' A' ' 25' ' ' LEU . 61.4 tp -76.27 124.21 27.13 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 120.943 0.402 . . . . 0.0 111.437 -178.782 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 70.0 mt -95.64 -60.21 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.224 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 176.703 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -154.81 160.2 41.1 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 123.756 0.822 . . . . 0.0 109.994 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.97 121.75 45.86 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 106.73 -1.582 . . . . 0.0 106.73 173.301 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.9 mp -92.95 -56.98 4.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.402 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.092 -175.124 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -141.57 -167.82 2.51 Favored 'General case' 0 C--N 1.311 -1.071 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 -177.207 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.532 ' HA2' ' OG1' ' A' ' 62' ' ' THR . . . -88.24 51.89 4.02 Favored Glycine 0 N--CA 1.44 -1.063 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 178.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.434 ' OD1' ' HD3' ' A' ' 35' ' ' ARG . 2.6 t70 179.06 -59.97 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.143 0 C-N-CA 125.813 1.645 . . . . 0.0 108.087 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.4 m -82.46 110.08 17.26 Favored 'General case' 0 N--CA 1.405 -2.706 0 CA-C-N 114.048 -1.433 . . . . 0.0 110.634 -175.079 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.1 t -125.15 152.82 31.98 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.2 tttp -111.19 117.67 33.86 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 118.793 0.724 . . . . 0.0 109.39 -175.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.481 ' HB2' ' CE1' ' A' ' 34' ' ' PHE . 3.3 mm? -123.62 153.94 40.02 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.614 0.721 . . . . 0.0 111.358 -175.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.531 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 49.1 ttm -112.29 109.1 18.56 Favored 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 174.894 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -115.96 116.19 27.49 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.165 -177.041 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.48 ' HA ' ' HE2' ' A' ' 28' ' ' LYS . 9.8 mmpt? 63.84 26.92 14.46 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.423 1.089 . . . . 0.0 109.577 -178.132 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.402 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 92.8 4.96 64.92 Favored Glycine 0 C--N 1.303 -1.263 0 CA-C-N 114.603 -1.18 . . . . 0.0 113.32 179.096 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.531 ' O ' ' HA ' ' A' ' 26' ' ' MET . 46.4 mt-30 -97.03 106.93 34.54 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.53 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.402 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 5.8 Cg_exo -80.42 102.49 1.42 Allowed 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 122.694 2.263 . . . . 0.0 110.354 177.424 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 89.6 mtp -133.98 150.64 51.27 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-O 121.371 0.605 . . . . 0.0 110.814 -177.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.6 m -86.47 126.74 34.63 Favored 'General case' 0 N--CA 1.415 -2.2 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 177.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.481 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 33.2 m-85 -97.15 157.95 15.68 Favored 'General case' 0 C--N 1.292 -1.903 0 C-N-CA 123.174 0.589 . . . . 0.0 111.853 -177.511 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.434 ' HD3' ' OD1' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -139.08 133.78 32.03 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 104.104 -2.554 . . . . 0.0 104.104 -179.187 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.6 mt -84.61 132.66 34.47 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.897 0.856 . . . . 0.0 112.265 -174.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.473 HD21 ' HB3' ' A' ' 89' ' ' LEU . 74.1 mt -73.31 138.34 45.37 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.115 177.718 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 38.8 mt 66.75 17.88 10.63 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.265 1.426 . . . . 0.0 112.964 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 59.5 t -110.64 136.92 45.16 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -126.15 106.67 9.73 Favored 'General case' 0 C--N 1.288 -2.103 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 174.001 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.507 ' H ' ' HD2' ' A' ' 42' ' ' PRO . 19.6 m -101.58 -58.41 0.11 Allowed Pre-proline 0 C--N 1.285 -2.22 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 177.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.507 ' HD2' ' H ' ' A' ' 41' ' ' THR . 31.4 Cg_endo -64.84 107.74 0.96 Allowed 'Trans proline' 0 C--N 1.383 2.382 0 C-N-CA 121.622 1.548 . . . . 0.0 111.441 175.733 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -67.17 154.15 41.95 Favored 'General case' 0 C--O 1.258 1.55 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.771 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.4 m 78.42 153.8 0.14 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 125.217 1.407 . . . . 0.0 108.759 -172.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -59.41 -25.82 64.63 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.515 0.674 . . . . 0.0 110.864 178.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 23.1 t60 -135.28 122.28 14.81 Favored Pre-proline 0 N--CA 1.429 -1.483 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 172.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -65.39 98.53 0.33 Allowed 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 121.574 1.516 . . . . 0.0 111.916 179.28 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -92.8 -44.16 8.65 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 178.37 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -85.28 -24.92 27.53 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 175.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 84.97 -132.03 10.82 Favored Glycine 0 N--CA 1.425 -2.097 0 N-CA-C 108.423 -1.871 . . . . 0.0 108.423 -177.594 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.423 ' CG2' ' HA ' ' A' ' 42' ' ' PRO . 5.0 t -135.25 88.29 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 173.474 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -83.37 -45.96 13.11 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.634 -177.109 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -50.06 -63.2 1.19 Allowed 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 114.797 1.406 . . . . 0.0 114.797 -175.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -134.47 20.49 3.64 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 121.261 0.553 . . . . 0.0 111.02 -175.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -61.82 -58.86 11.03 Favored Glycine 0 C--N 1.317 -0.508 0 CA-C-N 115.048 -0.978 . . . . 0.0 112.741 -179.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -51.55 -29.49 32.3 Favored 'Trans proline' 0 C--N 1.363 1.315 0 C-N-CA 123.154 2.569 . . . . 0.0 113.082 177.384 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -72.77 -47.58 45.55 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 122.554 0.342 . . . . 0.0 110.283 178.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.33 -44.85 93.73 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.69 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.568 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 12.9 m -59.21 -46.87 87.31 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.111 178.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.11 -46.26 89.84 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -177.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -59.37 -40.86 87.86 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.742 -177.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.532 ' OG1' ' HA2' ' A' ' 20' ' ' GLY . 30.2 m -64.45 -47.15 80.15 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.217 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.568 ' HG3' ' O ' ' A' ' 59' ' ' SER . 55.2 mtpt -60.46 -44.03 96.31 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.379 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp -56.15 -54.04 49.85 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.625 177.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 53.0 ttm -66.07 -42.17 89.77 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.729 -175.092 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 35.1 m -71.65 -37.75 64.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.921 -0.712 . . . . 0.0 112.351 -178.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -75.36 -24.78 57.34 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -78.67 -21.63 47.99 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.508 0.671 . . . . 0.0 110.203 178.173 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.487 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -78.62 147.08 33.78 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.518 -178.811 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.25 -47.49 7.75 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.678 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.4 mtmp? -110.07 139.08 45.59 Favored 'General case' 0 CA--C 1.494 -1.211 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 3.8 mp -112.25 135.0 52.96 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.404 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 176.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.531 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 7.0 mm-40 -111.99 132.89 54.51 Favored 'General case' 0 N--CA 1.422 -1.826 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 -177.082 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.443 HG12 ' CD1' ' A' ' 92' ' ' ILE . 35.4 m -116.74 118.91 60.35 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 175.448 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.451 ' HA ' ' HA ' ' A' ' 9' ' ' LYS . 25.1 tt0 -116.25 136.45 53.0 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 121.395 0.617 . . . . 0.0 112.539 -173.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -108.48 140.22 42.12 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 125.222 1.409 . . . . 0.0 111.104 -176.214 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.528 ' HB2' HD13 ' A' ' 7' ' ' LEU . 47.3 t0 -122.89 -179.3 4.21 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -179.706 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -73.74 69.55 1.33 Allowed 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 124.766 1.226 . . . . 0.0 112.549 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.495 ' HA2' HG21 ' B' ' 127' ' ' VAL . . . -150.75 -164.03 11.7 Favored Glycine 0 C--N 1.28 -2.557 0 CA-C-N 113.297 -1.774 . . . . 0.0 109.573 174.449 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -89.81 142.47 27.66 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 176.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -101.51 -10.6 19.99 Favored 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.697 -176.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.3 p -132.3 142.32 49.32 Favored 'General case' 0 C--N 1.29 -2.005 0 O-C-N 122.114 -0.366 . . . . 0.0 110.157 178.122 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -108.7 -174.9 2.63 Favored 'General case' 0 C--O 1.254 1.326 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 119' ' ' ASN . 29.9 ttpp -77.08 -27.36 54.18 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -178.05 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -75.2 -27.19 59.5 Favored 'General case' 0 C--O 1.246 0.912 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 105.15 40.87 2.03 Favored Glycine 0 N--CA 1.433 -1.52 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.53 173.595 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -117.42 150.38 38.97 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-O 120.796 0.331 . . . . 0.0 110.47 176.443 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.66 115.01 3.97 Favored Glycine 0 N--CA 1.426 -1.987 0 N-CA-C 110.711 -0.956 . . . . 0.0 110.711 179.564 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.473 ' HB3' HD21 ' A' ' 37' ' ' LEU . 69.5 mt -86.41 101.55 13.23 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -157.19 167.81 29.26 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 -177.11 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.431 ' CE1' ' HB2' ' A' ' 37' ' ' LEU . 11.9 m-85 -90.21 127.51 36.14 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.352 175.425 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.443 ' CD1' HG12 ' A' ' 74' ' ' VAL . 51.0 mm -99.17 122.91 51.47 Favored 'Isoleucine or valine' 0 C--O 1.261 1.7 0 C-N-CA 120.193 -0.603 . . . . 0.0 109.508 177.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.531 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 14.1 m-85 -114.48 135.93 53.57 Favored 'General case' 0 N--CA 1.427 -1.623 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 174.6 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.487 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -105.45 109.17 21.05 Favored 'General case' 0 C--N 1.278 -2.529 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 -178.618 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 11.1 t70 46.95 40.45 9.28 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.614 1.566 . . . . 0.0 111.319 -177.193 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 96.03 -14.35 64.72 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.339 -0.846 . . . . 0.0 113.792 177.071 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 8.4 mptt -92.29 140.84 29.2 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -179.29 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' MET . . . . . 0.414 ' HG3' ' CD1' ' A' ' 93' ' ' TYR . 1.9 mpt? -85.08 105.05 15.53 Favored 'General case' 0 C--N 1.297 -1.689 0 O-C-N 122.294 -0.254 . . . . 0.0 111.63 -176.47 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 30.0 t -66.59 -44.91 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-O 122.256 1.027 . . . . 0.0 108.456 -179.255 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 -56.45 -43.61 79.67 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 113.37 -1.741 . . . . 0.0 110.721 -179.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -66.83 -51.44 55.57 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.517 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.48 -45.24 76.98 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.111 -0.95 . . . . 0.0 112.066 -177.497 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.2 mt -54.65 -52.67 61.58 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 178.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 62.0 t -71.01 -37.83 69.43 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.737 -178.43 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 23.5 ttp85 -69.94 -21.49 63.26 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 -179.135 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -95.93 3.71 53.33 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.977 175.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.74 29.49 73.84 Favored Glycine 0 C--N 1.331 0.287 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.792 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.9 mt -95.08 -15.03 23.73 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.192 0.52 . . . . 0.0 110.198 -179.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -149.24 162.27 40.35 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -106.22 171.47 7.33 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 10.2 p -93.56 133.57 34.23 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 177.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -98.09 121.56 40.15 Favored 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 174.537 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -91.95 98.3 11.49 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -177.615 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 42.5 t -128.09 143.54 40.55 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.584 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.286 -174.509 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -97.66 -60.95 1.46 Allowed 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 173.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -135.93 137.79 26.1 Favored Pre-proline 0 C--N 1.31 -1.132 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 170.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -76.02 -167.68 0.47 Allowed 'Trans proline' 0 C--O 1.25 1.105 0 C-N-CA 121.86 1.707 . . . . 0.0 112.602 -175.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -62.78 -42.88 99.89 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.927 -177.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ASN . . . . . 0.404 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 89.8 m-20 72.27 -60.08 0.54 Allowed 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 125.314 1.446 . . . . 0.0 111.429 178.548 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 23.4 m -167.32 -58.78 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 125.783 1.633 . . . . 0.0 107.821 179.216 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 . . . . . 0 N--CA 1.442 -0.839 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -179.962 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.949 0 N-CA-C 112.591 -0.203 . . . . 0.0 112.591 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 24.8 p -81.8 83.11 7.25 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-O 121.425 0.631 . . . . 0.0 110.158 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 7.2 p -156.48 133.59 2.32 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.393 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -178.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . 68.52 -72.27 0.1 Allowed 'General case' 0 C--O 1.24 0.57 0 C-N-CA 125.208 1.403 . . . . 0.0 112.207 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -159.25 131.66 6.69 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 127' ' ' VAL . . . . . 0.495 HG21 ' HA2' ' A' ' 79' ' ' GLY . 26.8 m -98.41 142.32 14.83 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.34 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 174.273 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -78.99 -51.82 9.08 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.965 -172.527 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -82.1 158.48 67.06 Favored Pre-proline 0 C--N 1.315 -0.924 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.073 -177.259 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -75.73 154.35 39.07 Favored 'Trans proline' 0 C--O 1.252 1.186 0 C-N-CA 122.418 2.079 . . . . 0.0 112.091 176.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 131' ' ' ASN . . . . . 0.506 ' ND2' ' HB3' ' A' ' 77' ' ' ASP . 23.5 t-20 -85.85 73.84 10.28 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 175.833 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.466 ' C ' ' H ' ' B' ' 134' ' ' HIS . 26.6 p-10 -137.76 26.94 2.75 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.179 -172.479 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 1.7 m -81.58 27.75 0.43 Allowed 'General case' 0 CA--C 1.568 1.654 0 CA-C-O 122.76 1.267 . . . . 0.0 110.005 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 134' ' ' HIS . . . . . 0.466 ' H ' ' C ' ' B' ' 132' ' ' ASN . 5.5 p80 -162.63 21.19 0.09 Allowed 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 126.623 1.969 . . . . 0.0 107.852 -176.016 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.452 ' HB2' ' HB2' ' B' ' 132' ' ' ASN . 25.2 tt0 -67.75 -48.34 66.68 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.212 -173.451 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -60.08 -33.56 72.25 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.069 -0.969 . . . . 0.0 112.937 -178.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 91.8 mt -59.54 -47.71 84.48 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.324 0.583 . . . . 0.0 109.538 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -68.5 -40.61 80.81 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.404 178.278 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 -63.96 -36.46 84.05 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.486 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -68.63 -43.72 75.73 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.707 0.289 . . . . 0.0 110.718 175.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.0 m -61.41 -45.39 94.52 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.945 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.493 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 0.1 OUTLIER -68.78 -43.11 76.41 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.207 178.434 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -60.1 -44.36 94.9 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.803 0.335 . . . . 0.0 110.722 179.711 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 144' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 35.5 tt0 -67.43 -47.85 69.01 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.774 -179.703 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.91 85.4 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -177.028 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 146' ' ' LYS . . . . . 0.493 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 84.6 mttt -62.25 -47.35 84.76 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.888 175.875 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -69.92 -31.36 69.09 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 123.447 0.467 . . . . 0.0 112.019 -175.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 148' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 11.8 mm-40 -79.95 -17.68 52.36 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.89 178.621 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 149' ' ' LYS . . . . . 0.63 ' O ' ' HB3' ' B' ' 154' ' ' SER . 13.0 mmmm 60.25 65.45 1.08 Allowed 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -174.352 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 150' ' ' LEU . . . . . 0.478 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 97.6 mt -98.98 123.44 43.28 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 115.925 -0.579 . . . . 0.0 112.287 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 49.45 -88.51 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 126.324 1.85 . . . . 0.0 114.951 173.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 48.3 mt -66.29 -37.35 79.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.165 0.507 . . . . 0.0 110.226 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 62.7 m95 -77.25 -21.0 54.38 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.575 -175.095 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 154' ' ' SER . . . . . 0.63 ' HB3' ' O ' ' B' ' 149' ' ' LYS . 80.7 p -91.89 21.11 5.11 Favored 'General case' 0 N--CA 1.419 -1.989 0 CA-C-O 121.338 0.59 . . . . 0.0 111.049 -178.742 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -64.33 -31.97 73.38 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 170.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 27.0 t70 . . . . . 0 N--CA 1.42 -1.948 0 CA-C-N 113.076 -1.875 . . . . 0.0 107.832 -179.378 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.252 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.3 t 179.65 158.19 0.67 Allowed 'General case' 0 N--CA 1.438 -1.056 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 178.357 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.7 p -79.07 130.4 35.47 Favored 'General case' 0 N--CA 1.415 -2.175 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 173.172 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.1 t -74.4 132.74 42.24 Favored 'General case' 0 N--CA 1.421 -1.924 0 CA-C-O 121.588 0.709 . . . . 0.0 110.195 -174.688 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.417 ' HD2' ' N ' ' A' ' 5' ' ' LYS . 3.1 mptp? -86.53 112.78 21.87 Favored 'General case' 0 N--CA 1.428 -1.554 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 179.018 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 53.2 tptt -63.68 -46.06 87.26 Favored 'General case' 0 C--N 1.317 -0.841 0 O-C-N 123.962 0.789 . . . . 0.0 109.87 -176.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 93.6 mt 59.73 -169.27 0.15 Allowed 'General case' 0 C--O 1.239 0.532 0 O-C-N 124.368 1.043 . . . . 0.0 111.11 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.6 m80 -123.22 109.08 13.53 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -177.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -96.6 145.45 25.73 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.68 175.332 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.401 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 11.2 pt-20 -139.28 149.72 61.76 Favored Pre-proline 0 C--N 1.287 -2.15 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 5.1 Cg_exo -78.39 140.96 17.61 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 122.272 1.981 . . . . 0.0 113.172 -177.021 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.437 ' O ' ' HB ' ' A' ' 72' ' ' ILE . . . -132.24 154.83 49.24 Favored 'General case' 0 N--CA 1.424 -1.761 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.433 178.779 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.478 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 50.0 m -98.52 122.46 41.74 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.521 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.2 tp -66.56 118.84 10.73 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 176.003 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 39.0 mm -90.09 -56.9 4.69 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -165.0 153.93 12.47 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.567 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -111.25 123.11 49.54 Favored 'General case' 0 C--N 1.287 -2.15 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 176.064 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.3 mp -90.79 -64.32 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -175.016 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -130.65 -173.71 3.15 Favored 'General case' 0 C--N 1.31 -1.138 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 179.688 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.67 54.63 4.39 Favored Glycine 0 C--N 1.314 -0.654 0 N-CA-C 111.401 -0.68 . . . . 0.0 111.401 -178.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.543 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 4.2 p-10 -177.14 -36.51 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -178.115 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 p -111.33 112.06 23.55 Favored 'General case' 0 N--CA 1.422 -1.832 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.92 -178.473 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.8 m -131.63 143.19 41.14 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.645 0 CA-C-N 114.6 -1.182 . . . . 0.0 108.178 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 33' ' ' THR . 81.0 tttt -104.8 117.77 34.88 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 122.023 -0.423 . . . . 0.0 110.069 -176.671 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.2 mp -120.49 147.01 45.69 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.502 -179.007 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.629 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 44.1 ttm -108.15 108.96 20.25 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 175.128 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -115.38 130.7 56.97 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -178.358 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 32.4 pttt 41.77 35.74 0.54 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.849 1.26 . . . . 0.0 113.559 -174.076 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.445 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 95.32 -0.92 64.07 Favored Glycine 0 N--CA 1.442 -0.9 0 CA-C-N 114.929 -1.032 . . . . 0.0 114.668 177.463 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.629 ' O ' ' HA ' ' A' ' 26' ' ' MET . 1.8 mp0 -99.09 105.8 34.33 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 117.973 0.886 . . . . 0.0 111.458 178.834 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.445 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 1.7 Cg_endo -82.79 104.13 1.26 Allowed 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 122.261 1.974 . . . . 0.0 109.686 173.698 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 86.8 mtp -128.54 143.25 50.93 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 120.658 0.266 . . . . 0.0 110.562 -177.022 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.408 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 15.8 m -80.48 116.22 20.41 Favored 'General case' 0 N--CA 1.421 -1.92 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 174.738 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -98.19 154.62 17.64 Favored 'General case' 0 C--N 1.293 -1.891 0 C-N-CA 124.04 0.936 . . . . 0.0 111.551 -177.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.543 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -122.47 122.98 40.23 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 103.73 -2.693 . . . . 0.0 103.73 174.048 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.6 mp -61.77 126.0 25.81 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 123.389 0.431 . . . . 0.0 111.766 -177.184 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.432 HD21 ' HB3' ' A' ' 89' ' ' LEU . 71.7 mt -57.63 134.76 56.45 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.364 175.41 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.543 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 44.0 mt 70.04 16.77 7.5 Favored 'General case' 0 C--O 1.215 -0.714 0 C-N-CA 124.957 1.303 . . . . 0.0 113.002 179.354 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.599 HG23 HD22 ' A' ' 100' ' ' ASN . 55.6 t -119.49 127.5 75.86 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.755 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 177.557 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -137.15 129.52 29.78 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 123.432 0.457 . . . . 0.0 110.179 177.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.9 m -80.98 121.29 80.65 Favored Pre-proline 0 N--CA 1.426 -1.657 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 174.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -69.38 97.41 0.6 Allowed 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 122.186 1.924 . . . . 0.0 112.791 -178.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.432 ' HA ' ' HA2' ' A' ' 50' ' ' GLY . 46.6 mm-40 -62.68 122.97 17.18 Favored 'General case' 0 C--O 1.246 0.919 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.992 177.049 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.7 m -102.97 159.31 15.62 Favored 'General case' 0 N--CA 1.42 -1.974 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 177.016 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.511 ' HE2' ' HA ' ' A' ' 45' ' ' LYS . 0.4 OUTLIER -49.18 -34.84 15.44 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 -173.094 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -103.61 -59.16 0.08 OUTLIER Pre-proline 0 CA--C 1.555 1.137 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 -179.765 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.91 143.89 29.93 Favored 'Trans proline' 0 C--N 1.369 1.621 0 C-N-CA 121.709 1.606 . . . . 0.0 114.62 -174.117 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.9 mmmt -95.81 1.68 53.33 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.385 178.439 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.603 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.0 mmpt? -97.69 14.34 27.14 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 174.116 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.432 ' HA2' ' HA ' ' A' ' 43' ' ' GLU . . . 87.8 -73.06 2.38 Favored Glycine 0 N--CA 1.422 -2.239 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.495 -178.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.3 p -141.52 129.24 21.72 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.719 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -66.36 -33.89 76.73 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -171.454 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -77.79 -46.2 22.3 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -178.223 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -95.9 -22.21 17.58 Favored 'General case' 0 C--N 1.309 -1.173 0 C-N-CA 119.937 -0.705 . . . . 0.0 112.706 -172.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -53.59 -58.16 13.24 Favored Glycine 0 CA--C 1.535 1.297 0 CA-C-O 119.634 -0.537 . . . . 0.0 113.7 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -58.15 -22.57 57.12 Favored 'Trans proline' 0 C--N 1.361 1.203 0 C-N-CA 122.792 2.328 . . . . 0.0 113.154 177.321 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -82.69 -37.94 24.08 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.949 0.404 . . . . 0.0 109.914 178.542 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.63 -47.14 85.05 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.799 177.245 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.523 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 16.3 p -62.16 -44.7 96.04 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.367 179.454 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.59 -47.52 81.91 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 122.684 0.394 . . . . 0.0 111.499 -179.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -64.37 -40.64 96.23 Favored 'General case' 0 C--O 1.244 0.807 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.353 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 38.7 m -61.06 -45.14 95.98 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.9 178.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.567 ' HG2' ' HB3' ' A' ' 17' ' ' ALA . 61.4 mtpt -59.83 -52.94 63.32 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.593 -178.524 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.462 ' N ' ' HE2' ' A' ' 64' ' ' LYS . 0.3 OUTLIER -62.14 -33.46 74.54 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 179.258 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 53.3 tpp -65.5 -44.53 86.75 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 120.713 0.292 . . . . 0.0 110.8 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.7 m -75.39 -25.03 17.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.972 179.381 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.531 ' HG3' ' O ' ' A' ' 63' ' ' LYS . 44.9 mt-10 -71.43 -31.57 67.37 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.915 0.388 . . . . 0.0 110.053 174.059 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -78.13 -9.67 59.27 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 123.858 0.863 . . . . 0.0 111.319 -177.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.03 128.36 36.26 Favored 'General case' 0 C--O 1.252 1.211 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.459 -178.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 49.1 mttp -68.16 -47.81 67.03 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 105.755 -1.942 . . . . 0.0 105.755 171.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.462 ' H ' ' HB3' ' A' ' 95' ' ' ASP . 4.2 mtpm? -132.96 133.51 43.28 Favored 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 105.25 -2.13 . . . . 0.0 105.25 -179.108 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.437 ' HB ' ' O ' ' A' ' 12' ' ' ALA . 3.8 mp -91.72 119.96 39.98 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.361 0 N-CA-C 105.803 -1.925 . . . . 0.0 105.803 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.579 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 5.5 mm-40 -112.53 133.5 54.56 Favored 'General case' 0 C--N 1.294 -1.817 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.067 -171.225 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.5 m -110.94 125.62 68.28 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 174.434 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -114.01 131.33 56.39 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -178.402 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.466 ' CE1' ' HB2' ' A' ' 81' ' ' ARG . 60.3 t80 -102.47 122.58 44.6 Favored 'General case' 0 N--CA 1.421 -1.878 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.382 178.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.498 ' CG ' ' H ' ' B' ' 133' ' ' THR . 14.9 t70 -94.52 -173.51 3.06 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-N 114.925 -1.034 . . . . 0.0 108.442 178.908 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.412 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 82.1 mttt -81.58 17.03 1.52 Allowed 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 125.002 1.321 . . . . 0.0 111.184 -173.882 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -107.19 -121.91 4.79 Favored Glycine 0 N--CA 1.44 -1.083 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.377 -178.446 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -110.81 149.14 30.99 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 122.509 0.323 . . . . 0.0 110.638 -176.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.466 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . 43.2 ttp180 -110.23 -8.16 14.78 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.577 0.703 . . . . 0.0 109.172 177.124 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 2.1 p -148.95 151.11 34.02 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.515 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -108.38 153.18 23.65 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 108.355 -0.979 . . . . 0.0 108.355 176.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -69.0 -15.27 63.44 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 123.533 0.733 . . . . 0.0 111.431 -176.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -74.57 -10.13 59.25 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.293 0.568 . . . . 0.0 109.793 176.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 90.84 43.11 4.88 Favored Glycine 0 CA--C 1.496 -1.108 0 N-CA-C 110.06 -1.216 . . . . 0.0 110.06 -178.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.441 ' CG ' ' HB2' ' A' ' 35' ' ' ARG . 9.8 tpp180 -126.86 142.25 51.6 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 -176.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.23 146.27 23.73 Favored Glycine 0 N--CA 1.439 -1.159 0 N-CA-C 109.821 -1.312 . . . . 0.0 109.821 177.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.432 ' HB3' HD21 ' A' ' 37' ' ' LEU . 93.0 mt -126.64 119.91 28.2 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.05 161.65 40.39 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.443 ' CZ ' ' HB3' ' A' ' 100' ' ' ASN . 29.9 t80 -91.89 123.45 35.28 Favored 'General case' 0 N--CA 1.412 -2.369 0 N-CA-C 105.469 -2.049 . . . . 0.0 105.469 174.842 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 38.1 mm -99.44 130.84 47.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 CA-C-O 120.879 0.371 . . . . 0.0 110.736 -172.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.579 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 87.4 m-85 -122.09 147.59 45.93 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 174.519 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.13 98.95 8.59 Favored 'General case' 0 C--N 1.284 -2.241 0 N-CA-C 105.342 -2.095 . . . . 0.0 105.342 171.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.462 ' HB3' ' H ' ' A' ' 71' ' ' LYS . 4.2 p30 45.41 31.24 0.83 Allowed 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 125.045 1.338 . . . . 0.0 113.608 -175.502 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.49 -5.41 35.36 Favored Glycine 0 CA--C 1.524 0.633 0 CA-C-N 115.949 -0.568 . . . . 0.0 113.712 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -83.26 125.02 31.14 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 173.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 1.5 mpt? -67.4 102.85 1.17 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 117.868 0.303 . . . . 0.0 110.26 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 49.5 t -66.5 -38.69 82.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.599 HD22 HG23 ' A' ' 39' ' ' VAL . 6.7 t-20 -57.78 -51.68 68.59 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.438 176.706 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.493 ' O ' ' HG3' ' A' ' 105' ' ' ARG . 35.1 tt0 -69.96 -34.94 74.07 Favored 'General case' 0 C--O 1.204 -1.32 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.696 -174.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.49 -43.3 88.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.925 0.393 . . . . 0.0 110.293 177.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.7 mt -65.33 -42.81 92.53 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.757 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 100' ' ' ASN . 84.2 t -65.48 -41.48 91.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.346 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 101' ' ' GLU . 17.1 mtm180 -70.29 -16.39 63.01 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.082 0.553 . . . . 0.0 111.701 -178.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -105.56 1.85 27.84 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.586 176.1 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 59.55 44.37 96.84 Favored Glycine 0 C--O 1.219 -0.795 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.525 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.3 mt -106.27 10.4 31.75 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -177.124 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -165.5 170.33 14.51 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 178.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.406 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 96.8 mttt -116.57 147.12 42.14 Favored 'General case' 0 CA--C 1.491 -1.296 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 175.021 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.543 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 99.1 t -73.79 133.85 30.81 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 C-N-CA 120.122 -0.631 . . . . 0.0 109.744 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -86.33 154.8 20.96 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -72.03 139.38 48.5 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -172.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.475 HG13 ' ND2' ' B' ' 131' ' ' ASN . 93.8 t -88.56 151.92 3.43 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 CA-C-N 113.511 -1.677 . . . . 0.0 109.044 -177.421 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -84.6 72.89 10.63 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 122.59 1.186 . . . . 0.0 108.129 176.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -106.24 143.65 27.37 Favored Pre-proline 0 N--CA 1.429 -1.491 0 CA-C-N 114.062 -1.427 . . . . 0.0 108.269 -175.456 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -87.38 -165.17 0.22 Allowed 'Trans proline' 0 N--CA 1.438 -1.788 0 C-N-CA 121.826 1.684 . . . . 0.0 110.107 175.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -87.17 -25.39 24.09 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-O 121.088 0.47 . . . . 0.0 111.323 -178.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -148.29 105.83 3.67 Favored 'General case' 0 CA--C 1.49 -1.341 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -176.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 12.5 t -141.62 13.75 2.13 Favored 'General case' 0 C--N 1.283 -2.304 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 171.293 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 . . . . . 0 N--CA 1.43 -1.454 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 -178.63 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.59 0 N-CA-C 110.549 -1.021 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 12.0 p -79.06 -18.86 52.68 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 117.32 0.56 . . . . 0.0 112.079 -178.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 30.3 m -78.81 128.63 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.771 0 CA-C-O 122.062 0.934 . . . . 0.0 113.01 -178.494 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -151.24 83.04 1.31 Allowed 'General case' 0 C--N 1.291 -1.975 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 174.002 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -78.47 81.73 4.79 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-O 122.159 0.98 . . . . 0.0 111.987 -174.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 2.7 m -120.15 85.04 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.282 -2.346 0 CA-C-N 113.836 -1.529 . . . . 0.0 107.182 171.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 128' ' ' TYR . . . . . 0.489 ' O ' ' HD3' ' B' ' 130' ' ' PRO . 36.8 t80 -98.3 95.62 7.5 Favored 'General case' 0 N--CA 1.41 -2.451 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.622 -175.23 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -97.81 101.88 11.87 Favored Pre-proline 0 C--N 1.3 -1.58 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.231 173.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 130' ' ' PRO . . . . . 0.489 ' HD3' ' O ' ' B' ' 128' ' ' TYR . 2.7 Cg_exo -74.05 146.9 37.59 Favored 'Trans proline' 0 C--O 1.251 1.16 0 C-N-CA 121.721 1.614 . . . . 0.0 109.544 175.748 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 131' ' ' ASN . . . . . 0.475 ' ND2' HG13 ' A' ' 114' ' ' VAL . 4.3 p-10 -79.35 145.45 33.42 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.63 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -95.84 -58.13 2.18 Favored 'General case' 0 C--N 1.291 -1.959 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -179.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 133' ' ' THR . . . . . 0.498 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 6.3 p 56.06 17.43 2.66 Favored 'General case' 0 C--O 1.213 -0.864 0 C-N-CA 125.884 1.673 . . . . 0.0 113.392 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 134' ' ' HIS . . . . . 0.502 ' O ' ' HG ' ' B' ' 138' ' ' LEU . 64.4 m-70 67.46 25.04 8.62 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.955 1.302 . . . . 0.0 109.373 -179.23 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -37.44 -63.67 0.43 Allowed 'General case' 0 C--O 1.205 -1.253 0 C-N-CA 126.279 1.832 . . . . 0.0 113.907 -174.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -61.96 -33.55 74.49 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -170.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 88.0 mt -70.47 -47.25 61.48 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 122.052 0.929 . . . . 0.0 108.775 176.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 138' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' B' ' 134' ' ' HIS . 62.5 mt -67.79 -41.18 83.58 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 114.387 -1.279 . . . . 0.0 111.763 -176.658 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -75.44 -19.73 59.29 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.216 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 17.3 tppt? -72.6 -38.89 67.68 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 173.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 45.2 m -66.81 -35.45 80.09 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.404 174.414 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.555 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 24.6 tt0 -62.68 -54.08 44.81 Favored 'General case' 0 C--O 1.205 -1.24 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.245 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.56 -35.92 66.25 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 123.19 0.596 . . . . 0.0 111.226 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 144' ' ' GLN . . . . . 0.418 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 8.8 tp60 -70.97 -47.85 56.65 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.952 176.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -65.07 -35.41 81.07 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 122.45 0.3 . . . . 0.0 111.66 -178.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 146' ' ' LYS . . . . . 0.555 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 82.6 mttt -60.88 -46.18 91.63 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 177.009 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -62.53 -35.52 79.67 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.082 -177.345 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 148' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 43.7 mm-40 -88.86 -6.43 57.33 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-N 114.592 -1.185 . . . . 0.0 112.41 -174.173 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 149' ' ' LYS . . . . . 0.564 ' O ' ' HB2' ' B' ' 154' ' ' SER . 35.4 mmtp 53.61 54.35 10.13 Favored 'General case' 0 CA--C 1.512 -0.497 0 O-C-N 123.964 0.79 . . . . 0.0 110.927 -178.593 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 95.6 mt -82.92 114.76 21.43 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.783 -179.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 51.31 -93.28 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.475 1.51 . . . . 0.0 114.734 176.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 12.1 mt -64.38 -36.19 76.47 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.851 0 C-N-CA 122.605 0.362 . . . . 0.0 111.748 -179.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 153' ' ' TRP . . . . . 0.406 ' CH2' ' HG2' ' A' ' 110' ' ' LYS . 60.3 m95 -67.97 -23.14 65.01 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.043 0.449 . . . . 0.0 110.363 -179.284 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 154' ' ' SER . . . . . 0.564 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 10.1 t -85.79 42.98 1.0 Allowed 'General case' 0 N--CA 1.442 -0.871 0 CA-C-O 122.116 0.96 . . . . 0.0 108.792 179.227 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -74.22 -22.66 59.26 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 114.684 -1.143 . . . . 0.0 108.41 172.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 19.5 t70 . . . . . 0 N--CA 1.432 -1.355 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 175.305 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.575 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 73.1 p 60.33 1.86 0.41 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 126.453 1.901 . . . . 0.0 115.978 175.454 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.464 ' HA ' ' CE1' ' A' ' 8' ' ' HIS . 73.0 m 45.21 68.58 0.55 Allowed 'General case' 0 C--O 1.237 0.397 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.9 t -110.06 176.01 5.22 Favored 'General case' 0 N--CA 1.419 -2.005 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 176.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.8 mttt 71.08 -83.57 0.03 OUTLIER 'General case' 0 C--O 1.238 0.461 0 C-N-CA 125.298 1.439 . . . . 0.0 110.558 -177.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -121.69 -161.8 0.94 Allowed 'General case' 0 N--CA 1.426 -1.67 0 C-N-CA 123.847 0.859 . . . . 0.0 109.802 -176.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.533 HD22 ' HA ' ' A' ' 77' ' ' ASP . 49.5 mt -97.7 151.03 20.55 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 179.368 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.464 ' CE1' ' HA ' ' A' ' 3' ' ' SER . 23.0 m170 -104.87 131.0 52.9 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -177.059 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.421 ' HA ' ' O ' ' A' ' 74' ' ' VAL . 36.6 ttmt -121.01 135.16 55.28 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 114.377 -1.283 . . . . 0.0 109.094 -179.122 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -138.95 157.35 71.71 Favored Pre-proline 0 C--N 1.296 -1.735 0 C-N-CA 122.504 0.322 . . . . 0.0 110.848 177.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -71.18 148.09 55.24 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 122.358 2.039 . . . . 0.0 112.75 -178.665 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.24 161.51 37.25 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.951 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.433 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 20.4 m -109.78 145.36 36.81 Favored 'General case' 0 C--N 1.293 -1.891 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 176.276 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.7 tp -83.95 134.98 34.64 Favored 'General case' 0 C--N 1.295 -1.769 0 C-N-CA 120.089 -0.645 . . . . 0.0 109.752 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 41.3 mm -91.79 -57.58 4.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 171.09 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -168.84 141.73 2.82 Favored 'General case' 0 N--CA 1.416 -2.171 0 CA-C-N 115.164 -0.925 . . . . 0.0 108.899 178.145 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.484 ' HA ' HG23 ' A' ' 23' ' ' VAL . . . -99.93 110.1 22.44 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 171.603 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.6 mp -89.54 -53.79 8.74 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-O 121.376 0.608 . . . . 0.0 110.034 -174.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -129.99 169.08 15.72 Favored 'General case' 0 C--N 1.291 -1.947 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -175.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.31 -29.48 73.27 Favored Glycine 0 C--N 1.306 -1.104 0 O-C-N 123.987 0.805 . . . . 0.0 111.775 178.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.575 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 2.3 m-20 -96.99 -46.99 5.98 Favored 'General case' 0 CA--C 1.492 -1.274 0 CA-C-O 120.952 0.406 . . . . 0.0 110.866 177.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.6 m -96.72 113.33 24.87 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-O 121.472 0.653 . . . . 0.0 111.84 -171.434 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.484 HG23 ' HA ' ' A' ' 17' ' ' ALA . 5.8 p -135.07 144.76 33.56 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.182 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.109 -177.44 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -106.98 123.01 47.57 Favored 'General case' 0 CA--C 1.49 -1.353 0 O-C-N 121.63 -0.669 . . . . 0.0 111.524 -179.515 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.9 mp -125.82 151.03 47.34 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.987 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.497 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 25.9 ttt -117.52 106.26 12.96 Favored 'General case' 0 C--N 1.289 -2.054 0 CA-C-N 114.911 -1.041 . . . . 0.0 108.871 -178.624 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -113.39 123.66 50.6 Favored 'General case' 0 C--N 1.287 -2.131 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 96.4 mttt 58.79 27.73 16.43 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 123.399 0.679 . . . . 0.0 111.803 177.607 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.444 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 93.82 6.6 61.99 Favored Glycine 0 N--CA 1.44 -1.062 0 C-N-CA 120.83 -0.7 . . . . 0.0 113.104 179.385 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.497 ' O ' ' HA ' ' A' ' 26' ' ' MET . 17.9 mm-40 -107.3 98.37 22.64 Favored Pre-proline 0 C--N 1.318 -0.775 0 CA-C-N 116.85 0.325 . . . . 0.0 110.562 178.581 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 6.0 Cg_exo -80.76 97.16 1.0 Allowed 'Trans proline' 0 C--O 1.243 0.742 0 C-N-CA 122.98 2.453 . . . . 0.0 110.565 174.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 49.8 ttm -112.87 145.62 40.37 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.387 -176.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 32.1 m -82.16 120.08 24.87 Favored 'General case' 0 N--CA 1.42 -1.957 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 174.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.431 ' HA ' ' O ' ' A' ' 88' ' ' GLY . 74.9 m-85 -114.38 154.2 28.51 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-O 121.399 0.619 . . . . 0.0 111.682 -177.069 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.575 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 37.8 mtp180 -118.23 148.09 42.75 Favored 'General case' 0 C--N 1.288 -2.109 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.058 164.079 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.419 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 5.2 mp -77.66 123.32 26.5 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.668 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 68.1 mt -63.94 142.04 58.55 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.432 176.11 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.637 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 67.3 mt 72.65 10.56 5.59 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.336 1.055 . . . . 0.0 112.503 177.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 97.5 t -113.49 140.85 31.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.223 0.535 . . . . 0.0 111.979 -176.598 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.4 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 17.8 t70 -135.1 107.52 7.31 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 172.268 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.402 ' N ' ' HD2' ' A' ' 42' ' ' PRO . 82.3 p -109.43 -11.04 0.12 Allowed Pre-proline 0 CA--C 1.571 1.772 0 N-CA-C 116.555 2.058 . . . . 0.0 116.555 179.29 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.402 ' HD2' ' N ' ' A' ' 41' ' ' THR . 37.7 Cg_endo -62.27 152.91 73.57 Favored 'Trans proline' 0 C--N 1.403 3.401 0 CA-C-N 122.941 2.086 . . . . 0.0 111.445 -175.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.566 ' OE2' ' HG2' ' A' ' 53' ' ' LYS . 7.9 tp10 -48.35 127.44 12.95 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 124.404 1.065 . . . . 0.0 110.859 -177.433 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.5 t -50.15 -66.62 0.36 Allowed 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -163.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.474 ' HB2' ' HE2' ' A' ' 48' ' ' LYS . 2.2 mptp? -96.97 -0.12 47.96 Favored 'General case' 0 CA--C 1.496 -1.109 0 C-N-CA 120.107 -0.637 . . . . 0.0 110.147 177.444 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 29.1 m-70 80.1 131.94 0.04 OUTLIER Pre-proline 0 N--CA 1.472 0.644 0 C-N-CA 124.707 1.203 . . . . 0.0 108.52 -170.557 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -37.84 119.84 0.35 Allowed 'Trans proline' 0 N--CA 1.492 1.41 1 C-N-CA 125.578 4.185 . . . . 0.0 118.935 -166.147 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.474 ' HE2' ' HB2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -113.38 -39.47 4.11 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 167.307 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -91.93 -37.04 13.11 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 176.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 138.72 -47.93 0.9 Allowed Glycine 0 N--CA 1.431 -1.669 0 N-CA-C 108.097 -2.001 . . . . 0.0 108.097 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -141.3 104.94 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.41 -2.467 0 C-N-CA 124.903 1.281 . . . . 0.0 109.139 174.341 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -91.48 -56.88 2.96 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.347 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.584 ' HE2' HG12 ' B' ' 152' ' ' ILE . 11.6 ptmm? -87.17 -14.72 40.4 Favored 'General case' 0 CA--C 1.499 -1.016 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 176.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 76.78 86.05 0.08 Allowed 'General case' 0 C--O 1.244 0.772 0 C-N-CA 124.572 1.149 . . . . 0.0 111.049 179.289 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -58.22 -58.71 13.14 Favored Glycine 0 CA--C 1.537 1.423 0 CA-C-N 114.868 -1.06 . . . . 0.0 112.611 175.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -53.89 -34.98 78.33 Favored 'Trans proline' 0 C--N 1.368 1.601 0 C-N-CA 123.256 2.637 . . . . 0.0 113.764 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -66.4 -38.3 87.19 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.29 0.567 . . . . 0.0 109.628 -179.317 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.92 -48.44 63.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.871 177.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.453 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 19.1 m -57.71 -39.61 77.62 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.024 179.179 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.03 -34.88 78.51 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.142 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -69.63 -41.93 74.98 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 -177.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.463 ' O ' HG22 ' A' ' 66' ' ' VAL . 28.8 m -59.4 -47.99 83.33 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 175.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 59' ' ' SER . 60.8 mtpt -55.23 -51.89 65.14 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.682 178.414 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -64.22 -34.17 77.47 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -177.215 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 20.1 mmt -70.36 -47.93 58.7 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.659 177.031 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.463 HG22 ' O ' ' A' ' 62' ' ' THR . 33.9 m -75.18 -36.53 37.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -176.573 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -75.28 -23.94 57.49 Favored 'General case' 0 C--O 1.24 0.583 0 O-C-N 122.111 -0.368 . . . . 0.0 111.904 -179.658 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -78.98 -40.32 31.99 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.057 175.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -56.27 132.66 51.36 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 123.688 0.795 . . . . 0.0 112.329 -177.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -75.02 -50.33 16.87 Favored 'General case' 0 CA--C 1.501 -0.937 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 175.145 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -104.3 119.91 40.02 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.954 -178.497 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 69.4 mt -102.3 128.94 54.5 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.664 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 175.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.55 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 23.2 mt-10 -122.5 139.16 54.2 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 120.504 0.192 . . . . 0.0 110.758 -176.201 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.421 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 18.1 m -113.73 128.69 70.5 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 175.062 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -122.62 115.71 22.59 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.0 p90 -91.56 124.89 36.06 Favored 'General case' 0 N--CA 1.417 -2.12 0 CA-C-O 121.409 0.623 . . . . 0.0 111.323 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.533 ' HA ' HD22 ' A' ' 7' ' ' LEU . 17.1 t70 -91.67 176.8 6.41 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.255 -176.025 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.438 ' H ' ' HG2' ' A' ' 78' ' ' LYS . 18.0 pttm -82.14 -5.65 58.6 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 126.56 1.944 . . . . 0.0 112.109 -177.461 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -81.77 -138.45 2.63 Favored Glycine 0 C--O 1.246 0.87 0 C-N-CA 120.584 -0.817 . . . . 0.0 111.468 176.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -74.22 120.84 20.34 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 176.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -108.56 -8.18 15.56 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 121.82 0.819 . . . . 0.0 109.141 -176.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 10.0 p -139.79 141.11 36.79 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 114.986 -1.007 . . . . 0.0 110.331 179.317 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.528 ' HB3' ' HB2' ' A' ' 87' ' ' ARG . 22.2 t70 -102.91 134.14 46.83 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 104.823 -2.288 . . . . 0.0 104.823 171.673 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -60.4 -16.32 34.52 Favored 'General case' 0 CA--C 1.557 1.237 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -169.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -68.39 -22.06 64.66 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.33 0.586 . . . . 0.0 110.157 175.557 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 105.67 56.31 0.68 Allowed Glycine 0 N--CA 1.436 -1.339 0 N-CA-C 110.462 -1.055 . . . . 0.0 110.462 -176.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ARG . . . . . 0.528 ' HB2' ' HB3' ' A' ' 83' ' ' ASP . 32.1 mtm180 -135.86 150.54 49.42 Favored 'General case' 0 CA--C 1.484 -1.568 0 C-N-CA 123.871 0.869 . . . . 0.0 109.639 178.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLY . . . . . 0.431 ' O ' ' HA ' ' A' ' 34' ' ' PHE . . . -93.42 149.72 19.58 Favored Glycine 0 N--CA 1.42 -2.373 0 N-CA-C 109.29 -1.524 . . . . 0.0 109.29 176.182 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 89.3 mt -123.52 120.35 32.64 Favored 'General case' 0 C--N 1.287 -2.116 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 179.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -149.98 167.44 26.69 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 120.832 0.349 . . . . 0.0 110.489 -176.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.505 ' CZ ' ' HB2' ' A' ' 100' ' ' ASN . 5.4 t80 -94.25 133.02 38.22 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 105.618 -1.993 . . . . 0.0 105.618 174.383 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 44.4 mm -103.32 125.39 57.82 Favored 'Isoleucine or valine' 0 C--O 1.249 1.064 0 CA-C-O 120.919 0.39 . . . . 0.0 110.315 -175.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.55 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 61.8 m-85 -109.63 133.16 53.43 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 177.088 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.53 103.44 12.96 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -178.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.8 t70 46.98 40.46 9.38 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 125.69 1.596 . . . . 0.0 111.944 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.54 -25.0 24.38 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 115.034 -0.985 . . . . 0.0 113.584 177.407 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -97.09 160.46 14.33 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 117.081 0.44 . . . . 0.0 110.682 -176.414 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' MET . . . . . 0.49 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 3.8 mpp? -92.47 116.18 28.75 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -174.371 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 49.1 t -73.05 -46.8 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 120.817 0.342 . . . . 0.0 110.697 -178.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.505 ' HB2' ' CZ ' ' A' ' 91' ' ' TYR . 1.4 m-20 -54.43 -50.92 66.49 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.025 -0.988 . . . . 0.0 112.25 -173.474 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.488 ' HB3' HD22 ' B' ' 138' ' ' LEU . 9.8 pt-20 -75.22 -27.34 59.51 Favored 'General case' 0 N--CA 1.426 -1.646 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -179.873 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.87 -39.78 95.5 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.038 0.447 . . . . 0.0 110.131 176.351 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 82.8 mt -56.72 -45.91 81.63 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.5 175.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 46.7 t -73.14 -35.4 47.54 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.109 -178.661 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 13.2 mmm180 -55.92 -41.47 74.61 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.983 0.913 . . . . 0.0 111.862 176.32 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -87.17 1.42 53.1 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.041 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.514 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 70.22 37.33 71.66 Favored Glycine 0 C--O 1.222 -0.595 0 C-N-CA 121.536 -0.364 . . . . 0.0 112.631 179.087 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 83.6 mt -106.61 -8.85 16.78 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-O 121.01 0.433 . . . . 0.0 110.733 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -147.47 154.28 40.59 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.279 -178.19 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.4 ' HB2' ' HB3' ' A' ' 40' ' ' ASP . 94.9 mttt -105.3 166.23 10.56 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.601 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.411 HG12 ' OE2' ' B' ' 142' ' ' GLU . 7.3 p -86.99 122.61 39.12 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 CA-C-O 121.762 0.791 . . . . 0.0 110.914 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.637 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . -94.34 120.95 35.35 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 107.135 -1.431 . . . . 0.0 107.135 174.194 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -83.55 112.38 19.94 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-O 121.554 0.692 . . . . 0.0 111.993 -177.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 86.4 t -88.1 126.15 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.149 0 CA-C-N 114.861 -1.063 . . . . 0.0 108.445 -179.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.526 ' HA ' ' HA ' ' B' ' 130' ' ' PRO . 37.3 p90 -95.18 151.15 19.47 Favored 'General case' 0 C--N 1.282 -2.336 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.141 -177.789 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -78.07 126.26 83.96 Favored Pre-proline 0 N--CA 1.423 -1.813 0 N-CA-C 105.407 -2.071 . . . . 0.0 105.407 172.364 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -77.18 -176.94 3.47 Favored 'Trans proline' 0 N--CA 1.441 -1.597 0 C-N-CA 122.013 1.808 . . . . 0.0 114.978 -166.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -101.15 106.9 18.19 Favored 'General case' 0 N--CA 1.412 -2.36 0 CA-C-N 113.496 -1.683 . . . . 0.0 106.613 -175.079 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -116.52 96.41 5.5 Favored 'General case' 0 C--N 1.282 -2.345 0 CA-C-N 114.96 -1.018 . . . . 0.0 108.728 -175.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 19.5 m 86.18 -33.86 0.04 OUTLIER 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 113.349 -1.75 . . . . 0.0 112.406 172.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 . . . . . 0 C--O 1.243 0.72 0 C-N-CA 123.939 0.896 . . . . 0.0 110.021 179.071 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.853 0 N-CA-C 110.736 -0.945 . . . . 0.0 110.736 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 27.2 m 62.03 -159.38 0.32 Allowed 'General case' 0 C--O 1.246 0.883 0 C-N-CA 123.635 0.774 . . . . 0.0 110.19 -179.316 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 27.0 m -84.24 10.09 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -179.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -78.01 83.65 4.31 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 176.174 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.8 p90 -86.64 -49.11 7.75 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.752 -174.382 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 127' ' ' VAL . . . . . 0.52 HG11 ' HB2' ' A' ' 115' ' ' TYR . 70.3 t 66.4 133.1 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 O-C-N 124.16 0.912 . . . . 0.0 111.764 -176.522 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -76.3 -60.89 2.14 Favored 'General case' 0 C--N 1.311 -1.101 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.214 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -157.85 171.32 7.59 Favored Pre-proline 0 C--N 1.307 -1.261 0 N-CA-C 107.489 -1.301 . . . . 0.0 107.489 -177.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 130' ' ' PRO . . . . . 0.526 ' HA ' ' HA ' ' A' ' 115' ' ' TYR . 35.2 Cg_exo -66.02 168.85 14.59 Favored 'Trans proline' 0 C--O 1.245 0.855 0 C-N-CA 122.173 1.915 . . . . 0.0 111.809 174.424 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 131' ' ' ASN . . . . . 0.411 ' HB2' ' OD2' ' A' ' 77' ' ' ASP . 31.4 p-10 -66.87 -42.74 85.12 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 177.238 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.585 ' HA ' ' HB3' ' B' ' 135' ' ' GLU . 29.0 t-20 73.31 4.97 4.98 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 124.81 1.244 . . . . 0.0 113.761 168.163 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 7.1 t -49.06 -53.8 18.71 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 113.585 0.958 . . . . 0.0 113.585 -176.315 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 134' ' ' HIS . . . . . 0.432 ' O ' HD23 ' B' ' 138' ' ' LEU . 11.2 m-70 -135.05 19.99 3.45 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 176.473 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.585 ' HB3' ' HA ' ' B' ' 132' ' ' ASN . 2.3 tm-20 -57.61 -42.59 83.59 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.451 -1.25 . . . . 0.0 112.459 -172.789 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -69.81 -42.59 73.49 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-O 121.466 0.651 . . . . 0.0 109.449 -178.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 95.3 mt -60.95 -45.56 94.22 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.317 178.175 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 138' ' ' LEU . . . . . 0.488 HD22 ' HB3' ' A' ' 101' ' ' GLU . 4.3 mm? -60.38 -47.41 86.17 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.743 176.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 139' ' ' ARG . . . . . 0.464 ' HD2' ' OE2' ' B' ' 135' ' ' GLU . 53.3 mtt180 -62.62 -41.08 98.8 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 178.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -64.48 -35.47 81.05 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.553 176.49 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 30.7 m -68.35 -41.9 80.04 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.228 177.372 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.525 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 38.5 tt0 -64.56 -50.66 66.42 Favored 'General case' 0 CA--C 1.495 -1.162 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.146 179.513 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 143' ' ' ALA . . . . . 0.519 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -56.64 -39.22 73.3 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.857 0.723 . . . . 0.0 110.896 -179.097 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 144' ' ' GLN . . . . . 0.485 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 35.4 tt0 -65.1 -47.67 76.39 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.689 178.239 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -63.62 -33.48 75.71 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.02 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 146' ' ' LYS . . . . . 0.545 ' HA ' ' CG ' ' B' ' 153' ' ' TRP . 79.8 mttt -62.4 -45.76 91.68 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.216 177.226 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 147' ' ' LYS . . . . . 0.519 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 34.7 mmtp -66.71 -44.97 80.19 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.602 -178.418 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 148' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 22.5 mm-40 -75.43 -10.21 59.25 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.323 -176.722 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp 58.26 48.94 11.88 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.013 0.925 . . . . 0.0 110.588 -178.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 150' ' ' LEU . . . . . 0.425 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 95.7 mt -86.02 115.39 23.59 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.277 -177.033 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 151' ' ' ASN . . . . . 0.514 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 40.3 m-80 53.67 -81.47 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 126.107 1.763 . . . . 0.0 113.019 178.248 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 152' ' ' ILE . . . . . 0.584 HG12 ' HE2' ' A' ' 53' ' ' LYS . 67.3 mt -56.85 -60.35 2.08 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.328 0 C-N-CA 124.183 0.993 . . . . 0.0 110.426 -178.29 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 153' ' ' TRP . . . . . 0.545 ' CG ' ' HA ' ' B' ' 146' ' ' LYS . 62.4 m95 -71.62 -7.83 50.26 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 114.291 -1.322 . . . . 0.0 113.414 -166.683 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 27.1 t -74.93 -0.67 19.42 Favored 'General case' 0 CA--C 1.567 1.633 0 CA-C-O 121.134 0.492 . . . . 0.0 109.808 174.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -64.39 -17.64 63.94 Favored 'General case' 0 C--O 1.25 1.1 0 C-N-CA 124.757 1.223 . . . . 0.0 111.023 173.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 N--CA 1.445 -0.689 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.146 -178.117 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.25 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.6 t -154.33 136.48 14.78 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.7 m -81.3 109.24 15.62 Favored 'General case' 0 N--CA 1.427 -1.593 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.6 m -138.97 96.91 3.2 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-O 121.44 0.638 . . . . 0.0 110.362 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -146.86 -43.29 0.18 Allowed 'General case' 0 C--N 1.298 -1.657 0 CA-C-N 114.922 -1.035 . . . . 0.0 110.263 177.24 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -70.07 -47.12 63.28 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -177.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.686 HD11 ' HE2' ' B' ' 134' ' ' HIS . 63.1 mt -136.21 -169.97 2.55 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 -177.595 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.563 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 46.3 m-70 -94.81 103.4 15.3 Favored 'General case' 0 C--O 1.212 -0.911 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -113.8 117.68 32.15 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 120.685 0.279 . . . . 0.0 111.239 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -139.01 157.72 70.95 Favored Pre-proline 0 C--N 1.305 -1.344 0 CA-C-O 119.441 -0.314 . . . . 0.0 110.993 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -78.92 147.98 21.76 Favored 'Trans proline' 0 C--O 1.243 0.766 0 C-N-CA 121.998 1.799 . . . . 0.0 111.431 178.2 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -136.13 156.85 48.09 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 178.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.457 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 87.8 m -94.7 132.83 39.02 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.72 -178.836 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.497 ' HB2' HD12 ' A' ' 72' ' ' ILE . 60.7 tp -77.04 127.17 32.2 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 120.578 0.228 . . . . 0.0 111.026 -179.101 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 51.0 mm -98.79 -54.7 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 N-CA-C 107.375 -1.342 . . . . 0.0 107.375 172.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -170.67 157.15 5.56 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.065 179.46 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.423 ' HB2' HG21 ' A' ' 66' ' ' VAL . . . -111.04 120.61 42.94 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 174.675 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.45 ' HB ' ' O ' ' A' ' 22' ' ' THR . 67.0 mt -89.47 -64.12 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -175.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -129.14 -164.46 1.4 Allowed 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -177.272 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -88.64 48.33 3.53 Favored Glycine 0 CA--C 1.507 -0.452 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.334 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.556 ' HB3' HG23 ' A' ' 41' ' ' THR . 1.9 t70 178.5 -61.91 0.01 OUTLIER 'General case' 0 CA--C 1.496 -1.123 0 C-N-CA 125.565 1.546 . . . . 0.0 108.534 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.45 ' O ' ' HB ' ' A' ' 18' ' ' ILE . 24.1 m -76.58 106.71 8.39 Favored 'General case' 0 N--CA 1.404 -2.752 0 CA-C-N 114.094 -1.412 . . . . 0.0 109.995 -174.734 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 24.6 m -131.63 164.54 34.24 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 -179.22 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -121.7 114.27 20.89 Favored 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 118.514 0.597 . . . . 0.0 109.812 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.502 HD21 HG21 ' A' ' 72' ' ' ILE . 7.4 mp -126.32 159.18 33.86 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-O 121.217 0.532 . . . . 0.0 111.517 177.832 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.457 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 57.5 ttp -114.77 117.08 29.77 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.523 179.252 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.5 p90 -122.91 131.65 53.83 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.181 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 54.2 mttp 55.97 27.44 11.21 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.7 0.8 . . . . 0.0 112.514 -176.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 88.97 3.84 75.91 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 121.077 -0.582 . . . . 0.0 112.89 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.414 ' O ' ' HA ' ' A' ' 26' ' ' MET . 14.7 mm100 -106.29 104.96 52.52 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 116.842 0.321 . . . . 0.0 110.744 -179.058 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -78.98 107.37 2.23 Favored 'Trans proline' 0 C--O 1.247 0.962 0 C-N-CA 122.696 2.264 . . . . 0.0 110.264 175.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 65.5 mtt -127.32 154.13 45.32 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-O 121.137 0.494 . . . . 0.0 110.783 -177.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.9 m -81.2 136.62 35.87 Favored 'General case' 0 N--CA 1.42 -1.947 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 175.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.455 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 39.2 m-85 -105.05 149.05 26.13 Favored 'General case' 0 C--N 1.277 -2.568 0 CA-C-O 121.319 0.58 . . . . 0.0 112.257 -178.125 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.536 HH12 ' HA ' ' A' ' 40' ' ' ASP . 12.7 tpt85 -130.63 119.21 22.12 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 104.285 -2.487 . . . . 0.0 104.285 176.679 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.424 ' CD2' HG12 ' A' ' 92' ' ' ILE . 26.5 mt -83.98 137.76 33.46 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-O 122.142 0.972 . . . . 0.0 112.437 -169.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.487 HD21 ' HB3' ' A' ' 89' ' ' LEU . 98.5 mt -73.38 130.8 40.94 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 114.646 -1.161 . . . . 0.0 110.205 178.449 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.507 HD12 ' OH ' ' A' ' 91' ' ' TYR . 87.3 mt 73.78 7.41 4.95 Favored 'General case' 0 C--O 1.212 -0.869 0 C-N-CA 124.464 1.106 . . . . 0.0 113.438 176.106 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.7 t -125.01 125.66 69.9 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.716 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 175.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.536 ' HA ' HH12 ' A' ' 35' ' ' ARG . 11.0 t70 -105.58 140.68 38.29 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 179.405 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.556 HG23 ' HB3' ' A' ' 21' ' ' ASP . 1.0 OUTLIER -71.73 121.67 85.12 Favored Pre-proline 0 N--CA 1.425 -1.693 0 O-C-N 124.254 0.971 . . . . 0.0 110.399 -171.387 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -61.61 -54.87 1.38 Allowed 'Trans proline' 0 C--O 1.259 1.527 0 C-N-CA 122.65 2.233 . . . . 0.0 109.124 178.341 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.431 ' HB2' ' HG3' ' A' ' 45' ' ' LYS . 37.3 mt-10 64.32 168.49 0.17 Allowed 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 125.804 1.642 . . . . 0.0 112.341 178.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.7 t -102.78 66.95 0.96 Allowed 'General case' 0 N--CA 1.397 -3.088 0 N-CA-C 105.295 -2.113 . . . . 0.0 105.295 168.325 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.431 ' HG3' ' HB2' ' A' ' 43' ' ' GLU . 53.7 mttp -49.72 -31.5 11.44 Favored 'General case' 0 N--CA 1.485 1.312 0 CA-C-N 113.797 -1.547 . . . . 0.0 113.618 -174.265 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' HIS . . . . . 0.449 ' HB2' ' HB2' ' A' ' 49' ' ' LYS . 76.7 m-70 -134.44 105.38 11.04 Favored Pre-proline 0 C--N 1.288 -2.086 0 N-CA-C 103.424 -2.806 . . . . 0.0 103.424 171.419 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -36.45 -48.77 1.31 Allowed 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 125.062 3.841 . . . . 0.0 116.762 -171.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -77.15 -24.07 51.61 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.172 0.511 . . . . 0.0 111.24 -178.002 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.449 ' HB2' ' HB2' ' A' ' 46' ' ' HIS . 27.9 mmmt -98.72 -1.09 41.43 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.038 -175.081 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -62.92 -18.7 60.19 Favored Glycine 0 C--N 1.337 0.584 0 CA-C-N 116.215 -0.448 . . . . 0.0 112.525 -178.374 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 41.3 t -67.57 -35.9 74.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 178.65 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.9 mm-40 -74.08 -24.17 59.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.638 0.733 . . . . 0.0 109.619 -177.099 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.8 mmtm -83.58 -15.59 48.56 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.758 -1.11 . . . . 0.0 110.533 177.673 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 65.29 21.64 12.03 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 123.815 0.846 . . . . 0.0 110.229 -176.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -53.6 -50.78 52.13 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-N 114.05 -1.432 . . . . 0.0 113.85 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -50.84 -50.56 13.42 Favored 'Trans proline' 0 C--N 1.37 1.676 0 C-N-CA 122.735 2.29 . . . . 0.0 112.684 176.152 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -63.07 -42.78 99.73 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.22 -45.59 90.93 Favored 'General case' 0 C--O 1.243 0.761 0 CA-C-O 121.066 0.46 . . . . 0.0 111.353 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.45 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 36.1 p -70.17 -41.91 73.17 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.365 -179.115 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.48 -42.1 92.59 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 122.199 0.2 . . . . 0.0 111.046 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -55.47 -43.9 75.97 Favored 'General case' 0 C--O 1.242 0.686 0 C-N-CA 122.715 0.406 . . . . 0.0 109.929 178.052 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.8 m -63.95 -46.3 85.31 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.033 177.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' A' ' 59' ' ' SER . 49.7 mttp -57.39 -54.93 41.28 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.227 -179.582 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.98 -29.69 70.83 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -177.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.574 ' SD ' HG22 ' A' ' 99' ' ' VAL . 49.6 ttm -72.64 -46.12 55.59 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 119.621 -0.831 . . . . 0.0 111.194 179.367 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.423 HG21 ' HB2' ' A' ' 17' ' ' ALA . 33.8 m -73.39 -30.11 29.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 C-N-CA 120.338 -0.545 . . . . 0.0 112.172 -177.862 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -76.02 -23.55 55.18 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 120.549 0.214 . . . . 0.0 111.364 177.396 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -77.53 -31.84 53.61 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.492 0.663 . . . . 0.0 109.829 177.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.746 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -65.89 157.74 29.79 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 114.913 -1.04 . . . . 0.0 112.32 -178.288 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.48 ' N ' ' HD3' ' A' ' 70' ' ' LYS . 2.3 mppt? -110.42 -39.93 4.79 Favored 'General case' 0 C--N 1.291 -1.95 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 175.397 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.6 mtmt -120.75 121.81 39.02 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 114.748 -1.115 . . . . 0.0 108.506 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.502 HG21 HD21 ' A' ' 25' ' ' LEU . 61.0 mt -113.16 135.48 52.52 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.147 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 178.268 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.561 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 33.8 mm-40 -112.45 141.4 46.23 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -179.007 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.3 m -114.75 127.31 72.32 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.076 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 174.083 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.563 ' HA ' ' O ' ' A' ' 8' ' ' HIS . 40.2 tt0 -121.83 117.23 26.01 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.477 -179.494 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.523 ' O ' ' HB3' ' A' ' 7' ' ' LEU . 50.7 m-85 -95.84 143.41 27.08 Favored 'General case' 0 C--O 1.254 1.324 0 C-N-CA 123.781 0.832 . . . . 0.0 109.437 -177.346 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.505 ' HA ' HD22 ' A' ' 7' ' ' LEU . 8.2 t70 -87.98 -174.26 4.62 Favored 'General case' 0 C--O 1.253 1.255 0 CA-C-O 120.96 0.41 . . . . 0.0 111.117 -173.787 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.457 ' HE2' ' HA ' ' A' ' 78' ' ' LYS . 9.3 mmpt? -72.95 -21.06 60.93 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 124.087 0.955 . . . . 0.0 112.618 -170.792 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -99.22 -80.7 1.55 Allowed Glycine 0 C--N 1.314 -0.664 0 C-N-CA 119.303 -1.427 . . . . 0.0 114.882 -170.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -122.69 128.39 50.51 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 122.401 -0.47 . . . . 0.0 110.012 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.424 ' HD2' ' N ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -103.4 -4.67 23.81 Favored 'General case' 0 N--CA 1.427 -1.578 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.219 -173.185 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 21.9 p -136.24 150.65 49.06 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -179.188 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -116.58 153.74 31.7 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-O 120.836 0.35 . . . . 0.0 111.03 -178.391 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -65.45 -16.64 63.85 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.557 1.143 . . . . 0.0 113.634 -175.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -72.15 -12.81 61.36 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 121.206 0.527 . . . . 0.0 110.13 173.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 95.72 35.87 5.49 Favored Glycine 0 N--CA 1.439 -1.112 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -176.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -121.94 165.27 16.22 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 115.289 -0.456 . . . . 0.0 110.481 -176.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -100.44 137.7 13.41 Favored Glycine 0 N--CA 1.434 -1.438 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 174.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.487 ' HB3' HD21 ' A' ' 37' ' ' LEU . 95.3 mt -100.98 107.05 18.42 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 -178.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -154.38 168.06 27.91 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.437 0.637 . . . . 0.0 112.542 -175.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.507 ' OH ' HD12 ' A' ' 38' ' ' LEU . 2.5 m-85 -94.59 134.95 36.61 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.396 -1.274 . . . . 0.0 108.571 170.892 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.424 HG12 ' CD2' ' A' ' 36' ' ' LEU . 47.8 mm -99.89 126.09 53.42 Favored 'Isoleucine or valine' 0 C--O 1.254 1.328 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 175.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.561 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 31.1 m-85 -120.48 131.75 54.88 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 174.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.746 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -106.28 98.49 8.16 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 177.802 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.479 1.1 p30 31.95 57.32 0.34 Allowed 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 116.214 1.931 . . . . 0.0 116.214 -176.617 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 103.84 -21.95 36.83 Favored Glycine 0 N--CA 1.427 -1.925 0 CA-C-N 114.135 -1.393 . . . . 0.0 113.77 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -89.56 123.73 33.9 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -178.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' MET . . . . . 0.499 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 4.5 mpp? -84.32 101.6 12.06 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.255 178.225 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.574 HG22 ' SD ' ' A' ' 65' ' ' MET . 37.9 t -62.87 -46.06 97.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -54.86 -47.81 73.72 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 113.812 -1.54 . . . . 0.0 110.893 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.42 ' HB3' ' HB2' ' A' ' 98' ' ' MET . 13.7 tp10 -62.09 -50.64 71.13 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.734 0.814 . . . . 0.0 109.994 179.27 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.63 -41.14 85.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.582 -0.735 . . . . 0.0 112.192 -176.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 99' ' ' VAL . 95.8 mt -58.4 -46.34 86.6 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-O 120.738 0.304 . . . . 0.0 111.814 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.8 t -73.29 -43.87 56.08 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-O 121.191 0.52 . . . . 0.0 109.99 178.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 21.8 tpt180 -60.95 -40.32 92.87 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.951 -176.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -84.0 -5.45 59.23 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.426 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 68.93 38.68 85.11 Favored Glycine 0 CA--C 1.503 -0.661 0 N-CA-C 111.575 -0.61 . . . . 0.0 111.575 -178.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.8 mt -94.27 -22.07 18.62 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -140.57 174.43 10.52 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 115.284 -0.871 . . . . 0.0 108.842 -177.423 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -111.54 166.08 11.45 Favored 'General case' 0 C--N 1.309 -1.166 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.492 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 73.6 t -83.89 127.07 40.12 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.237 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.076 177.395 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.69 125.68 34.96 Favored 'General case' 0 CA--C 1.496 -1.133 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -71.89 122.57 21.01 Favored 'General case' 0 N--CA 1.428 -1.538 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.969 179.237 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.479 HG11 HD22 ' B' ' 131' ' ' ASN . 13.5 t -88.07 152.27 3.41 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 N-CA-C 106.04 -1.837 . . . . 0.0 106.04 175.832 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -94.19 133.89 37.22 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-O 121.035 0.445 . . . . 0.0 111.414 -168.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 8.6 mptt -103.97 159.17 30.18 Favored Pre-proline 0 C--N 1.31 -1.137 0 CA-C-N 115.398 -0.819 . . . . 0.0 108.956 -178.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.19 -9.17 24.05 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.06 1.84 . . . . 0.0 109.183 173.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -79.65 -1.9 40.3 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 113.781 -1.554 . . . . 0.0 109.642 177.329 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -57.2 -45.41 83.79 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 175.064 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 7.5 t -101.11 -37.31 8.64 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.095 -0.957 . . . . 0.0 108.883 173.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 . . . . . 0 C--N 1.351 0.659 0 C-N-CA 125.08 1.352 . . . . 0.0 110.713 -177.457 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.172 0 N-CA-C 109.354 -1.498 . . . . 0.0 109.354 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 14.1 m -88.84 -18.59 27.31 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 120.996 0.427 . . . . 0.0 111.167 -175.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 42.8 t -92.18 100.05 10.65 Favored 'Isoleucine or valine' 0 C--O 1.244 0.78 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 177.092 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -83.04 55.32 3.06 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.755 0.788 . . . . 0.0 111.046 -178.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -127.66 97.62 4.91 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 178.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 33.6 m -103.52 -29.87 2.9 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 C-N-CA 120.132 -0.627 . . . . 0.0 111.811 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 69.5 t80 55.29 84.91 0.07 Allowed 'General case' 0 C--O 1.246 0.919 0 O-C-N 124.028 0.83 . . . . 0.0 109.946 -170.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.457 ' HA ' ' HD3' ' B' ' 130' ' ' PRO . 83.2 tttt -55.16 122.56 43.43 Favored Pre-proline 0 C--N 1.304 -1.405 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 172.099 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 130' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' B' ' 129' ' ' LYS . 17.2 Cg_exo -63.52 149.18 91.68 Favored 'Trans proline' 0 N--CA 1.449 -1.102 0 C-N-CA 122.305 2.003 . . . . 0.0 113.102 -172.19 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 131' ' ' ASN . . . . . 0.479 HD22 HG11 ' A' ' 114' ' ' VAL . 4.0 t30 -77.23 102.47 6.68 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 104.687 -2.338 . . . . 0.0 104.687 175.824 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -157.71 -72.17 0.09 Allowed 'General case' 0 C--N 1.297 -1.706 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -169.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 133' ' ' THR . . . . . 0.411 ' HB ' ' CD2' ' B' ' 134' ' ' HIS . 3.2 m 44.96 -53.62 0.0 OUTLIER 'General case' 0 CA--C 1.585 2.323 0 C-N-CA 128.67 2.788 . . . . 0.0 117.862 177.552 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 134' ' ' HIS . . . . . 0.686 ' HE2' HD11 ' A' ' 7' ' ' LEU . 3.0 p80 -129.26 20.37 5.78 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 125.029 1.332 . . . . 0.0 111.227 -172.287 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 135' ' ' GLU . . . . . 0.427 ' HA ' ' CD1' ' A' ' 38' ' ' LEU . 36.3 tt0 -58.56 -44.48 89.72 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.37 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -61.47 -34.17 75.01 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.396 -176.315 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 82.9 mt -63.3 -50.97 68.0 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-O 121.126 0.488 . . . . 0.0 110.002 179.28 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 138' ' ' LEU . . . . . 0.41 ' HA ' HD23 ' B' ' 138' ' ' LEU . 24.7 mt -69.92 -34.42 73.45 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 178.729 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 139' ' ' ARG . . . . . 0.417 ' HG2' HG11 ' A' ' 111' ' ' VAL . 15.4 mtp85 -69.23 -31.49 70.09 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 179.03 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -77.26 -22.66 51.78 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.359 0.599 . . . . 0.0 111.138 174.728 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.1 m -76.4 -38.09 56.18 Favored 'General case' 0 N--CA 1.427 -1.605 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 173.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.571 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 36.4 tt0 -60.48 -42.98 97.37 Favored 'General case' 0 C--O 1.209 -1.069 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 173.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.96 -43.37 66.3 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 123.451 0.7 . . . . 0.0 111.452 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 144' ' ' GLN . . . . . 0.496 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 75.3 mt-30 -70.7 -48.36 55.07 Favored 'General case' 0 CA--C 1.497 -1.084 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.154 177.374 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -57.91 -38.85 76.61 Favored 'General case' 0 C--O 1.244 0.777 0 O-C-N 123.945 0.778 . . . . 0.0 112.038 -176.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 146' ' ' LYS . . . . . 0.571 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 89.4 mttt -57.62 -51.72 68.37 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 175.874 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -64.13 -45.15 89.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.109 -178.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 148' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 23.3 mm-40 -64.14 -14.08 52.51 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 124.093 0.957 . . . . 0.0 113.035 -178.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 149' ' ' LYS . . . . . 0.48 ' O ' ' HB2' ' B' ' 154' ' ' SER . 0.0 OUTLIER 62.39 40.95 10.57 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -178.932 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 150' ' ' LEU . . . . . 0.412 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 90.5 mt -76.41 109.7 10.35 Favored 'General case' 0 C--N 1.315 -0.918 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.238 -175.75 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 151' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 2.7 m-20 46.1 -88.3 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.415 1.886 . . . . 0.0 114.224 179.492 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 13.1 tt -68.19 -27.63 37.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 -176.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 153' ' ' TRP . . . . . 0.522 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 63.9 m95 -80.8 -7.25 59.36 Favored 'General case' 0 N--CA 1.435 -1.198 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.545 -178.143 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 154' ' ' SER . . . . . 0.48 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 22.5 t -81.6 13.38 3.14 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 120.985 0.421 . . . . 0.0 110.052 177.058 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -81.96 -20.81 37.8 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 172.682 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 156' ' ' ASP . . . . . 0.475 ' HB3' ' HE2' ' B' ' 149' ' ' LYS . 14.2 t70 . . . . . 0 N--CA 1.443 -0.82 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.27 -176.323 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.603 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.2 t -158.74 143.15 15.75 Favored 'General case' 0 N--CA 1.422 -1.853 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 176.72 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 30.2 t -100.85 119.82 39.22 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 178.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.7 p -88.59 134.51 33.86 Favored 'General case' 0 N--CA 1.421 -1.896 0 C-N-CA 120.336 -0.546 . . . . 0.0 110.116 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 61.1 mttp 65.78 -92.78 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 124.749 1.219 . . . . 0.0 110.547 -177.425 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.441 ' HG2' ' H ' ' A' ' 7' ' ' LEU . 4.1 ttmp? 178.15 176.02 0.49 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 105.213 -2.143 . . . . 0.0 105.213 178.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.441 ' H ' ' HG2' ' A' ' 6' ' ' LYS . 0.7 OUTLIER -109.68 92.43 4.05 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-O 122.307 1.051 . . . . 0.0 113.232 177.635 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -123.81 169.85 11.13 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-N 113.917 -1.492 . . . . 0.0 111.058 173.384 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.432 ' HA ' ' O ' ' A' ' 74' ' ' VAL . 43.1 mtmt -65.29 143.98 57.43 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 124.481 1.113 . . . . 0.0 112.562 -172.186 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -126.86 158.09 69.53 Favored Pre-proline 0 C--N 1.297 -1.71 0 N-CA-C 105.31 -2.107 . . . . 0.0 105.31 167.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -74.34 147.34 36.91 Favored 'Trans proline' 0 C--N 1.322 -0.817 0 C-N-CA 122.163 1.909 . . . . 0.0 112.096 -178.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.01 155.47 47.96 Favored 'General case' 0 N--CA 1.428 -1.566 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.429 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 37.5 m -103.19 123.07 46.02 Favored 'General case' 0 N--CA 1.415 -2.195 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.27 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 49.1 tp -69.29 124.76 24.69 Favored 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.4 mm -88.15 -52.33 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 N-CA-C 107.159 -1.422 . . . . 0.0 107.159 174.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -174.87 161.92 3.1 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 176.154 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -103.55 147.52 27.08 Favored 'General case' 0 C--N 1.285 -2.196 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 174.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.0 mp -107.25 -58.08 3.99 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 N-CA-C 107.359 -1.349 . . . . 0.0 107.359 176.077 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -140.91 173.58 11.34 Favored 'General case' 0 CA--C 1.484 -1.562 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.517 178.592 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -82.91 60.63 4.87 Favored Glycine 0 CA--C 1.5 -0.878 0 N-CA-C 108.449 -1.86 . . . . 0.0 108.449 174.27 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.463 ' HB2' ' HB ' ' A' ' 41' ' ' THR . 7.2 t70 -174.86 -56.98 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 124.691 1.196 . . . . 0.0 108.682 -172.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 34.8 m -119.04 127.78 53.74 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.966 178.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 15.9 m -135.52 167.57 24.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 C-N-CA 124.356 1.062 . . . . 0.0 109.796 -176.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -121.09 117.88 28.32 Favored 'General case' 0 C--N 1.316 -0.856 0 O-C-N 121.852 -0.53 . . . . 0.0 110.044 -177.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.407 ' HB2' ' CD1' ' A' ' 34' ' ' PHE . 7.0 mp -127.92 159.5 34.75 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.473 0.654 . . . . 0.0 111.667 -178.453 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.47 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 57.7 ttp -119.92 111.19 17.63 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 175.047 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.6 p90 -109.91 114.93 28.88 Favored 'General case' 0 C--N 1.293 -1.85 0 C-N-CA 118.709 -1.197 . . . . 0.0 109.962 -177.515 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt 63.28 28.44 15.73 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.736 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.449 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 94.82 2.78 62.67 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 114.868 -1.06 . . . . 0.0 113.072 -178.787 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.47 ' O ' ' HA ' ' A' ' 26' ' ' MET . 1.9 mp0 -99.72 101.97 15.47 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 117.022 0.411 . . . . 0.0 111.488 178.857 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.449 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 4.4 Cg_exo -78.09 113.7 3.46 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.351 2.034 . . . . 0.0 110.828 177.474 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 26.4 mmt -136.25 156.06 49.21 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.954 -178.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.0 m -95.04 112.21 23.94 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 176.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.407 ' CD1' ' HB2' ' A' ' 25' ' ' LEU . 60.2 m-85 -95.85 145.07 25.65 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-O 121.526 0.679 . . . . 0.0 112.129 -174.509 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -123.07 117.75 26.14 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 105.464 -2.05 . . . . 0.0 105.464 176.607 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.401 ' HG ' ' CG1' ' A' ' 92' ' ' ILE . 6.7 mp -60.62 116.14 4.15 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 123.945 0.778 . . . . 0.0 112.219 -174.166 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.402 HD21 ' HB3' ' A' ' 89' ' ' LEU . 74.1 mt -70.19 140.35 52.51 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.571 175.723 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.5 mt 76.54 10.07 2.92 Favored 'General case' 0 C--O 1.217 -0.625 0 C-N-CA 125.534 1.534 . . . . 0.0 110.705 -175.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.48 HG13 ' HB1' ' A' ' 109' ' ' ALA . 53.8 t -126.02 138.21 55.29 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.135 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 176.636 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.409 ' C ' ' HD3' ' A' ' 42' ' ' PRO . 14.5 t70 -148.13 106.58 3.77 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 179.471 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.596 ' N ' ' HD3' ' A' ' 42' ' ' PRO . 3.3 m -127.61 38.55 0.43 Allowed Pre-proline 0 CA--C 1.598 2.821 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 175.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.596 ' HD3' ' N ' ' A' ' 41' ' ' THR . 4.0 Cg_endo -89.76 77.12 1.03 Allowed 'Trans proline' 0 C--N 1.375 1.956 0 C-N-CA 121.829 1.686 . . . . 0.0 111.976 -179.597 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -129.9 127.86 41.0 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 174.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 22.4 m -65.37 113.01 3.78 Favored 'General case' 0 N--CA 1.429 -1.521 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 178.068 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.561 ' O ' ' HD2' ' A' ' 47' ' ' PRO . 56.9 mttp -66.88 -44.46 80.83 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.845 -173.51 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . 0.358 97.9 m-70 85.53 -83.12 0.0 OUTLIER Pre-proline 0 CA--C 1.555 1.149 0 C-N-CA 126.271 1.828 . . . . 0.0 112.381 -177.436 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.561 ' HD2' ' O ' ' A' ' 45' ' ' LYS . 72.5 Cg_endo -81.06 173.82 11.49 Favored 'Trans proline' 0 C--N 1.366 1.473 0 CA-C-N 122.306 1.859 . . . . 0.0 109.696 172.544 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -118.62 -37.52 3.27 Favored 'General case' 0 C--N 1.294 -1.812 0 CA-C-O 121.193 0.52 . . . . 0.0 110.273 178.02 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -83.83 -6.07 59.34 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.647 -174.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -151.38 85.02 0.15 Allowed Glycine 0 C--N 1.305 -1.157 0 C-N-CA 120.116 -1.04 . . . . 0.0 112.383 -178.544 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 59.5 t -124.91 113.25 35.07 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.221 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -61.41 -29.94 70.25 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.564 0.746 . . . . 0.0 112.526 -176.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.2 ptpt -86.23 -12.72 48.9 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 69.48 30.39 4.08 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 175.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -47.46 -50.94 17.19 Favored Glycine 0 CA--C 1.55 2.266 0 CA-C-N 115.047 -0.979 . . . . 0.0 114.429 176.431 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -64.83 -25.85 60.16 Favored 'Trans proline' 0 C--N 1.373 1.82 0 CA-C-N 120.488 2.144 . . . . 0.0 112.379 178.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -80.06 -28.15 39.26 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.581 -177.596 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.19 -48.06 81.71 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 174.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.408 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 14.6 m -62.84 -34.54 77.56 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.21 177.767 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.46 -46.9 81.11 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.893 0.378 . . . . 0.0 110.056 177.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -60.82 -41.63 96.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.913 177.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.514 ' O ' HG22 ' A' ' 66' ' ' VAL . 54.2 m -58.38 -48.63 79.99 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.127 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 59' ' ' SER . 56.2 mtpt -56.37 -51.84 66.82 Favored 'General case' 0 CA--C 1.509 -0.61 0 O-C-N 123.601 0.563 . . . . 0.0 110.734 178.641 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -58.74 -39.76 81.84 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.213 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 13.2 tpt -69.9 -47.73 61.37 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.663 -179.002 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 62' ' ' THR . 35.8 m -77.85 -34.68 19.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 -175.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -76.47 -19.49 57.97 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-O 121.027 0.442 . . . . 0.0 110.693 -179.706 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -89.93 -10.02 46.69 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.287 176.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -78.8 133.68 37.04 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 120.904 0.383 . . . . 0.0 111.767 -175.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -73.31 -34.13 65.55 Favored 'General case' 0 CA--C 1.502 -0.874 0 CA-C-O 121.439 0.637 . . . . 0.0 111.219 176.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -131.66 123.1 27.11 Favored 'General case' 0 C--N 1.292 -1.899 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 4.4 mp -101.71 121.54 52.79 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.314 0 N-CA-C 104.983 -2.228 . . . . 0.0 104.983 173.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.557 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 24.4 mt-10 -119.08 145.51 45.85 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-O 120.793 0.33 . . . . 0.0 110.904 -173.244 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.432 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 11.0 m -120.96 133.39 67.77 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.759 179.119 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -135.64 134.42 39.23 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.555 ' HB3' ' HG2' ' A' ' 81' ' ' ARG . 89.9 m-85 -95.28 148.03 22.85 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.469 -175.263 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -85.81 163.71 17.99 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 -179.591 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.437 ' HG3' ' HB2' ' B' ' 131' ' ' ASN . 19.8 ptmt -73.1 -6.05 43.12 Favored 'General case' 0 C--O 1.246 0.887 0 C-N-CA 123.167 0.587 . . . . 0.0 111.955 -178.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -96.44 -99.28 1.89 Allowed Glycine 0 N--CA 1.433 -1.542 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 175.313 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 19.5 mp0 -93.52 134.93 35.27 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 121.041 0.448 . . . . 0.0 111.125 -176.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.555 ' HG2' ' HB3' ' A' ' 76' ' ' PHE . 55.8 mtt180 -111.67 -27.61 8.46 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.922 175.819 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 16.2 p -140.25 133.91 30.31 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.568 -176.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -97.86 146.41 25.46 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 176.479 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -68.0 -13.19 61.99 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -176.123 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -87.76 -0.85 57.48 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 178.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 89.85 54.81 2.12 Favored Glycine 0 N--CA 1.427 -1.92 0 C-N-CA 120.43 -0.891 . . . . 0.0 111.547 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -131.14 143.91 50.98 Favored 'General case' 0 C--N 1.307 -1.26 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 176.585 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -90.28 121.52 6.23 Favored Glycine 0 N--CA 1.422 -2.254 0 N-CA-C 108.172 -1.971 . . . . 0.0 108.172 173.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.402 ' HB3' HD21 ' A' ' 37' ' ' LEU . 90.4 mt -101.33 107.4 18.74 Favored 'General case' 0 C--N 1.289 -2.023 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 -177.594 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -153.92 167.33 30.09 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.463 -176.248 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.403 ' OH ' ' HB ' ' B' ' 133' ' ' THR . 41.1 m-85 -87.31 142.33 27.97 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 173.581 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.401 ' CG1' ' HG ' ' A' ' 36' ' ' LEU . 50.0 mm -108.31 123.32 63.83 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 178.177 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.557 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 17.4 m-85 -115.44 150.5 36.35 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 177.611 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -120.59 99.93 6.83 Favored 'General case' 0 C--N 1.291 -1.956 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 176.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.315 4.4 p-10 44.08 57.91 3.96 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 125.07 1.348 . . . . 0.0 113.638 -177.303 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.16 -23.34 27.45 Favored Glycine 0 N--CA 1.432 -1.601 0 CA-C-N 114.884 -1.053 . . . . 0.0 114.176 178.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -93.16 123.84 36.72 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -177.189 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' MET . . . . . 0.478 ' HG3' ' CB ' ' A' ' 101' ' ' GLU . 25.7 ptp -79.0 116.38 19.27 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-O 121.971 0.891 . . . . 0.0 111.125 -179.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 56.3 t -65.17 -31.37 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.599 -175.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 25.2 p-10 -65.11 -31.15 72.2 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.871 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.478 ' CB ' ' HG3' ' A' ' 98' ' ' MET . 5.1 tp10 -63.8 -51.47 64.62 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 173.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.46 -45.57 84.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.9 -177.498 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.2 mt -61.66 -41.15 97.13 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.747 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 96.7 t -70.66 -43.18 77.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.749 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 -67.29 -26.63 66.63 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 86.7 mm-40 -93.65 -4.23 51.04 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 120.829 0.347 . . . . 0.0 111.196 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.463 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 66.35 44.13 91.21 Favored Glycine 0 C--O 1.215 -1.082 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.741 -179.051 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 90.9 mt -113.16 7.85 18.05 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-O 121.511 0.672 . . . . 0.0 109.779 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.48 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -159.38 171.04 20.51 Favored 'General case' 0 N--CA 1.427 -1.588 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -179.576 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.563 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 95.3 mttt -120.97 161.47 21.55 Favored 'General case' 0 N--CA 1.424 -1.734 0 N-CA-C 104.921 -2.251 . . . . 0.0 104.921 177.045 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.6 p -76.56 150.73 6.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.701 0 C-N-CA 118.739 -1.184 . . . . 0.0 109.159 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -86.89 126.89 34.97 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 175.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -71.04 107.39 4.09 Favored 'General case' 0 C--N 1.291 -1.944 0 CA-C-N 114.718 -1.128 . . . . 0.0 110.394 -171.044 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.497 HG11 ' HA ' ' B' ' 132' ' ' ASN . 47.7 t -97.0 152.15 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.579 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.138 177.613 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -85.07 133.41 34.23 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 123.414 0.686 . . . . 0.0 111.04 -175.237 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -95.28 159.05 33.68 Favored Pre-proline 0 C--N 1.305 -1.326 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 176.199 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -58.35 -36.85 97.17 Favored 'Trans proline' 0 C--O 1.245 0.873 0 C-N-CA 121.945 1.763 . . . . 0.0 111.324 176.154 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 7.7 t30 71.38 -58.91 0.56 Allowed 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 125.977 1.711 . . . . 0.0 110.188 178.129 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -106.55 -83.05 0.53 Allowed 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 106.014 -1.847 . . . . 0.0 106.014 175.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -168.61 74.87 0.11 Allowed 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 125.144 1.378 . . . . 0.0 108.874 172.649 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 . . . . . 0 C--O 1.246 0.893 0 CA-C-N 113.964 -1.471 . . . . 0.0 109.837 -179.481 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -0.986 0 N-CA-C 110.634 -0.987 . . . . 0.0 110.634 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 123' ' ' SER . . . . . 0.443 ' HB3' ' O ' ' B' ' 126' ' ' TYR . 34.7 t -147.85 147.16 29.49 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 179.061 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 33.7 m -100.54 -12.99 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.003 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 175.535 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -75.27 -48.83 21.44 Favored 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 175.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 126' ' ' TYR . . . . . 0.443 ' O ' ' HB3' ' B' ' 123' ' ' SER . 74.0 t80 -131.34 104.95 7.31 Favored 'General case' 0 N--CA 1.426 -1.631 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 170.64 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 21.2 t -72.49 115.41 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.676 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 -179.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -74.17 -28.99 61.56 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.396 -177.228 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -79.69 126.15 81.02 Favored Pre-proline 0 N--CA 1.432 -1.342 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.012 177.384 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -59.68 -171.74 0.06 OUTLIER 'Trans proline' 0 C--N 1.358 1.077 0 C-N-CA 123.534 2.823 . . . . 0.0 114.431 -178.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 131' ' ' ASN . . . . . 0.437 ' HB2' ' HG3' ' A' ' 78' ' ' LYS . 6.4 p-10 -99.55 155.99 17.29 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.036 -0.984 . . . . 0.0 109.377 -174.647 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 132' ' ' ASN . . . . . 0.497 ' HA ' HG11 ' A' ' 114' ' ' VAL . 10.5 p30 179.42 -39.73 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.691 0 C-N-CA 125.555 1.542 . . . . 0.0 107.538 175.575 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 133' ' ' THR . . . . . 0.403 ' HB ' ' OH ' ' A' ' 91' ' ' TYR . 2.9 m 56.64 -73.69 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.226 0 C-N-CA 125.977 1.711 . . . . 0.0 113.245 177.47 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -138.48 21.38 2.73 Favored 'General case' 0 C--N 1.312 -1.063 0 O-C-N 121.876 -0.515 . . . . 0.0 112.236 177.449 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -53.56 -50.47 65.47 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.873 175.416 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -48.77 -37.99 20.58 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.621 1.168 . . . . 0.0 112.977 -176.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 95.2 mt -70.41 -50.08 42.24 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.974 0.416 . . . . 0.0 110.599 -179.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 19.8 mt -69.58 -41.24 76.06 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-O 121.563 0.697 . . . . 0.0 111.361 -178.08 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 139' ' ' ARG . . . . . 0.475 ' O ' ' HB3' ' B' ' 142' ' ' GLU . 64.4 ttt180 -67.32 -31.91 72.51 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.431 -175.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -78.74 -24.43 44.82 Favored 'General case' 0 N--CA 1.432 -1.326 0 C-N-CA 119.654 -0.819 . . . . 0.0 111.116 176.526 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 51.0 m -69.03 -36.97 78.34 Favored 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 171.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 142' ' ' GLU . . . . . 0.646 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 28.1 tt0 -56.62 -49.25 75.53 Favored 'General case' 0 C--O 1.204 -1.324 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.358 174.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.81 -45.47 59.4 Favored 'General case' 0 C--O 1.255 1.379 0 CA-C-O 121.44 0.638 . . . . 0.0 111.512 -178.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 144' ' ' GLN . . . . . 0.499 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 29.0 tt0 -67.1 -47.78 70.16 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.586 178.311 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -60.06 -34.0 72.81 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 123.532 0.733 . . . . 0.0 112.17 -178.255 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 146' ' ' LYS . . . . . 0.646 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 60.2 mttm -55.15 -51.37 66.67 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 175.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -71.77 -27.42 62.95 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.252 -178.286 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 148' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 9.5 mm-40 -73.25 -16.19 61.4 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.931 176.819 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt 51.92 55.63 9.0 Favored 'General case' 0 CA--C 1.505 -0.754 0 C-N-CA 125.052 1.341 . . . . 0.0 110.838 -178.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 95.0 mt -86.37 114.06 22.85 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.211 -178.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 151' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 44.3 m-80 48.23 -87.53 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.314 1.846 . . . . 0.0 114.257 177.4 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 10.7 tt -72.01 -24.89 23.1 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-O 120.932 0.396 . . . . 0.0 110.286 -175.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 153' ' ' TRP . . . . . 0.626 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 52.6 m95 -80.64 -10.43 59.73 Favored 'General case' 0 CA--C 1.506 -0.731 0 CA-C-O 121.771 0.796 . . . . 0.0 110.288 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 22.6 t -87.33 12.82 11.05 Favored 'General case' 0 N--CA 1.419 -1.993 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.001 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -66.62 -31.24 71.81 Favored 'General case' 0 C--N 1.356 0.871 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 172.191 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 20.9 t70 . . . . . 0 C--O 1.254 1.318 0 C-N-CA 125.007 1.323 . . . . 0.0 113.261 173.266 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 37.5 m80 . . . . . 0 N--CA 1.433 -1.286 0 CA-C-O 121.529 0.68 . . . . 0.0 112.072 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.453 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 37.0 ttmt -115.73 134.37 55.09 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 114.093 -1.412 . . . . 0.0 108.554 177.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -138.19 146.34 51.31 Favored Pre-proline 0 C--N 1.3 -1.558 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 176.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -69.22 150.59 71.67 Favored 'Trans proline' 0 C--O 1.246 0.891 0 C-N-CA 122.228 1.952 . . . . 0.0 112.388 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -141.45 165.04 28.61 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.142 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.547 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 8.4 m -100.23 133.81 44.08 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.4 tp -81.84 124.76 29.97 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 178.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.453 HD11 ' HB2' ' A' ' 26' ' ' MET . 59.4 mt -95.78 -54.87 6.63 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 176.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -162.68 153.83 17.49 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.197 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.459 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -111.32 107.47 16.75 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 176.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.4 mt -81.04 -63.53 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.237 0 CA-C-O 121.59 0.71 . . . . 0.0 109.357 -173.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -112.77 -171.37 1.85 Allowed 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.186 -0.916 . . . . 0.0 109.856 -176.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -92.29 40.18 2.92 Favored Glycine 0 C--O 1.202 -1.884 0 N-CA-C 109.779 -1.328 . . . . 0.0 109.779 177.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.612 ' OD1' ' HG2' ' A' ' 35' ' ' ARG . 2.5 t0 -174.9 -57.46 0.01 OUTLIER 'General case' 0 CA--C 1.505 -0.761 0 N-CA-C 106.534 -1.654 . . . . 0.0 106.534 -174.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.3 111.37 18.92 Favored 'General case' 0 N--CA 1.425 -1.704 0 CA-C-N 113.826 -1.534 . . . . 0.0 109.103 -176.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.425 HG12 ' HA ' ' A' ' 17' ' ' ALA . 22.2 m -134.6 163.16 37.48 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.892 0 C-N-CA 123.499 0.72 . . . . 0.0 109.058 -176.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -116.26 116.26 27.44 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.619 -0.676 . . . . 0.0 110.107 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.8 mp -121.92 159.44 26.88 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 121.409 0.623 . . . . 0.0 111.001 178.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.547 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 26.9 ttt -120.08 105.93 11.48 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -178.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.425 ' CD1' ' HZ ' ' A' ' 34' ' ' PHE . 11.3 p90 -106.74 120.61 42.46 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -177.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 60.9 mttp 55.79 28.71 12.72 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.438 0.637 . . . . 0.0 111.916 -178.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.402 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 93.43 6.08 62.96 Favored Glycine 0 N--CA 1.434 -1.464 0 C-N-CA 120.513 -0.851 . . . . 0.0 113.197 178.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.465 ' O ' ' HA ' ' A' ' 26' ' ' MET . 84.0 mm-40 -105.62 104.01 46.29 Favored Pre-proline 0 C--N 1.311 -1.081 0 CA-C-N 117.122 0.461 . . . . 0.0 110.938 178.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.402 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 6.2 Cg_exo -76.77 117.09 4.4 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.682 2.254 . . . . 0.0 110.703 176.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 25.8 mmt -137.42 147.58 45.5 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 90.3 m -85.59 116.73 24.05 Favored 'General case' 0 N--CA 1.425 -1.685 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 173.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.425 ' HZ ' ' CD1' ' A' ' 27' ' ' TYR . 90.5 m-85 -102.53 157.59 16.82 Favored 'General case' 0 C--N 1.291 -1.962 0 C-N-CA 123.686 0.794 . . . . 0.0 109.847 -177.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.612 ' HG2' ' OD1' ' A' ' 21' ' ' ASP . 11.9 ttt-85 -132.66 156.44 46.96 Favored 'General case' 0 C--N 1.286 -2.157 0 N-CA-C 104.127 -2.546 . . . . 0.0 104.127 172.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.467 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 84.1 mt -89.88 116.88 28.28 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -170.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.485 HD21 ' HB3' ' A' ' 89' ' ' LEU . 37.3 mt -55.71 135.82 51.21 Favored 'General case' 0 C--O 1.245 0.816 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.009 178.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.499 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 95.6 mt 72.24 13.14 5.73 Favored 'General case' 0 C--O 1.209 -1.031 0 O-C-N 124.872 1.357 . . . . 0.0 112.132 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 57.3 t -125.88 143.38 39.59 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.433 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -140.08 107.8 5.64 Favored 'General case' 0 C--O 1.249 1.052 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 175.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.441 HG23 ' O ' ' A' ' 108' ' ' LEU . 2.6 m . . . . . 0 CA--C 1.571 1.785 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 -173.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 1.552 0 N-CA-C 116.328 1.291 . . . . 0.0 116.328 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo -49.06 -52.0 9.55 Favored 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 123.059 2.506 . . . . 0.0 113.774 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -70.45 -48.57 55.25 Favored 'General case' 0 C--O 1.206 -1.197 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.5 -48.1 72.28 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -177.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.517 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 46.0 p -69.08 -33.77 74.07 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-O 121.146 0.498 . . . . 0.0 111.876 -178.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.605 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -71.04 -38.62 72.56 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 175.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -61.51 -43.13 99.41 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 124.917 1.287 . . . . 0.0 111.509 -176.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.527 ' O ' HG22 ' A' ' 66' ' ' VAL . 5.0 p -64.28 -41.47 96.88 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.951 177.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.517 ' HG3' ' O ' ' A' ' 59' ' ' SER . 57.7 mttp -57.11 -39.12 74.47 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 123.541 0.526 . . . . 0.0 111.096 177.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.605 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 82.1 mttt -59.51 -54.27 48.52 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -179.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -67.35 -39.56 85.77 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -177.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.527 HG22 ' O ' ' A' ' 62' ' ' THR . 34.5 m -82.32 -39.02 15.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 113.634 0.975 . . . . 0.0 113.634 -176.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -75.55 -22.85 56.68 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -177.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -83.94 -9.44 58.69 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.766 0.793 . . . . 0.0 109.766 178.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.45 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -86.17 140.35 30.25 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.476 0.655 . . . . 0.0 112.436 -177.113 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -87.04 -38.52 16.48 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.042 -0.981 . . . . 0.0 108.977 175.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -119.11 119.78 35.21 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.522 -176.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 74.6 mt -118.23 121.37 67.04 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.475 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 22.8 mt-10 -115.9 137.95 51.63 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.199 -173.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.8 m -110.7 118.67 57.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 174.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.453 ' HA ' ' HA ' ' A' ' 9' ' ' LYS . 39.6 tt0 -111.71 133.76 53.73 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.484 ' CE1' ' HG3' ' A' ' 81' ' ' ARG . 60.8 m-85 -108.65 147.3 32.09 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -175.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.415 ' HB2' ' HE2' ' A' ' 91' ' ' TYR . 1.3 t70 -97.33 -174.54 2.96 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 120.939 0.4 . . . . 0.0 110.816 -176.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.0 mtpm? -76.82 -8.41 57.26 Favored 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 123.787 0.835 . . . . 0.0 110.79 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -69.13 -93.65 0.05 OUTLIER Glycine 0 C--N 1.335 0.508 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -145.97 158.74 43.86 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 176.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.484 ' HG3' ' CE1' ' A' ' 76' ' ' PHE . 37.0 ttm180 -88.52 -35.37 17.0 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 173.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 8.4 p . . . . . 0 C--N 1.313 -1.021 0 CA-C-N 115.285 -0.87 . . . . 0.0 112.119 -175.351 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.412 -2.339 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -87.9 157.47 28.49 Favored Glycine 0 N--CA 1.427 -1.966 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.412 -175.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.485 ' HB3' HD21 ' A' ' 37' ' ' LEU . 72.7 mt -122.39 108.55 13.34 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 -178.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.436 ' O ' ' HA ' ' A' ' 36' ' ' LEU . . . -150.66 167.61 26.82 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 119.992 -0.683 . . . . 0.0 112.543 -175.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.415 ' HE2' ' HB2' ' A' ' 77' ' ' ASP . 78.8 m-85 -106.22 127.93 53.58 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 171.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 65.5 mt -103.14 126.7 57.42 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.978 0 C-N-CA 119.503 -0.879 . . . . 0.0 111.608 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.475 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 35.4 m-85 -112.45 133.94 54.26 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.278 178.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.45 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -105.34 105.83 16.04 Favored 'General case' 0 C--N 1.283 -2.306 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 174.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.2 p30 46.96 26.53 0.61 Allowed 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 125.201 1.4 . . . . 0.0 113.866 -172.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.46 -6.94 36.46 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.694 -0.765 . . . . 0.0 113.396 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -89.07 115.38 26.57 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 175.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 51.8 ttp -76.11 112.55 12.68 Favored 'General case' 0 C--N 1.294 -1.846 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 -178.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 57.5 t -62.41 -32.77 56.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.245 0.545 . . . . 0.0 110.138 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.467 ' ND2' ' HB3' ' A' ' 36' ' ' LEU . 1.3 m-20 -57.79 -37.95 74.63 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.073 178.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -66.3 -46.01 78.4 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.758 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.36 -39.77 88.38 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.662 -178.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 97.2 mt -62.19 -53.46 54.94 Favored 'General case' 0 C--O 1.244 0.795 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 19.3 m -69.54 -37.88 75.6 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 116.222 -0.444 . . . . 0.0 112.156 -177.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 53.2 ttp180 -68.26 -24.64 64.91 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 123.405 0.682 . . . . 0.0 111.16 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 50.7 tp60 -92.01 -5.74 52.43 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.547 0.689 . . . . 0.0 109.375 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.497 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 73.23 27.19 68.69 Favored Glycine 0 N--CA 1.441 -0.976 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.766 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.441 ' O ' HG23 ' A' ' 41' ' ' THR . 83.3 mt -97.63 -7.04 31.93 Favored 'General case' 0 CA--C 1.495 -1.138 0 O-C-N 122.864 -0.198 . . . . 0.0 111.186 -179.104 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -150.61 164.67 35.47 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 -177.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -112.66 156.92 21.91 Favored 'General case' 0 CA--C 1.488 -1.421 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 174.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 75.2 t -73.77 136.13 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.755 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 174.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.424 -1.766 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -177.741 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 65.8 m80 . . . . . 0 N--CA 1.467 0.398 0 CA-C-O 118.706 -0.664 . . . . 0.0 112.377 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.4 ' HA ' HD13 ' A' ' 38' ' ' LEU . 33.9 tt0 -60.98 -41.75 97.05 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 118.889 0.768 . . . . 0.0 110.628 -176.021 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -65.9 -33.6 76.21 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.319 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 95.0 mt -68.52 -49.73 57.41 Favored 'General case' 0 C--O 1.246 0.871 0 CA-C-O 121.657 0.741 . . . . 0.0 109.136 178.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -63.55 -44.56 93.81 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.288 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 139' ' ' ARG . . . . . 0.433 ' HA ' ' HB3' ' B' ' 142' ' ' GLU 0.436 48.6 mtt180 -75.13 -18.39 60.24 Favored 'General case' 0 N--CA 1.436 -1.159 0 N-CA-C 117.62 2.452 . . . . 0.0 117.62 -175.767 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -72.68 -42.78 63.91 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 169.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 15.0 m -66.4 -37.12 84.51 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 114.651 -1.159 . . . . 0.0 110.275 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.606 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 39.0 tt0 -63.39 -51.17 66.92 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.694 175.143 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.61 -39.21 70.47 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.65 0.78 . . . . 0.0 111.65 -176.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -60.17 -47.54 85.53 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.432 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -74.45 -34.29 63.13 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.423 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 146' ' ' LYS . . . . . 0.606 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 39.6 mtpt -59.82 -47.71 84.63 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-O 121.131 0.491 . . . . 0.0 110.208 179.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -67.98 -26.95 66.18 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.541 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -82.85 -8.54 59.57 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . 0.54 ' O ' ' HB2' ' B' ' 154' ' ' SER . 29.8 mmmt 58.35 42.72 21.07 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 36.3 mt -79.13 112.28 16.18 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.19 -176.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 151' ' ' ASN . . . . . 0.497 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 85.6 m-20 54.16 -92.85 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.084 1.354 . . . . 0.0 112.671 174.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 52.1 mt -67.69 -32.73 58.06 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.948 0 CA-C-O 121.206 0.527 . . . . 0.0 110.387 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 52.8 m95 -75.69 -5.43 45.56 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-O 121.765 0.793 . . . . 0.0 111.473 -177.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . 0.54 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 23.2 t -93.72 12.66 24.81 Favored 'General case' 0 N--CA 1.423 -1.787 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.604 173.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -70.79 -24.3 62.55 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.615 0.722 . . . . 0.0 109.08 175.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 30.2 t70 . . . . . 0 N--CA 1.429 -1.488 0 CA-C-N 114.356 -1.293 . . . . 0.0 109.295 -178.351 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 14.9 p-80 . . . . . 0 N--CA 1.444 -0.728 0 CA-C-O 120.733 0.302 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.485 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 21.4 pttp -111.46 145.9 38.17 Favored 'General case' 0 C--N 1.291 -1.951 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 173.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -138.85 147.6 54.81 Favored Pre-proline 0 C--N 1.259 -3.34 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -74.96 149.76 37.39 Favored 'Trans proline' 0 C--O 1.244 0.804 0 C-N-CA 122.212 1.941 . . . . 0.0 113.193 -177.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -138.12 155.05 49.13 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.542 -0.753 . . . . 0.0 109.448 178.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.474 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 21.6 m -100.59 137.02 39.55 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.442 ' HB2' HD12 ' A' ' 72' ' ' ILE . 62.2 tp -83.36 132.97 34.97 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.979 -0.451 . . . . 0.0 111.594 -176.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 51.0 mm -95.92 -59.47 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.481 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 172.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.24 142.3 0.8 Allowed 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 -178.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.428 ' HA ' HG23 ' A' ' 23' ' ' VAL . . . -92.04 122.53 34.63 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 171.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.4 mt -90.15 -64.8 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -175.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -134.83 -178.82 5.25 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.643 -178.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.7 56.01 4.9 Favored Glycine 0 C--O 1.238 0.379 0 C-N-CA 121.732 -0.27 . . . . 0.0 112.95 -176.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.572 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 3.2 p-10 177.71 -34.06 0.01 OUTLIER 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 124.546 1.139 . . . . 0.0 108.259 179.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -110.12 109.89 20.58 Favored 'General case' 0 N--CA 1.419 -2.002 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.953 -177.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.428 HG23 ' HA ' ' A' ' 17' ' ' ALA . 7.3 p -129.33 139.2 52.39 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.881 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 178.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -106.0 119.48 39.31 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -175.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 31' ' ' PRO . 4.7 mp -127.24 156.28 42.13 Favored 'General case' 0 CA--C 1.496 -1.119 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.958 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.474 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 49.3 ttm -110.83 99.94 8.77 Favored 'General case' 0 C--N 1.29 -2.019 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 175.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -98.29 113.26 25.14 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.329 -0.949 . . . . 0.0 108.717 -177.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 96.8 mttt 56.71 31.62 19.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.878 0.847 . . . . 0.0 111.563 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 95.52 4.2 60.86 Favored Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 114.815 -1.084 . . . . 0.0 113.938 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 33.5 mm-40 -105.97 103.46 44.64 Favored Pre-proline 0 C--N 1.309 -1.173 0 CA-C-N 117.403 0.601 . . . . 0.0 111.163 175.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.48 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 1.9 Cg_endo -82.69 107.69 1.6 Allowed 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 122.798 2.332 . . . . 0.0 111.124 177.328 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 92.0 mtp -131.52 156.49 45.62 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-O 121.081 0.467 . . . . 0.0 111.463 -177.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.8 m -78.31 108.95 12.02 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 175.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -95.1 142.7 27.25 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-O 121.291 0.567 . . . . 0.0 111.572 -178.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.572 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 8.2 tpt180 -110.88 112.25 23.96 Favored 'General case' 0 N--CA 1.417 -2.105 0 N-CA-C 105.443 -2.058 . . . . 0.0 105.443 172.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.569 HD12 ' H ' ' A' ' 36' ' ' LEU . 3.9 mp -62.93 122.08 15.11 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -177.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 78.9 mt -69.09 146.58 52.46 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.306 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.487 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 70.3 mt 75.47 4.27 4.02 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 124.935 1.294 . . . . 0.0 112.265 177.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 94.1 t -120.3 125.79 74.57 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.223 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.599 -178.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.472 ' HA ' ' NH2' ' A' ' 35' ' ' ARG . 31.9 t70 -121.89 134.9 54.87 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 173.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.561 ' OG1' ' HB3' ' A' ' 21' ' ' ASP . 1.7 m . . . . . 0 C--N 1.307 -1.242 0 C-N-CA 123.741 0.816 . . . . 0.0 109.547 -177.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.598 0 CA-C-O 118.836 -0.98 . . . . 0.0 114.395 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.477 ' HA ' ' OG ' ' A' ' 59' ' ' SER . 32.4 Cg_exo -64.12 -21.48 67.85 Favored 'Trans proline' 0 C--N 1.364 1.381 0 C-N-CA 122.842 2.362 . . . . 0.0 112.357 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -68.8 -47.38 66.25 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 177.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.88 -46.47 68.34 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.078 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.501 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 12.9 p -65.88 -45.16 83.07 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -177.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.38 -39.46 90.73 Favored 'General case' 0 CA--C 1.51 -0.58 0 C-N-CA 121.255 -0.178 . . . . 0.0 110.864 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -63.92 -45.19 90.38 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.496 ' O ' HG22 ' A' ' 66' ' ' VAL . 44.8 m -56.84 -49.86 74.17 Favored 'General case' 0 N--CA 1.445 -0.708 0 O-C-N 124.181 0.926 . . . . 0.0 109.425 177.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.501 ' HG3' ' O ' ' A' ' 59' ' ' SER . 59.7 mtpt -56.83 -54.59 44.66 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.821 179.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -57.48 -42.01 81.8 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.69 0.618 . . . . 0.0 111.89 -177.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.8 ttt -72.35 -44.87 61.99 Favored 'General case' 0 N--CA 1.441 -0.911 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.854 -177.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.496 HG22 ' O ' ' A' ' 62' ' ' THR . 33.2 m -74.88 -30.91 24.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -70.8 -31.56 68.36 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.338 0.589 . . . . 0.0 109.774 176.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -84.23 -13.44 52.64 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.384 -178.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.57 132.43 46.91 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.025 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -79.51 -38.27 34.75 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-O 122.004 0.906 . . . . 0.0 109.226 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.458 ' H ' ' HB3' ' A' ' 95' ' ' ASP . 44.5 mtmt -133.18 150.44 52.0 Favored 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 106.02 -1.845 . . . . 0.0 106.02 178.01 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.442 HD12 ' HB2' ' A' ' 14' ' ' LEU . 53.3 mt -119.1 130.69 73.53 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.744 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 171.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.585 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 14.2 mm-40 -111.49 133.11 54.01 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 106.222 -1.77 . . . . 0.0 106.222 -178.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 m -112.64 122.81 67.54 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.916 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 174.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.485 ' HA ' ' HA ' ' A' ' 9' ' ' LYS . 33.7 tt0 -106.51 135.16 48.51 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 120.902 0.382 . . . . 0.0 110.526 -177.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -79.13 116.6 19.51 Favored 'General case' 0 N--CA 1.415 -2.215 0 CA-C-N 114.919 -1.037 . . . . 0.0 108.882 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.451 ' CG ' ' H ' ' A' ' 78' ' ' LYS . 25.9 t70 -96.8 -175.2 3.21 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 123.926 0.766 . . . . 0.0 109.924 -177.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.451 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 43.1 tptt -73.05 -9.4 58.69 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 124.443 1.097 . . . . 0.0 112.353 -173.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -81.05 -113.54 0.33 Allowed Glycine 0 C--N 1.314 -0.675 0 C-N-CA 120.337 -0.935 . . . . 0.0 110.927 174.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -130.21 175.01 9.27 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 176.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 40.4 ttt180 -96.15 -32.75 12.34 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 43.0 p . . . . . 0 N--CA 1.441 -0.923 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.834 177.654 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 27.8 mmt85 . . . . . 0 N--CA 1.439 -0.98 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -89.19 141.58 16.34 Favored Glycine 0 C--N 1.291 -1.919 0 N-CA-C 109.105 -1.598 . . . . 0.0 109.105 175.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.6 mt -124.4 105.84 9.75 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -178.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.54 164.18 38.51 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-O 120.631 0.253 . . . . 0.0 110.434 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.413 ' CZ ' ' HB2' ' A' ' 100' ' ' ASN . 13.1 t80 -89.21 130.77 35.57 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 173.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 45.2 mm -99.99 123.94 53.13 Favored 'Isoleucine or valine' 0 C--O 1.251 1.14 0 CA-C-O 120.954 0.407 . . . . 0.0 111.623 -175.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.585 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 50.1 m-85 -113.94 145.65 41.21 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 173.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.19 100.4 9.99 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 175.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.458 ' HB3' ' H ' ' A' ' 71' ' ' LYS 0.338 4.2 p-10 43.83 42.5 4.51 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 125.46 1.504 . . . . 0.0 114.256 -176.864 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.25 -17.84 39.99 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-N 114.687 -1.142 . . . . 0.0 113.52 177.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.2 mtmt -97.97 132.29 43.66 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 120.937 0.398 . . . . 0.0 110.908 -177.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . 0.446 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 1.9 mpt? -70.39 109.99 5.06 Favored 'General case' 0 C--N 1.305 -1.334 0 C-N-CA 123.999 0.92 . . . . 0.0 112.95 -173.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 58.7 t -73.41 -43.78 55.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 121.441 0.639 . . . . 0.0 109.941 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.506 HD21 ' HB3' ' A' ' 36' ' ' LEU . 14.3 m120 -60.65 -45.16 95.15 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.247 -176.467 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -61.91 -38.0 86.76 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.05 178.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.557 ' O ' ' HG2' ' A' ' 106' ' ' GLN . . . -65.33 -46.69 79.25 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.265 179.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 97.2 mt -53.57 -48.66 68.95 Favored 'General case' 0 C--O 1.244 0.777 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -179.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 12.7 m -70.81 -36.97 66.76 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.514 ' HB2' ' HB3' ' B' ' 141' ' ' SER . 29.2 ttp180 -72.26 -21.81 61.32 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.557 ' HG2' ' O ' ' A' ' 102' ' ' ALA . 82.0 mm-40 -87.54 -2.67 58.78 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.32 0.581 . . . . 0.0 109.508 176.326 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.436 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 69.75 28.7 71.76 Favored Glycine 0 N--CA 1.444 -0.833 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.993 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.4 mt -94.98 -13.98 24.79 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-O 121.189 0.518 . . . . 0.0 110.577 -177.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -151.22 167.41 27.9 Favored 'General case' 0 N--CA 1.428 -1.569 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.231 -176.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -112.57 153.11 28.04 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 175.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.508 HG11 ' HG2' ' B' ' 139' ' ' ARG . 11.7 p -76.9 125.55 36.8 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-O 121.516 0.674 . . . . 0.0 110.475 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.455 ' CB ' ' HB2' ' A' ' 40' ' ' ASP . . . . . . . . 0 C--N 1.305 -1.368 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.867 176.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 . . . . . 0 N--CA 1.47 0.552 0 CA-C-O 120.994 0.426 . . . . 0.0 110.49 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -54.82 -55.35 31.22 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.926 -1.033 . . . . 0.0 112.892 -175.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 56.9 mm-40 -56.74 -45.92 81.69 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.043 -171.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.0 mt -62.9 -51.1 68.25 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 123.78 0.675 . . . . 0.0 111.019 -176.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 7.6 mp -70.04 -32.95 71.33 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 139' ' ' ARG . . . . . 0.508 ' HG2' HG11 ' A' ' 111' ' ' VAL . 34.1 mtp180 -68.25 -34.26 75.89 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.378 176.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 19.4 mmmt -70.46 -32.04 69.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.875 0.369 . . . . 0.0 110.941 173.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 141' ' ' SER . . . . . 0.514 ' HB3' ' HB2' ' A' ' 105' ' ' ARG . 43.3 m -65.82 -41.96 91.2 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.807 177.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.552 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 48.0 mt-10 -63.65 -46.96 83.27 Favored 'General case' 0 C--O 1.198 -1.612 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.455 172.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . 0.548 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -51.04 -44.41 61.08 Favored 'General case' 0 CA--C 1.509 -0.617 0 O-C-N 123.899 0.749 . . . . 0.0 111.608 -176.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -61.31 -47.41 86.09 Favored 'General case' 0 N--CA 1.441 -0.876 0 O-C-N 123.864 0.728 . . . . 0.0 109.503 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.1 -40.79 91.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.055 -178.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 146' ' ' LYS . . . . . 0.552 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 56.0 mttm -54.55 -45.09 73.4 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.102 0.477 . . . . 0.0 110.52 177.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 31.1 mmtp -79.9 -24.01 41.43 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.772 -174.161 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -87.23 -9.86 54.01 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.584 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . 0.552 ' O ' ' HB2' ' B' ' 154' ' ' SER . 27.4 mmmt 61.97 55.91 2.45 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.387 1.075 . . . . 0.0 108.428 -178.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 88.7 mt -95.06 123.25 38.44 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.038 -177.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 151' ' ' ASN . . . . . 0.436 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 54.2 m-80 46.26 -97.11 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.766 1.626 . . . . 0.0 113.574 -179.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 152' ' ' ILE . . . . . 0.563 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 64.4 mt -60.98 -36.01 69.22 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.632 0 CA-C-O 121.767 0.794 . . . . 0.0 110.401 -178.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -80.61 1.0 31.63 Favored 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.6 -175.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . 0.552 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 25.0 t -99.72 -6.73 26.59 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.49 177.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . 0.563 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 12.5 pt-20 -79.94 -19.67 47.46 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 119.939 -0.704 . . . . 0.0 109.24 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 18.4 t70 . . . . . 0 CA--C 1.487 -1.473 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -178.027 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 28.9 t-80 . . . . . 0 N--CA 1.433 -1.277 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -96.33 125.02 40.54 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 115.32 -0.854 . . . . 0.0 108.926 179.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.473 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 7.5 pt-20 -135.38 143.4 45.2 Favored Pre-proline 0 C--N 1.303 -1.454 0 CA-C-N 116.78 -0.191 . . . . 0.0 110.489 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 6.0 Cg_exo -79.97 147.36 18.91 Favored 'Trans proline' 0 C--O 1.249 1.046 0 C-N-CA 122.472 2.115 . . . . 0.0 113.903 -176.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -129.86 171.26 12.91 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.208 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.423 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 28.1 m -117.13 145.6 43.7 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 107.081 -1.452 . . . . 0.0 107.081 178.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.1 tp -88.28 127.93 35.47 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 118.721 0.691 . . . . 0.0 110.381 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.483 HD11 ' HB2' ' A' ' 26' ' ' MET . 46.6 mm -93.13 -51.47 11.2 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 176.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -169.48 134.12 1.41 Allowed 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.347 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -84.79 131.51 34.53 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 172.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.436 ' HB ' ' O ' ' A' ' 22' ' ' THR . 59.7 mt -105.89 -64.45 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 C-N-CA 120.544 -0.463 . . . . 0.0 111.016 -175.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.457 ' HB2' ' OG1' ' A' ' 22' ' ' THR . 36.9 m-20 -122.71 -152.71 0.52 Allowed 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -101.69 44.43 1.54 Allowed Glycine 0 CA--C 1.498 -0.971 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 -178.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.455 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 33.0 t0 -179.73 -56.12 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 -178.177 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.457 ' OG1' ' HB2' ' A' ' 19' ' ' ASP . 1.0 OUTLIER -76.4 106.34 7.98 Favored 'General case' 0 N--CA 1.411 -2.377 0 CA-C-N 114.627 -1.169 . . . . 0.0 110.059 -178.296 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.5 m -130.68 151.04 35.27 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.451 -178.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 45.7 tttp -108.49 114.48 28.35 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 -176.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.7 mp -121.5 159.69 25.77 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 121.382 0.611 . . . . 0.0 111.416 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.513 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 64.0 ttp -119.46 116.24 25.71 Favored 'General case' 0 C--N 1.294 -1.83 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 177.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.2 p90 -119.66 119.53 33.98 Favored 'General case' 0 C--N 1.286 -2.154 0 C-N-CA 119.368 -0.933 . . . . 0.0 109.272 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 98.0 mttt 60.85 27.52 17.33 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.266 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.434 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 94.31 3.67 63.11 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-N 115.232 -0.895 . . . . 0.0 113.034 -179.589 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.513 ' O ' ' HA ' ' A' ' 26' ' ' MET . 1.7 mp0 -100.47 102.39 18.59 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.95 0.375 . . . . 0.0 110.446 177.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.434 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 1.5 Cg_endo -83.34 101.96 1.01 Allowed 'Trans proline' 0 N--CA 1.443 -1.45 0 C-N-CA 122.31 2.007 . . . . 0.0 109.856 176.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 66.7 mtt -124.98 147.47 48.91 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.492 -176.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.54 ' O ' ' HD3' ' A' ' 87' ' ' ARG . 23.7 m -85.91 121.37 28.45 Favored 'General case' 0 N--CA 1.422 -1.839 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 177.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -99.57 161.58 13.53 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-O 122.256 1.026 . . . . 0.0 113.532 -174.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.455 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 9.0 tpt180 -134.51 131.02 37.52 Favored 'General case' 0 N--CA 1.412 -2.327 0 N-CA-C 105.037 -2.208 . . . . 0.0 105.037 173.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.1 mp -69.94 129.3 39.13 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 119.658 -0.817 . . . . 0.0 111.859 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.453 HD21 ' HB3' ' A' ' 89' ' ' LEU . 50.2 mt -57.42 126.07 25.67 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 115.047 -0.979 . . . . 0.0 112.629 177.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 40.2 mt 72.03 23.4 3.47 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-N 113.485 -1.688 . . . . 0.0 112.562 173.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 51.1 t -111.41 135.57 50.2 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.033 0 CA-C-O 121.113 0.482 . . . . 0.0 110.596 177.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.539 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 35.8 t70 -122.36 106.79 11.39 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 174.364 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.455 HG21 ' HB2' ' A' ' 21' ' ' ASP . 1.8 p . . . . . 0 N--CA 1.421 -1.925 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.774 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.616 0 CA-C-O 118.803 -0.998 . . . . 0.0 114.758 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.47 -25.2 70.46 Favored 'Trans proline' 0 C--N 1.366 1.47 0 C-N-CA 122.409 2.073 . . . . 0.0 112.899 -178.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -70.3 -50.46 39.07 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 178.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.3 -43.06 98.91 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.296 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.7 p -64.91 -49.41 70.54 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.444 -178.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.33 -39.12 93.27 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 120.52 0.2 . . . . 0.0 110.853 -178.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -59.74 -52.73 64.21 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 123.435 0.694 . . . . 0.0 109.562 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 25.6 m -61.72 -47.15 86.56 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.313 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -58.36 -48.05 81.85 Favored 'General case' 0 CA--C 1.503 -0.839 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.191 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -60.7 -39.86 90.11 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.426 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 84.9 mtp -66.8 -47.71 71.22 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 120.141 -0.624 . . . . 0.0 111.633 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.9 m -75.09 -29.9 22.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -176.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -85.62 -29.52 24.01 Favored 'General case' 0 C--N 1.315 -0.933 0 O-C-N 121.83 -0.543 . . . . 0.0 112.182 -179.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -84.99 -11.71 54.87 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.296 0.57 . . . . 0.0 109.92 178.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.31 123.26 11.41 Favored 'General case' 0 C--O 1.244 0.791 0 C-N-CA 123.7 0.8 . . . . 0.0 112.069 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -74.54 -40.82 61.48 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 177.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -126.57 122.59 35.52 Favored 'General case' 0 N--CA 1.416 -2.169 0 CA-C-N 113.513 -1.676 . . . . 0.0 107.915 -179.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 63.5 mt -97.44 112.5 29.62 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.251 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 177.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.546 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 30.2 mt-10 -113.07 133.8 54.83 Favored 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 120.525 -0.47 . . . . 0.0 109.925 -175.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.0 m -110.93 127.01 68.33 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.693 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 171.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -115.33 128.85 56.37 Favored 'General case' 0 C--N 1.279 -2.495 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -175.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.455 ' CE1' ' HB2' ' A' ' 81' ' ' ARG . 32.2 t80 -97.41 131.86 43.67 Favored 'General case' 0 N--CA 1.414 -2.228 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.458 -175.149 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -85.66 -174.95 5.42 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -75.79 -14.95 60.32 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -175.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -97.93 -116.52 3.57 Favored Glycine 0 C--N 1.313 -0.742 0 C-N-CA 120.19 -1.005 . . . . 0.0 115.586 -172.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -96.07 141.22 29.72 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -175.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.455 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . 19.3 ttm180 -96.82 -22.4 16.95 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 124.145 0.903 . . . . 0.0 108.859 176.668 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.4 p . . . . . 0 C--N 1.3 -1.583 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.985 -177.263 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.54 ' HD3' ' O ' ' A' ' 33' ' ' THR . 10.8 tpp85 . . . . . 0 N--CA 1.433 -1.316 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -76.62 141.17 26.18 Favored Glycine 0 N--CA 1.441 -0.967 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.453 ' HB3' HD21 ' A' ' 37' ' ' LEU . 88.2 mt -122.95 102.04 7.78 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -178.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -153.13 167.75 28.24 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 -178.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -88.28 141.99 28.11 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 174.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 46.5 mm -111.62 123.42 67.42 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.546 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 13.4 m-85 -118.91 139.0 52.37 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 176.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.63 98.85 8.49 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 174.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.276 4.3 p-10 42.91 43.34 3.48 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.749 1.22 . . . . 0.0 113.714 -175.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.3 -19.48 37.08 Favored Glycine 0 N--CA 1.443 -0.878 0 C-N-CA 120.858 -0.686 . . . . 0.0 113.412 178.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.3 mttp -82.85 113.15 20.28 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 179.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . 0.483 ' CE ' ' HB2' ' A' ' 101' ' ' GLU . 44.7 ttp -77.48 106.85 9.52 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 45.4 t -59.73 -44.32 93.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.424 -173.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -65.62 -30.05 70.72 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.483 ' HB2' ' CE ' ' A' ' 98' ' ' MET . 7.9 tp10 -62.24 -53.82 49.76 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 173.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.76 -44.5 96.65 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.047 -0.979 . . . . 0.0 112.061 -177.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 90.3 mt -56.64 -51.7 67.7 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.1 t -73.17 -38.02 53.81 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.204 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.586 -177.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 101' ' ' GLU . 3.9 tpt180 -69.46 -25.95 64.34 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.164 0.586 . . . . 0.0 111.415 -176.287 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.2 tp60 -95.67 -1.84 49.29 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.265 0.555 . . . . 0.0 109.565 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.451 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 73.23 39.71 51.63 Favored Glycine 0 N--CA 1.442 -0.953 0 CA-C-N 115.316 -0.856 . . . . 0.0 113.597 177.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 78.8 mt -104.24 -10.09 18.14 Favored 'General case' 0 C--N 1.296 -1.756 0 O-C-N 122.431 -0.452 . . . . 0.0 110.337 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -153.17 168.21 26.72 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.824 -177.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.561 ' HG3' ' CZ3' ' B' ' 153' ' ' TRP . 0.9 OUTLIER -99.87 168.07 10.12 Favored 'General case' 0 CA--C 1.492 -1.268 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 176.024 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 12.7 p -93.08 138.12 20.89 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.475 0 N-CA-C 106.576 -1.638 . . . . 0.0 106.576 173.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.282 -2.353 0 N-CA-C 104.458 -2.423 . . . . 0.0 104.458 174.685 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 73.5 m80 . . . . . 0 N--CA 1.472 0.627 0 CA-C-O 119.749 -0.167 . . . . 0.0 111.277 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -51.07 -65.72 0.51 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.789 1.236 . . . . 0.0 109.523 -178.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . 0.56 ' O ' ' HG3' ' B' ' 140' ' ' LYS . 14.6 mm100 -60.86 -47.55 85.88 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.038 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 84.4 mt -58.65 -49.4 77.65 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -175.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 138' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' B' ' 138' ' ' LEU . 28.6 mt -70.03 -26.61 64.13 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 178.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -71.48 -25.39 62.26 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 119.831 -0.747 . . . . 0.0 110.532 173.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . 0.56 ' HG3' ' O ' ' B' ' 136' ' ' GLN . 29.5 mtpp -72.89 -38.07 67.09 Favored 'General case' 0 C--O 1.243 0.745 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 175.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 15.7 m -60.88 -45.53 94.19 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.322 -0.854 . . . . 0.0 108.805 175.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.454 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 5.0 tt0 -57.9 -58.54 7.92 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.828 176.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -51.58 -50.73 59.57 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.614 0.766 . . . . 0.0 112.537 -176.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 144' ' ' GLN . . . . . 0.438 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 50.5 tt0 -61.37 -47.11 87.35 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.945 -178.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -71.69 -33.04 68.47 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.713 -176.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 146' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 77.3 mttt -64.0 -43.33 96.0 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 175.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -60.11 -38.46 83.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.146 178.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . 0.459 ' HB2' ' HG ' ' B' ' 150' ' ' LEU . 13.3 mm-40 -81.58 -17.93 46.61 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.592 -179.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 31.2 mtpt 54.48 60.99 3.21 Favored 'General case' 0 C--O 1.244 0.78 0 C-N-CA 124.987 1.315 . . . . 0.0 109.342 -174.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . 0.459 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 53.4 mt -82.78 116.86 22.31 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 113.591 -1.64 . . . . 0.0 110.841 -176.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 151' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 93.6 m-20 47.44 -89.97 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 125.371 1.469 . . . . 0.0 114.616 174.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 152' ' ' ILE . . . . . 0.452 HG12 ' HE3' ' A' ' 110' ' ' LYS . 6.8 tt -70.46 -27.24 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -175.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 153' ' ' TRP . . . . . 0.561 ' CZ3' ' HG3' ' A' ' 110' ' ' LYS . 56.2 m95 -74.18 -18.41 60.77 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-O 121.646 0.736 . . . . 0.0 110.612 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 8.4 t -87.19 61.66 6.84 Favored 'General case' 0 N--CA 1.426 -1.646 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 176.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -97.3 -4.64 38.33 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 114.795 -1.093 . . . . 0.0 111.688 -179.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 . . . . . 0 C--N 1.295 -1.774 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 179.935 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . 0.569 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 17.2 m-70 . . . . . 0 CA--C 1.493 -1.24 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.439 ' HG3' ' OE1' ' A' ' 75' ' ' GLU . 18.2 mtmm -93.9 117.92 30.76 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 172.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.505 ' CD ' HH22 ' A' ' 81' ' ' ARG . 9.3 pt-20 -127.85 139.14 34.5 Favored Pre-proline 0 C--N 1.28 -2.44 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.479 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 17.0 Cg_exo -67.76 142.98 59.8 Favored 'Trans proline' 0 C--O 1.25 1.096 0 C-N-CA 122.443 2.095 . . . . 0.0 113.309 -178.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -134.43 159.27 41.61 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.439 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 7.0 m -96.91 138.62 34.17 Favored 'General case' 0 N--CA 1.423 -1.818 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 179.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 49.8 tp -84.97 124.01 31.19 Favored 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 120.164 -0.614 . . . . 0.0 109.5 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 75.1 mt -84.72 -52.69 12.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.532 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 174.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -179.02 163.6 1.35 Allowed 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 115.177 -0.919 . . . . 0.0 108.993 175.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.559 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -107.28 126.08 51.98 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 174.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.443 ' HB ' ' HB ' ' A' ' 22' ' ' THR . 44.8 mm -78.44 -64.13 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -175.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -113.25 -161.62 0.77 Allowed 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 178.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -97.47 27.27 19.44 Favored Glycine 0 C--N 1.296 -1.649 0 N-CA-C 108.863 -1.695 . . . . 0.0 108.863 169.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.709 ' OD2' ' HD2' ' A' ' 35' ' ' ARG . 4.9 t70 -143.78 -62.19 0.39 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 -171.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.443 ' HB ' ' HB ' ' A' ' 18' ' ' ILE . 1.8 m -83.77 128.22 34.38 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 114.631 -1.168 . . . . 0.0 108.75 178.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.4 m -133.23 155.65 41.07 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 C-N-CA 122.78 0.432 . . . . 0.0 110.656 -177.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -119.61 112.11 18.91 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 -176.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.1 mp -126.0 159.5 32.54 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.519 0.676 . . . . 0.0 112.532 -176.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.439 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 25.3 ttt -127.62 102.78 6.99 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.464 -1.244 . . . . 0.0 108.741 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -105.1 119.1 38.21 Favored 'General case' 0 C--N 1.287 -2.127 0 C-N-CA 118.931 -1.108 . . . . 0.0 109.867 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 88.2 mttt 59.43 27.92 17.17 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 122.092 0.948 . . . . 0.0 110.754 175.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.444 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 93.07 7.04 62.75 Favored Glycine 0 N--CA 1.439 -1.114 0 CA-C-N 114.619 -1.173 . . . . 0.0 113.245 179.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -105.57 101.42 32.02 Favored Pre-proline 0 C--N 1.31 -1.127 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 5.5 Cg_exo -79.67 118.3 3.82 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 122.628 2.219 . . . . 0.0 110.47 177.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 63.7 mtt -136.1 149.0 48.52 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.092 0.472 . . . . 0.0 110.819 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.6 m -83.87 107.48 16.28 Favored 'General case' 0 N--CA 1.427 -1.579 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 176.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -101.99 163.78 12.06 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-O 121.602 0.715 . . . . 0.0 110.246 -177.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.709 ' HD2' ' OD2' ' A' ' 21' ' ' ASP . 25.3 ttp85 -137.46 141.79 41.58 Favored 'General case' 0 C--N 1.27 -2.88 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 169.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.542 ' HB2' ' HB ' ' A' ' 39' ' ' VAL . 28.6 mt -60.94 109.43 1.07 Allowed 'General case' 0 C--N 1.307 -1.261 0 O-C-N 124.115 0.884 . . . . 0.0 109.213 -177.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.4 tt -63.71 126.29 27.1 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 -179.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.45 ' C ' ' H ' ' A' ' 112' ' ' ALA . 91.0 mt 85.99 8.48 0.31 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.16 1.784 . . . . 0.0 113.85 -178.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.542 ' HB ' ' HB2' ' A' ' 36' ' ' LEU . 99.7 t -118.33 130.93 72.48 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.15 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 176.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -133.53 107.86 8.27 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 177.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 3.8 m . . . . . 0 CA--C 1.569 1.68 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -177.002 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.365 0 N-CA-C 115.186 0.834 . . . . 0.0 115.186 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -56.49 -32.08 88.24 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 123.035 2.49 . . . . 0.0 113.984 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -68.21 -57.1 6.55 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.918 0.39 . . . . 0.0 111.616 -176.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.3 -41.41 98.95 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.559 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 37.0 m -63.96 -35.69 81.5 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.137 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.94 -37.86 88.71 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.023 0.44 . . . . 0.0 110.333 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -68.91 -53.09 22.98 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.774 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 28.5 m -57.11 -48.11 79.45 Favored 'General case' 0 C--N 1.318 -0.79 0 O-C-N 124.101 0.876 . . . . 0.0 112.306 -178.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.559 ' HG2' ' HB3' ' A' ' 17' ' ' ALA . 51.8 mttp -60.61 -54.54 44.16 Favored 'General case' 0 C--N 1.344 0.359 0 C-N-CA 120.962 -0.295 . . . . 0.0 110.963 -178.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.6 mtmp? -67.5 -23.24 65.45 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 15.5 tpt -67.05 -45.11 78.4 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.21 0.529 . . . . 0.0 109.629 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.0 m -86.93 -26.13 6.06 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.438 -178.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 63' ' ' LYS . 51.0 mt-10 -73.9 -34.15 64.29 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.368 177.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -83.96 -16.34 44.47 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 121.01 0.433 . . . . 0.0 110.415 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.74 143.12 48.03 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.018 -178.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 44.2 mttp -74.44 -44.31 52.34 Favored 'General case' 0 CA--C 1.493 -1.236 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.408 ' HB2' ' HE3' ' A' ' 71' ' ' LYS . 42.2 mtmt -133.78 147.35 51.26 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-N 113.846 -1.524 . . . . 0.0 107.047 -179.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.448 ' O ' ' HA ' ' A' ' 11' ' ' PRO . 4.0 mp -105.9 120.99 57.67 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.719 0 N-CA-C 105.106 -2.183 . . . . 0.0 105.106 173.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.627 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 23.9 mm-40 -111.83 132.95 54.36 Favored 'General case' 0 C--N 1.292 -1.908 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 -175.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.6 m -112.3 129.72 67.32 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.989 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 175.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.569 ' HA ' ' O ' ' A' ' 8' ' ' HIS . 28.4 tt0 -106.52 118.97 38.04 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 119.525 -0.87 . . . . 0.0 111.229 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -87.24 124.24 33.1 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-N 113.395 -1.729 . . . . 0.0 109.232 177.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -88.31 -175.58 5.06 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 177.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.55 -3.81 56.08 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -173.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -93.2 -87.67 1.59 Allowed Glycine 0 N--CA 1.435 -1.421 0 C-N-CA 119.913 -1.137 . . . . 0.0 112.473 -177.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -125.59 139.24 53.75 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -175.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.505 HH22 ' CD ' ' A' ' 10' ' ' GLU . 25.6 ttt180 -98.96 -13.35 19.99 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.648 0.737 . . . . 0.0 109.129 178.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 13.6 p . . . . . 0 C--N 1.311 -1.101 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.333 177.255 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 12.2 mmt85 . . . . . 0 N--CA 1.433 -1.298 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -74.78 121.22 6.62 Favored Glycine 0 N--CA 1.425 -2.033 0 O-C-N 123.712 0.632 . . . . 0.0 111.575 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.3 mt -103.58 93.05 4.72 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 178.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -145.13 155.08 43.1 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -179.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -85.25 132.04 34.33 Favored 'General case' 0 C--N 1.29 -2.02 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 48.3 mm -99.5 126.38 52.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 C-N-CA 119.247 -0.981 . . . . 0.0 110.073 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.627 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 27.0 m-85 -120.3 144.07 48.01 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 114.682 -1.145 . . . . 0.0 109.125 179.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -106.67 99.54 9.11 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 176.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.5 p30 42.79 38.31 1.32 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 125.146 1.378 . . . . 0.0 113.907 -176.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.78 -11.4 38.35 Favored Glycine 0 N--CA 1.444 -0.785 0 CA-C-N 115.449 -0.796 . . . . 0.0 114.131 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -87.63 135.27 33.43 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 176.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . 0.602 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 3.6 mpp? -80.4 111.69 17.04 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 177.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 82.8 t -70.14 -45.63 75.28 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 19.1 m-20 -55.35 -50.13 70.46 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.421 -179.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' A' ' 105' ' ' ARG . 9.3 tp10 -55.8 -51.01 68.94 Favored 'General case' 0 C--O 1.211 -0.96 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.226 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.93 -43.29 95.04 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.829 -176.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 79.0 mt -60.29 -48.98 79.42 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 179.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 52.1 t -73.06 -31.5 35.47 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.47 -178.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.454 ' HB2' ' O ' ' A' ' 101' ' ' GLU . 1.8 tpt180 -72.57 -28.02 62.55 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.997 -178.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -87.51 -8.7 56.06 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.239 0.543 . . . . 0.0 109.76 175.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.97 41.52 87.48 Favored Glycine 0 N--CA 1.431 -1.695 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.186 -176.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 90.7 mt -96.89 -18.21 19.66 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.063 0.459 . . . . 0.0 110.768 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -149.7 171.32 16.88 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -176.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -110.2 171.55 7.38 Favored 'General case' 0 N--CA 1.425 -1.678 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.415 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 8.0 p -84.01 133.35 29.39 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.782 0 CA-C-O 121.066 0.46 . . . . 0.0 110.359 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.45 ' H ' ' C ' ' A' ' 38' ' ' LEU . . . . . . . . 0 CA--C 1.486 -1.503 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 176.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 63.0 m80 . . . . . 0 N--CA 1.448 -0.53 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -66.66 -38.03 86.01 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.902 -176.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -58.52 -37.93 76.65 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.153 -178.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.1 mt -64.83 -51.09 64.01 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.811 -178.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 8.2 mp -70.25 -23.26 62.87 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 178.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 84.9 mtt-85 -66.03 -31.24 72.02 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.278 -0.569 . . . . 0.0 110.537 174.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . 0.561 ' HE2' ' HA ' ' B' ' 140' ' ' LYS . 10.8 mmpt? -71.35 -39.7 71.15 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 176.022 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 3.5 m -59.99 -49.73 76.52 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.672 177.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.498 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 0.8 OUTLIER -64.22 -43.17 95.79 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.838 179.04 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . 0.403 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -61.66 -40.93 96.68 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.995 0.426 . . . . 0.0 110.888 179.125 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -69.21 -48.02 63.19 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.453 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.55 -32.49 73.87 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.564 -0.743 . . . . 0.0 112.081 -175.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 146' ' ' LYS . . . . . 0.498 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 84.0 mttt -65.33 -40.38 93.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.498 0.19 . . . . 0.0 110.648 174.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 48.4 mmtm -64.79 -37.88 89.11 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.501 0.667 . . . . 0.0 109.582 178.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . 0.407 ' HB2' ' HG ' ' B' ' 150' ' ' LEU . 49.3 mm-40 -79.24 -13.87 59.41 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 114.709 -1.132 . . . . 0.0 113.043 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm 54.32 47.49 22.86 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.54 0.736 . . . . 0.0 109.834 -178.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . 0.407 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 96.3 mt -74.98 95.59 3.02 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 114.943 -1.026 . . . . 0.0 112.0 -174.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 51.9 t30 53.92 -69.84 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 127.775 2.43 . . . . 0.0 114.154 173.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 12.0 tt -75.84 -28.74 19.48 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.075 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -78.13 -15.58 58.73 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.365 0.602 . . . . 0.0 111.407 -178.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 22.9 t -88.8 11.09 18.77 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.548 177.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -66.79 -28.73 68.62 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.147 0.579 . . . . 0.0 112.41 -178.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.1 t70 . . . . . 0 C--N 1.299 -1.592 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 -170.577 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . 0.426 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 7.7 m-70 . . . . . 0 CA--C 1.494 -1.209 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.52 107.48 15.21 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 105.022 -2.214 . . . . 0.0 105.022 175.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -138.99 159.0 68.73 Favored Pre-proline 0 C--N 1.3 -1.582 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.454 -173.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -78.94 147.17 21.06 Favored 'Trans proline' 0 C--O 1.25 1.075 0 C-N-CA 122.729 2.286 . . . . 0.0 114.123 -174.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -144.14 155.59 43.99 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.343 177.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.437 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 9.1 m -104.35 142.67 34.16 Favored 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 179.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -84.22 142.9 29.95 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 118.109 -1.437 . . . . 0.0 109.538 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 70.4 mt -103.0 -57.59 4.4 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.055 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 171.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 51.1 mttm -152.57 154.14 34.81 Favored 'General case' 0 N--CA 1.428 -1.536 0 C-N-CA 124.013 0.925 . . . . 0.0 110.552 -178.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.516 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -108.8 95.97 6.01 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 105.824 -1.917 . . . . 0.0 105.824 169.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 60.5 mt -68.4 -37.67 78.21 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.923 -171.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -152.44 -165.03 2.09 Favored 'General case' 0 C--N 1.291 -1.97 0 N-CA-C 106.366 -1.716 . . . . 0.0 106.366 -176.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -90.96 -25.76 23.82 Favored Glycine 0 C--N 1.286 -2.206 0 N-CA-C 109.029 -1.628 . . . . 0.0 109.029 176.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.698 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 10.5 t70 -92.87 -36.32 12.88 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 122.035 0.922 . . . . 0.0 109.504 -177.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.8 m -114.13 127.29 55.85 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 114.902 -1.045 . . . . 0.0 111.294 -173.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.9 p -132.79 153.75 38.54 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.629 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -178.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -112.85 112.96 24.82 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 -175.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -115.75 159.1 21.86 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.764 0.792 . . . . 0.0 111.737 -178.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.437 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 46.7 ttm -123.01 104.85 9.49 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 175.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -109.87 118.13 35.67 Favored 'General case' 0 C--N 1.286 -2.158 0 C-N-CA 118.147 -1.421 . . . . 0.0 109.626 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 78.9 mttt 62.41 27.69 16.46 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.222 1.009 . . . . 0.0 110.199 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.08 1.86 64.74 Favored Glycine 0 CA--C 1.524 0.598 0 CA-C-N 115.365 -0.834 . . . . 0.0 113.164 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.411 ' HA ' ' HD3' ' A' ' 31' ' ' PRO . 53.7 tt0 -104.11 107.55 57.5 Favored Pre-proline 0 C--N 1.32 -0.68 0 O-C-N 122.462 -0.434 . . . . 0.0 110.48 -179.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 30' ' ' GLN . 2.7 Cg_endo -83.23 120.31 2.9 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.119 2.546 . . . . 0.0 111.992 178.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . 0.49 ' HB2' ' CE2' ' A' ' 34' ' ' PHE . 90.4 mtp -134.82 156.35 49.04 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 120.892 0.377 . . . . 0.0 110.273 178.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.2 m -92.98 119.5 32.31 Favored 'General case' 0 C--N 1.295 -1.786 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.49 ' CE2' ' HB2' ' A' ' 32' ' ' MET . 86.0 m-85 -116.78 142.57 46.75 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -176.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.698 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 31.6 mtm105 -106.3 153.89 21.54 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 166.119 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.527 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 73.9 mt -83.82 129.4 34.94 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-O 121.651 0.738 . . . . 0.0 112.464 -175.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.429 HD13 ' HB2' ' A' ' 77' ' ' ASP . 52.5 mt -57.04 130.29 45.45 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.452 176.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.602 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 78.5 mt 73.55 11.27 4.79 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 124.551 1.157 . . . . 0.0 112.481 177.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 86.3 t -110.84 131.05 63.08 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 CA-C-O 121.252 0.548 . . . . 0.0 110.646 -179.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.404 ' HB2' ' HB2' ' A' ' 112' ' ' ALA . 22.0 t70 -128.31 107.17 9.54 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 174.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.57 ' HB ' ' HB2' ' A' ' 21' ' ' ASP . 1.3 m . . . . . 0 C--N 1.287 -2.11 0 CA-C-O 118.139 -0.934 . . . . 0.0 112.357 175.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 1.643 0 CA-C-O 119.141 -0.811 . . . . 0.0 113.451 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo -56.26 -36.34 96.73 Favored 'Trans proline' 0 C--N 1.373 1.837 0 C-N-CA 122.911 2.407 . . . . 0.0 112.517 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.8 mp0 -62.36 -51.77 66.3 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 122.973 0.509 . . . . 0.0 110.406 178.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.29 -41.64 85.07 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.841 -178.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.0 m -67.83 -33.97 75.81 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.395 0.617 . . . . 0.0 111.357 -177.133 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -70.95 -39.07 72.8 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.042 175.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -62.8 -41.95 99.5 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.318 -176.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.537 ' O ' HG22 ' A' ' 66' ' ' VAL . 7.5 p -63.47 -44.61 93.92 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.85 178.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.516 ' HG2' ' HB3' ' A' ' 17' ' ' ALA . 9.1 mtpm? -57.67 -49.03 77.84 Favored 'General case' 0 CA--C 1.513 -0.475 0 O-C-N 123.385 0.428 . . . . 0.0 110.472 176.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 97.1 mttt -57.36 -39.89 76.92 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.139 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.6 mmt -72.19 -51.38 21.44 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.537 HG22 ' O ' ' A' ' 62' ' ' THR . 34.6 m -74.33 -27.21 21.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 -174.018 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -86.19 -20.15 28.98 Favored 'General case' 0 C--N 1.314 -0.953 0 O-C-N 121.847 -0.533 . . . . 0.0 110.577 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -83.59 -24.66 31.4 Favored 'General case' 0 C--O 1.245 0.856 0 CA-C-O 121.158 0.504 . . . . 0.0 109.822 174.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.57 131.25 38.32 Favored 'General case' 0 C--O 1.248 1.013 0 CA-C-N 114.819 -1.082 . . . . 0.0 112.027 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -82.99 -37.49 23.94 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 115.117 -0.947 . . . . 0.0 108.69 177.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -133.09 119.8 20.46 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.781 -1.1 . . . . 0.0 108.182 -178.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 63.4 mt -99.51 112.56 32.17 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.658 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -114.31 142.14 46.7 Favored 'General case' 0 C--N 1.289 -2.023 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.083 -177.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -110.34 124.95 67.53 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.756 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.426 ' HA ' ' O ' ' A' ' 8' ' ' HIS . 34.2 tt0 -115.28 125.62 53.51 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -96.55 129.18 43.98 Favored 'General case' 0 N--CA 1.406 -2.627 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.851 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.429 ' HB2' HD13 ' A' ' 37' ' ' LEU . 17.2 t70 -85.51 -174.37 5.14 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 125.117 1.367 . . . . 0.0 110.031 -176.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.655 ' NZ ' ' HA ' ' A' ' 78' ' ' LYS . 1.1 mmpm? -94.78 7.85 44.52 Favored 'General case' 0 C--N 1.313 -0.993 0 O-C-N 121.458 -0.776 . . . . 0.0 112.144 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -84.15 -137.2 3.43 Favored Glycine 0 N--CA 1.428 -1.867 0 C-N-CA 120.775 -0.726 . . . . 0.0 111.899 175.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -95.23 144.22 26.01 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.6 ttm180 -87.07 -29.18 22.09 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.162 0.506 . . . . 0.0 110.528 178.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.0 p . . . . . 0 C--N 1.294 -1.829 0 CA-C-O 121.353 0.597 . . . . 0.0 111.561 -178.152 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.504 ' HG2' ' HG3' ' A' ' 35' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.509 -0.598 0 CA-C-O 121.326 0.584 . . . . 0.0 110.176 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -103.76 152.28 17.79 Favored Glycine 0 N--CA 1.42 -2.374 0 N-CA-C 106.859 -2.496 . . . . 0.0 106.859 168.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 93.6 mt -109.03 122.5 47.39 Favored 'General case' 0 C--N 1.282 -2.333 0 CA-C-N 117.972 0.886 . . . . 0.0 110.442 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -144.16 157.85 44.06 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.116 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.487 ' CZ ' ' HB2' ' A' ' 100' ' ' ASN . 4.3 t80 -103.83 129.73 51.32 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 105.546 -2.02 . . . . 0.0 105.546 174.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 41.6 mm -99.32 125.73 52.8 Favored 'Isoleucine or valine' 0 C--O 1.249 1.042 0 C-N-CA 119.731 -0.788 . . . . 0.0 111.892 -178.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -110.79 131.6 54.91 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.983 173.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.67 98.26 8.03 Favored 'General case' 0 C--N 1.289 -2.052 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 175.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.251 4.1 p30 44.92 32.12 0.79 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.209 1.404 . . . . 0.0 114.137 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.21 2.16 35.77 Favored Glycine 0 CA--C 1.521 0.442 0 CA-C-N 115.676 -0.693 . . . . 0.0 113.445 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.7 mttp -99.78 126.88 45.92 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 175.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -78.13 105.5 9.39 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 122.815 0.446 . . . . 0.0 110.401 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 57.6 t -71.51 -43.05 72.46 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.332 -178.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.527 ' ND2' ' HB3' ' A' ' 36' ' ' LEU . 1.7 m-20 -58.76 -49.82 76.2 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.957 -178.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -63.84 -37.16 86.34 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.542 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.55 -44.6 93.19 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.898 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.13 -52.75 64.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.747 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.1 t -65.05 -41.45 92.02 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.276 -177.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 34.4 ttp85 -64.23 -31.98 73.39 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.922 0.391 . . . . 0.0 111.291 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -87.99 -1.05 57.75 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.954 0.354 . . . . 0.0 111.954 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.433 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 74.44 22.14 77.85 Favored Glycine 0 N--CA 1.441 -0.997 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.428 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.3 mt -91.67 -6.24 52.44 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -151.85 162.95 40.22 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.005 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt -120.34 154.74 34.62 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 178.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.6 p -76.98 127.97 37.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 C-N-CA 118.656 -1.218 . . . . 0.0 112.28 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.602 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . . . . . . 0 C--N 1.299 -1.603 0 N-CA-C 105.225 -2.139 . . . . 0.0 105.225 171.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 69.9 m80 . . . . . 0 C--O 1.223 -0.309 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -60.64 -59.84 4.75 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.467 -174.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . 0.464 ' O ' ' HG2' ' B' ' 140' ' ' LYS . 13.7 mm100 -54.99 -44.57 74.6 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 123.946 0.779 . . . . 0.0 111.885 -176.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 91.2 mt -60.24 -47.4 86.14 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.652 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.58 -35.5 75.4 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 178.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -60.62 -45.21 94.89 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 120.759 0.314 . . . . 0.0 110.296 176.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' B' ' 136' ' ' GLN . 2.8 mmmp? -63.43 -44.91 93.21 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.436 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 8.1 p -70.2 -41.07 74.17 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.327 -178.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.529 ' HG3' ' CZ2' ' B' ' 153' ' ' TRP . 39.3 tt0 -65.94 -44.84 83.86 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.516 177.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -54.29 -43.4 71.03 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 120.999 0.428 . . . . 0.0 110.591 -179.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -64.73 -46.85 80.47 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.526 178.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.13 -35.73 80.36 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.915 -178.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 146' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 88.8 mttt -62.33 -38.77 90.76 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.971 0.415 . . . . 0.0 110.334 176.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 9.9 mtpm? -63.99 -40.63 96.79 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.226 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -86.35 -8.12 57.94 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.337 -175.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . 0.515 ' O ' ' HB2' ' B' ' 154' ' ' SER . 51.0 mtpt 49.7 58.83 5.0 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 124.092 0.957 . . . . 0.0 111.119 -177.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 90.8 mt -88.52 119.51 29.04 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.299 -178.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 151' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 90.9 m-20 52.5 -93.46 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.163 1.385 . . . . 0.0 113.885 176.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 35.3 mt -65.64 -31.4 53.61 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.593 0 CA-C-O 121.087 0.47 . . . . 0.0 110.569 178.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 153' ' ' TRP . . . . . 0.529 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 58.8 m95 -77.94 -6.49 54.54 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-O 122.101 0.953 . . . . 0.0 111.117 -178.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . 0.515 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 19.9 t -99.87 18.62 17.87 Favored 'General case' 0 N--CA 1.411 -2.4 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.14 175.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -71.25 -17.62 62.48 Favored 'General case' 0 C--N 1.356 0.86 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 173.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.1 t70 . . . . . 0 CA--C 1.5 -0.966 0 CA-C-N 113.339 -1.755 . . . . 0.0 112.1 175.08 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 25.5 p80 . . . . . 0 C--O 1.232 0.148 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.579 ' H ' ' HD3' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -94.49 132.23 39.37 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 174.7 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.48 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 3.9 pt-20 -117.38 144.37 33.85 Favored Pre-proline 0 C--N 1.262 -3.217 0 CA-C-N 114.423 -1.262 . . . . 0.0 110.847 -175.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.48 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 23.5 Cg_exo -63.92 138.91 65.34 Favored 'Trans proline' 0 C--N 1.359 1.098 0 C-N-CA 123.07 2.514 . . . . 0.0 114.301 -174.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.587 ' O ' ' HB ' ' A' ' 72' ' ' ILE . . . -136.08 151.68 50.08 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.488 178.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.418 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 86.7 m -98.94 133.2 43.55 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 178.158 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.489 ' H ' HD23 ' A' ' 14' ' ' LEU . 2.2 pt? -80.93 141.31 34.64 Favored 'General case' 0 C--N 1.306 -1.292 0 C-N-CA 118.498 -1.281 . . . . 0.0 109.255 177.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 74.1 mt -101.36 -53.56 7.51 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 175.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -161.67 156.99 23.82 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.489 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.473 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -112.54 119.11 37.06 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 174.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 59.8 mt -85.71 -64.03 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 CA-C-O 121.192 0.52 . . . . 0.0 109.747 -175.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -135.93 -168.79 2.28 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.172 -0.922 . . . . 0.0 108.526 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -74.11 -22.54 77.69 Favored Glycine 0 C--N 1.314 -0.661 0 C-N-CA 120.657 -0.783 . . . . 0.0 112.615 -177.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.438 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 9.6 p-10 -100.63 -20.36 15.69 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 122.304 0.242 . . . . 0.0 110.756 -176.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 p -127.73 118.8 24.46 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.3 m -128.11 157.45 40.33 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.916 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 176.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -119.89 119.22 32.87 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -178.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.9 mp -125.25 159.57 31.33 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.501 0.667 . . . . 0.0 112.2 -175.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.455 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 48.0 ttm -122.8 107.09 11.51 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 124.177 0.991 . . . . 0.0 108.497 177.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -113.18 126.89 55.93 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.9 mttt 59.0 27.66 16.66 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 121.613 0.721 . . . . 0.0 111.0 178.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 88.03 7.05 74.49 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.749 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.455 ' O ' ' HA ' ' A' ' 26' ' ' MET . 17.6 mm-40 -103.88 104.11 41.11 Favored Pre-proline 0 C--N 1.319 -0.74 0 O-C-N 122.422 -0.457 . . . . 0.0 110.511 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -81.07 113.83 2.77 Favored 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.623 2.215 . . . . 0.0 110.685 176.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 65.6 mtt -135.14 149.85 50.07 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.6 m -87.75 129.68 35.09 Favored 'General case' 0 C--N 1.295 -1.804 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 175.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -113.51 138.9 49.47 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -173.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.438 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 10.6 tpp85 -107.99 129.46 55.12 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 106.324 -1.732 . . . . 0.0 106.324 168.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.406 HD22 HD12 ' A' ' 103' ' ' LEU . 6.9 mp -64.94 122.02 16.02 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.5 0.667 . . . . 0.0 111.066 178.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.4 tt -66.35 130.18 42.33 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.98 -1.009 . . . . 0.0 108.699 -177.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 70.3 mt 79.5 8.16 1.76 Allowed 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 124.938 1.295 . . . . 0.0 111.611 -177.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 54.2 t -115.41 126.44 72.97 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 CA-C-O 121.175 0.512 . . . . 0.0 110.543 179.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -141.68 108.01 5.27 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.325 175.121 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.3 m . . . . . 0 C--N 1.282 -2.351 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.143 173.159 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.863 0 CA-C-O 119.121 -0.821 . . . . 0.0 113.157 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -54.44 -38.74 89.66 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 122.776 2.317 . . . . 0.0 111.852 176.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -63.25 -56.82 13.35 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.737 178.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.48 -51.07 69.85 Favored 'General case' 0 CA--C 1.516 -0.351 0 O-C-N 124.018 0.824 . . . . 0.0 111.943 -176.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.515 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 13.9 p -64.8 -44.46 89.87 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.846 -0.616 . . . . 0.0 112.661 -177.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -69.98 -34.81 73.84 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -59.66 -49.22 78.58 Favored 'General case' 0 C--O 1.244 0.767 0 C-N-CA 123.116 0.566 . . . . 0.0 110.758 -177.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.9 m -61.6 -42.02 98.27 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.138 178.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.515 ' HG3' ' O ' ' A' ' 59' ' ' SER . 29.7 mtpp -57.28 -46.79 82.79 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.646 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 97.6 mttt -65.89 -42.43 90.29 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.641 -0.708 . . . . 0.0 111.331 -178.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.1 mmt -64.05 -44.71 91.66 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 123.557 0.536 . . . . 0.0 112.373 -179.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.5 m -72.38 -29.23 30.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -176.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -82.65 -26.97 31.66 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 119.915 -0.714 . . . . 0.0 110.979 178.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -73.08 -27.87 61.97 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.533 ' HA ' ' OD1' ' A' ' 95' ' ' ASP . . . -55.09 121.02 7.85 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 114.63 -1.168 . . . . 0.0 112.481 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.47 ' HD2' ' N ' ' A' ' 70' ' ' LYS . 9.3 mptt -82.88 -31.09 28.07 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 174.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.6 mtpp -127.21 126.97 43.71 Favored 'General case' 0 N--CA 1.426 -1.64 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.587 ' HB ' ' O ' ' A' ' 12' ' ' ALA . 3.7 mp -113.64 113.15 43.1 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.194 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 178.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.521 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 24.8 mt-10 -113.01 137.46 51.37 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 -177.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.1 m -110.29 127.04 67.53 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 177.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -114.11 140.45 48.48 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.717 -175.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -109.92 116.82 32.31 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 124.204 1.002 . . . . 0.0 110.963 -177.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -88.36 -174.28 4.55 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 176.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -60.1 -13.08 10.12 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -175.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -76.6 -151.08 3.73 Favored Glycine 0 C--N 1.313 -0.706 0 CA-C-O 121.497 0.499 . . . . 0.0 114.155 -173.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -89.81 155.86 18.88 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 42.4 ttt180 -91.75 -3.51 56.12 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 122.357 1.075 . . . . 0.0 108.615 178.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.8 p . . . . . 0 N--CA 1.438 -1.058 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.566 179.331 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.443 -0.787 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -112.79 144.64 18.02 Favored Glycine 0 N--CA 1.42 -2.403 0 N-CA-C 108.789 -1.724 . . . . 0.0 108.789 171.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 59.4 mt -101.64 110.48 22.48 Favored 'General case' 0 CA--C 1.491 -1.307 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 178.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.12 155.47 32.6 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 177.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . 0.302 54.2 p90 -110.06 140.84 43.68 Favored 'General case' 0 N--CA 1.424 -1.746 0 C-N-CA 119.241 -0.983 . . . . 0.0 112.456 176.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 34.4 mm -98.92 131.0 46.96 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 CA-C-N 115.551 -0.749 . . . . 0.0 112.695 -166.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.521 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 82.8 m-85 -107.66 127.67 53.87 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 168.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.426 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -105.15 99.4 9.02 Favored 'General case' 0 C--N 1.289 -2.05 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 176.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.533 ' OD1' ' HA ' ' A' ' 69' ' ' ALA . 6.2 p-10 45.01 41.72 5.68 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.09 1.356 . . . . 0.0 113.191 -178.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.95 -23.39 27.74 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.293 -0.867 . . . . 0.0 113.337 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -87.52 113.65 23.4 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . 0.484 ' HE3' ' HB2' ' A' ' 101' ' ' GLU . 52.2 ttp -74.99 105.42 6.0 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 45.2 t -64.12 -29.82 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-O 121.679 0.752 . . . . 0.0 109.665 -175.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -61.08 -40.07 92.32 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.067 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.506 ' OE2' ' HD3' ' A' ' 105' ' ' ARG . 11.4 tp10 -64.94 -54.05 36.75 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 114.883 -1.053 . . . . 0.0 108.338 176.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -53.1 -48.38 67.84 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.112 -0.949 . . . . 0.0 113.129 -176.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.406 HD12 HD22 ' A' ' 36' ' ' LEU . 85.1 mt -59.87 -48.14 82.89 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 78.7 t -73.01 -35.06 47.57 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 CA-C-O 120.981 0.42 . . . . 0.0 110.292 -178.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.506 ' HD3' ' OE2' ' A' ' 101' ' ' GLU . 4.0 tpt180 -65.5 -41.05 93.65 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 123.388 0.675 . . . . 0.0 110.174 -178.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -83.99 -3.1 57.75 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.887 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.98 39.05 85.31 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 121.077 -0.582 . . . . 0.0 112.744 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 92.3 mt -102.17 4.4 39.43 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-O 121.938 0.875 . . . . 0.0 109.586 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -165.18 165.36 19.8 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 114.513 -1.221 . . . . 0.0 107.862 178.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.4 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 83.1 mttt -111.53 165.75 11.73 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 174.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.457 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 78.1 t -76.76 136.46 24.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.631 177.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.379 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.976 179.971 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 . . . . . 0 CA--C 1.504 -0.804 0 CA-C-O 120.973 0.416 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.548 ' OE2' ' HD2' ' B' ' 139' ' ' ARG . 2.4 tm-20 -69.15 -47.92 63.72 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.373 -178.527 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -63.84 -33.32 75.43 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.354 0.597 . . . . 0.0 110.516 176.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 78.8 mt -70.41 -50.57 37.19 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.729 -177.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.21 -33.6 75.71 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.713 0.292 . . . . 0.0 111.586 177.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 139' ' ' ARG . . . . . 0.548 ' HD2' ' OE2' ' B' ' 135' ' ' GLU . 84.2 mtt180 -66.81 -27.92 67.95 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 177.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 28.5 ttpp -71.37 -39.88 70.96 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 177.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 15.2 m -62.39 -45.66 92.15 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 114.832 -1.076 . . . . 0.0 109.249 175.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.525 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 40.2 tt0 -59.44 -48.08 83.01 Favored 'General case' 0 C--O 1.204 -1.291 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.652 177.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -56.65 -40.97 76.42 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 122.693 0.397 . . . . 0.0 110.993 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -67.78 -47.37 69.34 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.04 178.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -64.15 -34.06 77.21 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.707 -178.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 146' ' ' LYS . . . . . 0.525 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 89.8 mttt -61.87 -46.88 87.48 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 177.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -69.85 -35.41 74.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.222 -177.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 59.7 mm-40 -74.36 -17.25 60.85 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.195 177.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt 57.03 56.51 5.25 Favored 'General case' 0 CA--C 1.514 -0.424 0 C-N-CA 124.785 1.234 . . . . 0.0 110.49 -178.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 91.8 mt -91.55 121.37 33.18 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.76 -176.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 51.24 -92.51 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 125.481 1.513 . . . . 0.0 113.898 178.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 24.5 mt -65.2 -33.98 67.37 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.899 0 CA-C-O 121.058 0.456 . . . . 0.0 110.979 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 153' ' ' TRP . . . . . 0.518 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 63.7 m95 -75.96 -6.09 49.31 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.573 0.701 . . . . 0.0 111.465 -177.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 42.3 t -92.72 16.31 12.57 Favored 'General case' 0 N--CA 1.425 -1.704 0 CA-C-N 115.433 -0.803 . . . . 0.0 108.916 174.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -63.03 -21.79 66.41 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.494 0.664 . . . . 0.0 110.11 174.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 . . . . . 0 N--CA 1.427 -1.592 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 176.989 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 83.8 t60 . . . . . 0 N--CA 1.435 -1.192 0 CA-C-O 121.277 0.56 . . . . 0.0 112.035 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.408 ' HB3' ' HB2' ' A' ' 75' ' ' GLU . 62.2 pttt -116.13 159.62 21.5 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.042 176.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -134.71 159.8 70.81 Favored Pre-proline 0 C--N 1.3 -1.551 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 178.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -81.68 140.51 11.75 Favored 'Trans proline' 0 C--O 1.244 0.824 0 C-N-CA 123.007 2.472 . . . . 0.0 111.138 175.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -127.64 162.87 25.51 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.805 178.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.501 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 36.5 m -98.16 131.47 44.51 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.6 tp -84.28 122.19 28.55 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 -179.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 72.4 mt -93.0 -59.74 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.501 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -161.22 143.58 12.24 Favored 'General case' 0 N--CA 1.416 -2.128 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.055 -178.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.478 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -96.25 108.31 20.77 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 105.966 -1.864 . . . . 0.0 105.966 171.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 70.6 mt -81.85 -53.87 11.08 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.417 0 CA-C-O 121.345 0.593 . . . . 0.0 110.795 -173.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.534 ' HB2' ' H ' ' A' ' 22' ' ' THR . 11.8 m-20 -128.55 -175.35 3.5 Favored 'General case' 0 C--N 1.295 -1.803 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 -179.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -94.98 46.43 2.06 Favored Glycine 0 C--N 1.304 -1.218 0 N-CA-C 108.571 -1.812 . . . . 0.0 108.571 173.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.586 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 9.6 t70 -171.48 -52.74 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 105.926 -1.879 . . . . 0.0 105.926 -172.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.534 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 1.3 m -91.54 118.49 30.64 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 113.868 -1.514 . . . . 0.0 110.56 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.4 m -133.16 151.04 33.27 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.931 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 177.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -116.03 116.04 27.18 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 -177.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.9 mp -123.93 159.06 30.55 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.274 0.559 . . . . 0.0 111.028 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.501 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 57.2 ttp -120.67 111.83 18.12 Favored 'General case' 0 C--N 1.293 -1.862 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 175.127 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 44.1 p90 -106.93 110.34 22.46 Favored 'General case' 0 CA--C 1.485 -1.523 0 C-N-CA 119.163 -1.015 . . . . 0.0 110.748 -178.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 97.2 mttt 53.43 38.99 29.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.716 -178.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.497 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 95.26 2.18 62.25 Favored Glycine 0 N--CA 1.448 -0.535 0 CA-C-N 113.796 -1.547 . . . . 0.0 113.766 177.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.438 ' O ' ' HA ' ' A' ' 26' ' ' MET . 2.4 mp0 -100.48 97.56 6.69 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 117.0 0.4 . . . . 0.0 110.545 177.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.497 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 1.8 Cg_endo -83.39 105.51 1.27 Allowed 'Trans proline' 0 C--O 1.243 0.743 0 C-N-CA 122.964 2.443 . . . . 0.0 111.192 179.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 66.3 mtt -129.32 153.18 48.1 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.082 0.467 . . . . 0.0 110.385 -177.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.8 m -89.67 119.72 30.32 Favored 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 107.646 -1.242 . . . . 0.0 107.646 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -101.52 150.18 23.33 Favored 'General case' 0 C--N 1.282 -2.357 0 CA-C-O 121.654 0.74 . . . . 0.0 111.629 -176.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.615 ' HB2' ' NH1' ' A' ' 87' ' ' ARG . 9.7 mmt85 -127.43 127.07 43.51 Favored 'General case' 0 C--N 1.283 -2.295 0 N-CA-C 103.541 -2.763 . . . . 0.0 103.541 171.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.426 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 9.3 mt -68.72 133.08 47.89 Favored 'General case' 0 C--N 1.289 -2.038 0 O-C-N 123.709 0.631 . . . . 0.0 109.995 -173.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.4 mt -61.4 137.03 58.23 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.891 176.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 67.5 mt 73.92 14.35 4.02 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 124.391 1.057 . . . . 0.0 113.056 175.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 85.3 t -110.74 126.46 68.08 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.569 0 CA-C-O 121.109 0.48 . . . . 0.0 110.662 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -125.01 108.24 11.63 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 115.421 -0.808 . . . . 0.0 109.549 175.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 p . . . . . 0 C--N 1.29 -1.985 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.935 176.916 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.492 0 CA-C-O 119.077 -0.846 . . . . 0.0 114.844 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -60.09 -38.99 73.65 Favored 'Trans proline' 0 C--N 1.366 1.462 0 C-N-CA 122.65 2.233 . . . . 0.0 112.663 -179.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -62.43 -47.9 82.03 Favored 'General case' 0 C--O 1.245 0.868 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.624 -177.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.93 -43.79 87.05 Favored 'General case' 0 C--O 1.242 0.709 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.772 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.407 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 22.7 p -64.8 -46.07 83.6 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -67.86 -36.04 79.6 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 120.589 0.233 . . . . 0.0 111.421 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -61.49 -47.37 85.93 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.076 178.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.443 ' O ' HG22 ' A' ' 66' ' ' VAL . 40.8 m -60.47 -44.93 95.39 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.688 -178.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.478 ' HG2' ' HB3' ' A' ' 17' ' ' ALA . 44.4 mtpt -59.22 -49.79 76.51 Favored 'General case' 0 C--N 1.345 0.402 0 O-C-N 123.23 0.331 . . . . 0.0 110.468 178.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -55.42 -44.48 76.29 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.986 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.9 mmt -71.02 -38.38 72.6 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -177.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.443 HG22 ' O ' ' A' ' 62' ' ' THR . 35.3 m -80.67 -31.83 12.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 -178.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -76.09 -27.71 57.28 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 121.4 0.619 . . . . 0.0 110.36 177.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -67.42 -31.39 71.56 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.905 176.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.539 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -69.89 131.31 44.25 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.737 -177.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -78.95 -41.34 29.56 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 171.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.3 mtmt -113.96 131.42 56.33 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 114.832 -1.076 . . . . 0.0 108.664 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 3.9 mp -111.43 117.92 56.24 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.364 0 N-CA-C 105.221 -2.14 . . . . 0.0 105.221 174.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.536 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 23.2 mt-10 -112.75 140.01 47.89 Favored 'General case' 0 C--N 1.295 -1.776 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.875 -172.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.48 HG12 ' CD1' ' A' ' 92' ' ' ILE . 10.1 m -116.38 117.66 56.23 Favored 'Isoleucine or valine' 0 C--O 1.25 1.092 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.398 178.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.408 ' HB2' ' HB3' ' A' ' 9' ' ' LYS . 23.8 tt0 -109.14 143.5 38.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.842 0.353 . . . . 0.0 111.188 -176.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -94.14 147.81 22.79 Favored 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 124.7 1.2 . . . . 0.0 110.31 -176.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -116.29 -175.81 2.82 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 176.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.52 -26.73 68.03 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.409 0.684 . . . . 0.0 112.16 -175.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -72.64 -115.43 0.06 OUTLIER Glycine 0 N--CA 1.445 -0.719 0 CA-C-N 115.888 -0.596 . . . . 0.0 113.436 -177.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -124.64 165.09 18.51 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 122.28 -0.541 . . . . 0.0 109.761 -178.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 44.2 ttt85 -104.65 -13.18 16.04 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-O 121.783 0.801 . . . . 0.0 108.987 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.8 p . . . . . 0 N--CA 1.436 -1.14 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.176 178.19 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.615 ' NH1' ' HB2' ' A' ' 35' ' ' ARG . 0.8 OUTLIER . . . . . 0 N--CA 1.442 -0.842 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -80.82 144.89 25.54 Favored Glycine 0 C--N 1.305 -1.185 0 C-N-CA 121.031 -0.604 . . . . 0.0 113.281 -177.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.0 mt -117.48 97.9 6.12 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.172 -1.048 . . . . 0.0 108.172 177.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.63 161.64 39.89 Favored 'General case' 0 C--N 1.313 -0.999 0 C-N-CA 120.223 -0.591 . . . . 0.0 111.414 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -88.86 127.4 35.63 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 105.951 -1.87 . . . . 0.0 105.951 170.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.48 ' CD1' HG12 ' A' ' 74' ' ' VAL . 45.7 mm -99.55 123.75 52.48 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.072 -179.405 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.536 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 77.5 m-85 -109.18 132.51 54.05 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 175.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.539 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -105.35 100.54 10.11 Favored 'General case' 0 C--N 1.285 -2.234 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 176.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.498 ' OD2' ' HA ' ' A' ' 69' ' ' ALA . 3.0 p30 46.32 29.97 0.95 Allowed 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 124.928 1.291 . . . . 0.0 113.472 -174.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.44 -9.8 38.67 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.852 -0.613 . . . . 0.0 113.435 -179.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -83.53 121.87 27.79 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 175.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 34.2 ttp -80.68 99.47 8.2 Favored 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 179.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 48.7 t -58.36 -43.62 86.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 114.781 -1.1 . . . . 0.0 112.795 -169.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.426 ' HB3' ' HB3' ' A' ' 36' ' ' LEU . 24.7 p-10 -66.5 -31.4 72.1 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.499 -176.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -77.61 -40.64 41.35 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.94 -39.25 77.58 Favored 'General case' 0 C--O 1.222 -0.351 0 O-C-N 123.741 0.651 . . . . 0.0 110.737 179.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.17 -44.66 94.83 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.915 177.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 95.0 t -70.26 -47.57 66.19 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.302 -178.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 11.5 ttp85 -60.45 -37.82 82.2 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 177.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -82.3 0.93 39.31 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-O 120.678 0.275 . . . . 0.0 111.575 177.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.85 38.06 93.95 Favored Glycine 0 C--O 1.221 -0.712 0 CA-C-N 116.276 -0.42 . . . . 0.0 113.688 177.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.4 mt -100.62 -13.66 18.48 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.377 0.608 . . . . 0.0 110.22 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -152.13 160.19 43.47 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -105.56 164.15 12.11 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 106.759 -1.571 . . . . 0.0 106.759 177.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.457 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 82.5 t -71.38 128.39 34.44 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.507 177.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -1.034 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 176.243 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 . . . . . 0 N--CA 1.448 -0.57 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.3 -38.7 91.02 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.988 -1.005 . . . . 0.0 109.689 -175.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -61.79 -33.92 74.96 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.981 178.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 88.4 mt -66.12 -46.43 77.57 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.618 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 7.8 mp -65.98 -29.13 69.46 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.367 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -61.85 -41.41 97.79 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.334 0.587 . . . . 0.0 109.866 175.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -70.65 -39.73 73.46 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.32 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 50.3 m -63.88 -46.18 86.05 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.487 177.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.586 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 41.7 tt0 -61.73 -50.75 71.18 Favored 'General case' 0 C--O 1.204 -1.326 0 O-C-N 123.469 0.481 . . . . 0.0 109.825 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.15 -38.15 73.12 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 123.48 0.488 . . . . 0.0 111.243 -179.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 144' ' ' GLN . . . . . 0.499 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 14.6 tt0 -66.47 -48.81 68.72 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -65.34 -33.61 76.39 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.483 -176.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 146' ' ' LYS . . . . . 0.586 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 88.1 mttt -59.33 -51.33 70.38 Favored 'General case' 0 C--N 1.345 0.409 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 176.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -69.7 -34.41 73.88 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.375 -0.83 . . . . 0.0 112.052 -177.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 57.6 mm-40 -74.08 -18.63 60.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.644 177.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 23.4 mtpp 59.28 48.17 10.55 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 125.234 1.414 . . . . 0.0 110.437 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 99.4 mt -84.45 119.99 25.78 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.233 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 53.9 -93.43 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.229 0 O-C-N 124.781 1.3 . . . . 0.0 112.6 176.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 152' ' ' ILE . . . . . 0.509 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 29.5 mt -60.34 -43.8 94.5 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.654 0 C-N-CA 122.121 0.168 . . . . 0.0 111.331 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -71.48 -4.03 24.36 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.987 0.899 . . . . 0.0 112.774 -172.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 27.9 t -80.35 -5.23 56.05 Favored 'General case' 0 C--N 1.291 -1.942 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.45 171.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 21.4 pt-20 -69.93 -25.08 63.49 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 121.543 0.687 . . . . 0.0 109.704 175.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.5 t70 . . . . . 0 C--N 1.309 -1.166 0 CA-C-N 114.843 -1.072 . . . . 0.0 109.654 -178.175 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 45.3 m80 . . . . . 0 CA--C 1.516 -0.351 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.7 ttmt -105.14 127.1 52.75 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 172.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -114.0 149.35 41.76 Favored Pre-proline 0 C--N 1.296 -1.749 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 173.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -80.16 141.1 14.41 Favored 'Trans proline' 0 C--N 1.311 -1.408 0 C-N-CA 121.928 1.752 . . . . 0.0 110.399 174.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.447 ' HB1' ' HB3' ' A' ' 25' ' ' LEU . . . -136.19 155.98 49.35 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 121.103 0.477 . . . . 0.0 112.156 -178.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.415 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 72.7 m -111.86 140.76 46.25 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 176.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.446 ' HB2' ' CD1' ' A' ' 72' ' ' ILE . 52.3 tp -83.14 125.48 31.56 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 118.312 0.505 . . . . 0.0 110.424 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 44.5 mm -89.18 -53.18 9.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 174.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -164.36 145.83 8.44 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -105.99 119.44 39.19 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 49.5 mm -90.56 -55.77 5.88 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -177.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.497 ' HB2' ' H ' ' A' ' 22' ' ' THR . 32.4 m-20 -125.83 -166.56 1.58 Allowed 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -85.2 -13.61 70.88 Favored Glycine 0 C--O 1.21 -1.397 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 173.038 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.579 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 0.4 OUTLIER -101.29 -54.03 2.87 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 122.485 1.136 . . . . 0.0 108.099 -178.864 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.497 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 6.8 m -82.49 105.81 13.85 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 114.268 -1.333 . . . . 0.0 111.334 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.3 m -129.27 137.27 57.46 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.609 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 177.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.505 ' HA ' ' HA ' ' A' ' 33' ' ' THR . 46.6 tttp -101.19 119.1 38.24 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.61 -0.682 . . . . 0.0 110.144 -176.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.447 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 3.3 mm? -116.25 146.73 42.13 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 121.453 0.644 . . . . 0.0 110.765 -177.464 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.484 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 26.5 ttt -107.01 108.59 20.17 Favored 'General case' 0 C--N 1.286 -2.17 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 175.019 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 10.8 p90 -115.55 116.88 28.91 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 -177.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 99.3 mttt 57.51 32.59 22.04 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 124.131 0.895 . . . . 0.0 110.921 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.96 3.76 61.87 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 114.738 -1.119 . . . . 0.0 114.142 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.484 ' O ' ' HA ' ' A' ' 26' ' ' MET . 20.3 mt-30 -107.53 103.86 50.53 Favored Pre-proline 0 C--N 1.311 -1.08 0 O-C-N 122.401 -0.47 . . . . 0.0 111.224 -179.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -80.85 95.26 0.97 Allowed 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 122.757 2.304 . . . . 0.0 111.268 177.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 26.5 mmt -119.78 145.49 46.53 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.745 -176.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.505 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 11.4 m -86.52 118.76 26.15 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -109.21 162.07 14.64 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 123.551 0.74 . . . . 0.0 111.071 -176.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.579 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 20.7 mtp180 -133.23 142.6 48.65 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 169.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.6 mp -61.48 119.55 8.8 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -175.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.1 mt -55.36 128.08 32.52 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.767 176.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.0 mt 68.17 23.2 8.0 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 124.829 1.331 . . . . 0.0 112.211 174.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 90.6 t -128.75 131.53 68.42 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.155 0 O-C-N 122.101 -0.374 . . . . 0.0 110.301 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -107.33 106.87 17.51 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 105.634 -1.987 . . . . 0.0 105.634 168.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.5 m . . . . . 0 CA--C 1.567 1.612 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 175.617 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.45 ' N ' ' HD2' ' A' ' 56' ' ' PRO . . . . . . . . 0 CA--C 1.534 1.254 0 CA-C-O 119.412 -0.66 . . . . 0.0 113.322 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' ' 55' ' ' GLY . 4.7 Cg_endo -49.64 -34.31 34.3 Favored 'Trans proline' 0 CA--C 1.553 1.427 0 C-N-CA 123.44 2.76 . . . . 0.0 114.016 175.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -83.39 -39.4 20.7 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 121.864 -0.523 . . . . 0.0 110.921 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.95 -40.25 94.74 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.929 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.437 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 9.0 p -65.33 -43.53 90.65 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.461 179.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.92 -47.38 85.24 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 123.614 0.571 . . . . 0.0 109.885 177.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -57.26 -49.83 74.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.14 178.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 36.8 m -59.94 -50.83 72.2 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.827 -177.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.518 ' HE3' ' OE1' ' A' ' 67' ' ' GLU 0.339 0.1 OUTLIER -64.38 -38.23 90.3 Favored 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -179.482 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.411 ' HG3' ' HD3' ' A' ' 63' ' ' LYS . 28.9 mtpp -66.45 -40.67 89.55 Favored 'General case' 0 N--CA 1.436 -1.169 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 177.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 14.7 tpt -62.68 -45.85 90.87 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.266 -178.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.8 m -80.71 -31.44 12.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -176.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.518 ' OE1' ' HE3' ' A' ' 63' ' ' LYS . 45.1 mt-10 -77.66 -33.42 53.41 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.146 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -78.1 -20.81 51.46 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.461 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -64.22 147.74 51.68 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.793 179.143 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -71.12 -61.34 1.8 Allowed 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.853 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.0 mtmm -125.55 150.91 47.04 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 178.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.446 ' CD1' ' HB2' ' A' ' 14' ' ' LEU . 69.2 mt -105.58 134.26 47.6 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.231 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 175.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.547 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 1.5 mm-40 -111.92 133.24 54.24 Favored 'General case' 0 N--CA 1.424 -1.771 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -178.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 31.4 m -111.52 118.19 56.91 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 174.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -114.22 137.33 51.91 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.153 0.501 . . . . 0.0 109.756 -178.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -106.86 138.99 41.99 Favored 'General case' 0 C--N 1.282 -2.338 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.176 -178.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -86.51 -174.27 4.92 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -76.31 -2.5 31.9 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -176.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.59 -119.25 1.15 Allowed Glycine 0 N--CA 1.442 -0.927 0 C-N-CA 121.576 -0.345 . . . . 0.0 112.857 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 70.6 mm-40 -99.75 164.04 12.21 Favored 'General case' 0 C--N 1.293 -1.869 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -175.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -108.89 -37.96 5.72 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.6 p . . . . . 0 C--N 1.312 -1.051 0 CA-C-N 115.363 -0.835 . . . . 0.0 108.827 179.604 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.416 ' HD3' ' O ' ' A' ' 33' ' ' THR . 3.3 tpp180 . . . . . 0 N--CA 1.415 -2.176 0 N-CA-C 106.759 -1.571 . . . . 0.0 106.759 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -78.66 151.58 36.11 Favored Glycine 0 N--CA 1.428 -1.867 0 N-CA-C 111.209 -0.757 . . . . 0.0 111.209 -179.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 85.6 mt -119.94 105.04 10.68 Favored 'General case' 0 C--N 1.288 -2.093 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -138.76 152.48 47.98 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-O 121.279 0.561 . . . . 0.0 111.689 -176.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -95.21 123.57 38.79 Favored 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 105.078 -2.193 . . . . 0.0 105.078 175.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 47.4 mm -99.27 129.06 50.29 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-O 121.452 0.644 . . . . 0.0 112.131 -171.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.547 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 26.1 m-85 -114.83 142.94 45.87 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 172.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.461 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -105.38 98.85 8.49 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 175.411 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.4 t70 45.71 40.04 5.79 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.179 1.392 . . . . 0.0 110.544 -173.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.69 -22.07 31.02 Favored Glycine 0 N--CA 1.444 -0.811 0 CA-C-N 115.182 -0.917 . . . . 0.0 114.509 178.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -80.83 132.98 35.52 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 117.975 0.888 . . . . 0.0 110.772 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 51.9 mtm -77.78 100.86 6.45 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -175.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 57.9 t -66.83 -48.02 81.02 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.618 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -56.63 -44.75 81.54 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.659 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -68.2 -42.53 79.74 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.3 -179.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.74 -45.13 86.26 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.066 0.546 . . . . 0.0 111.407 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 89.3 mt -57.82 -50.25 73.91 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.95 0.405 . . . . 0.0 111.297 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.6 t -69.89 -36.55 69.77 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.778 -178.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 14.3 tpp85 -62.69 -37.93 88.4 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.96 0.904 . . . . 0.0 111.18 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -91.07 3.9 53.54 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.976 -177.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.1 36.21 92.69 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 121.278 -0.487 . . . . 0.0 112.16 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 97.8 mt -102.28 -11.36 18.77 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 120.896 0.379 . . . . 0.0 110.031 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -153.19 161.13 42.77 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -107.15 152.4 24.11 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 177.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.3 p -82.88 130.17 36.19 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.439 0 CA-C-O 121.106 0.479 . . . . 0.0 109.932 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.298 -1.633 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.082 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 72.9 m80 . . . . . 0 N--CA 1.47 0.562 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.422 ' O ' ' HG2' ' B' ' 139' ' ' ARG . 13.0 tm-20 -67.27 -47.48 70.54 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.411 -172.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 2.9 tm0? -72.51 -33.6 67.03 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -176.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 72.4 mt -57.6 -49.68 75.61 Favored 'General case' 0 C--O 1.254 1.338 0 CA-C-O 121.824 0.821 . . . . 0.0 109.256 177.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 11.2 mp -69.14 -28.89 66.85 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.591 177.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 139' ' ' ARG . . . . . 0.422 ' HG2' ' O ' ' B' ' 135' ' ' GLU . 31.2 mmt180 -60.8 -42.76 98.27 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.443 0.535 . . . . 0.0 112.443 176.287 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -64.08 -35.29 80.28 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.639 0.733 . . . . 0.0 110.028 178.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.3 m -70.12 -43.17 71.54 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.149 178.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.605 ' O ' ' HG2' ' B' ' 146' ' ' LYS . 34.5 tt0 -60.47 -45.29 94.26 Favored 'General case' 0 C--O 1.22 -0.467 0 O-C-N 123.862 0.726 . . . . 0.0 109.677 177.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.75 -46.26 77.89 Favored 'General case' 0 CA--C 1.514 -0.419 0 O-C-N 124.007 0.817 . . . . 0.0 111.41 -177.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -70.51 -41.7 72.28 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.454 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -62.87 -39.98 96.12 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.709 -179.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 146' ' ' LYS . . . . . 0.605 ' HG2' ' O ' ' B' ' 142' ' ' GLU . 18.4 ptpt -73.28 -35.69 66.2 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 176.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -59.77 -47.58 85.12 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 122.023 0.916 . . . . 0.0 109.599 176.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -89.33 -3.2 58.57 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 113.88 -1.509 . . . . 0.0 112.123 -173.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . 0.446 ' O ' ' HB2' ' B' ' 154' ' ' SER . 34.1 mmtp 54.24 47.54 22.87 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.048 0.939 . . . . 0.0 111.113 178.132 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 90.5 mt -78.96 117.64 20.22 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.201 -176.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 48.7 -89.8 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.303 1.841 . . . . 0.0 113.646 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 41.6 mt -59.38 -49.18 84.49 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.989 0 C-N-CA 122.988 0.515 . . . . 0.0 111.764 -177.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -69.33 -10.41 57.75 Favored 'General case' 0 CA--C 1.495 -1.139 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -171.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . 0.446 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 23.0 t -72.52 2.33 6.54 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.037 174.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -60.5 -32.86 71.85 Favored 'General case' 0 C--N 1.355 0.809 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 168.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.6 t70 . . . . . 0 C--O 1.24 0.566 0 C-N-CA 125.593 1.557 . . . . 0.0 111.241 178.05 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 32.8 m170 . . . . . 0 N--CA 1.429 -1.495 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -110.24 150.97 27.92 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-O 121.317 0.579 . . . . 0.0 110.481 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.435 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 11.5 pt-20 -138.86 143.97 39.58 Favored Pre-proline 0 C--N 1.277 -2.558 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.823 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 10.8 Cg_exo -73.75 138.81 26.9 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.788 2.326 . . . . 0.0 113.625 -177.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.416 ' O ' ' HB ' ' A' ' 72' ' ' ILE . . . -125.68 153.94 43.13 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.191 -178.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.419 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 42.8 m -105.34 135.5 46.59 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 177.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.1 tp -80.35 137.9 36.62 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 118.143 0.429 . . . . 0.0 110.711 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 72.6 mt -107.11 -49.81 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 172.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -161.67 138.01 8.11 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.289 -177.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -101.93 107.46 18.62 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 174.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 56.3 mt -89.5 -52.64 10.52 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-O 120.778 0.323 . . . . 0.0 111.367 -173.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.497 ' HA ' ' HB3' ' A' ' 59' ' ' SER . 28.1 m-20 -138.15 -176.22 4.37 Favored 'General case' 0 CA--C 1.499 -0.997 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -178.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -92.95 54.38 2.58 Favored Glycine 0 CA--C 1.489 -1.543 0 N-CA-C 107.348 -2.301 . . . . 0.0 107.348 178.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -177.59 -54.67 0.01 OUTLIER 'General case' 0 CA--C 1.486 -1.502 0 C-N-CA 125.271 1.428 . . . . 0.0 107.222 -171.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.673 ' HA ' ' O ' ' A' ' 34' ' ' PHE . 1.9 m -101.88 113.06 25.94 Favored 'General case' 0 N--CA 1.407 -2.597 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.465 -173.147 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 35.4 m -124.71 167.05 19.27 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.803 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 173.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -121.47 114.13 20.82 Favored 'General case' 0 C--N 1.27 -2.855 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 176.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.493 ' O ' ' HA ' ' A' ' 31' ' ' PRO . 2.4 pp -136.11 159.41 41.8 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -176.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.441 ' HA ' ' HA ' ' A' ' 31' ' ' PRO . 47.4 ttm -117.51 114.98 24.25 Favored 'General case' 0 C--N 1.295 -1.775 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.536 -176.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -119.14 126.71 52.25 Favored 'General case' 0 C--N 1.281 -2.392 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 176.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt 59.97 27.21 16.56 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 123.804 0.69 . . . . 0.0 110.67 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.46 9.11 82.24 Favored Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.9 -178.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -111.7 102.2 52.91 Favored Pre-proline 0 C--N 1.312 -1.043 0 O-C-N 122.57 -0.37 . . . . 0.0 110.411 178.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.493 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 4.9 Cg_exo -81.47 134.77 8.99 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.379 2.72 . . . . 0.0 111.834 178.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 48.1 mtt -140.83 156.09 46.21 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 178.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 85.4 m -85.13 118.29 24.6 Favored 'General case' 0 N--CA 1.423 -1.819 0 N-CA-C 103.047 -2.946 . . . . 0.0 103.047 170.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.673 ' O ' ' HA ' ' A' ' 22' ' ' THR . 34.0 t80 -112.22 151.78 29.18 Favored 'General case' 0 C--N 1.271 -2.83 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -162.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.1 mmt180 -117.76 131.57 56.58 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 127.494 2.317 . . . . 0.0 106.186 172.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.621 ' HB2' HG21 ' A' ' 39' ' ' VAL . 32.6 mt -80.75 140.16 35.68 Favored 'General case' 0 C--N 1.289 -2.024 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 177.494 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.461 ' HB3' HD12 ' A' ' 38' ' ' LEU . 41.2 mt -65.68 133.45 51.12 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 178.061 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.52 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 2.9 mp 66.44 48.92 1.46 Allowed 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 125.674 1.59 . . . . 0.0 111.821 177.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.621 HG21 ' HB2' ' A' ' 36' ' ' LEU . 96.4 t -122.73 125.29 72.24 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.063 0 CA-C-O 121.035 0.445 . . . . 0.0 110.461 177.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.652 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 12.2 t70 -102.25 107.13 18.07 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.702 -1.222 . . . . 0.0 107.702 175.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 30.0 p . . . . . 0 C--N 1.307 -1.249 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.267 172.574 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.843 0 CA-C-O 118.754 -1.026 . . . . 0.0 114.663 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.408 ' HA ' ' OG ' ' A' ' 59' ' ' SER . 34.8 Cg_exo -64.8 -12.77 35.72 Favored 'Trans proline' 0 C--N 1.371 1.737 0 C-N-CA 123.006 2.471 . . . . 0.0 113.164 -178.438 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -89.92 -43.45 10.58 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.86 -43.62 87.89 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.753 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.497 ' HB3' ' HA ' ' A' ' 19' ' ' ASP . 35.3 p -66.56 -36.11 81.85 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.824 -179.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.82 -44.51 96.83 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -66.27 -46.89 75.46 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.531 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.496 ' O ' HG23 ' A' ' 66' ' ' VAL . 60.3 m -55.37 -51.68 66.01 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 123.684 0.615 . . . . 0.0 111.394 -178.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 39.4 mttp -53.69 -51.87 61.85 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 120.926 0.393 . . . . 0.0 111.432 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -64.62 -40.9 96.31 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.535 -177.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.92 -47.02 61.38 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.964 -176.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 62' ' ' THR . 36.3 t -66.52 -38.07 80.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 120.965 0.412 . . . . 0.0 110.669 -177.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -75.0 -22.99 58.18 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.374 -0.531 . . . . 0.0 111.571 178.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -83.11 -24.42 32.64 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 121.204 0.526 . . . . 0.0 110.199 177.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.18 151.89 30.17 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.16 179.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -84.49 -65.35 1.02 Allowed 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.158 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -118.15 136.5 53.57 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 -176.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.416 ' HB ' ' O ' ' A' ' 12' ' ' ALA . 69.8 mt -104.84 112.96 40.61 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.508 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 22.1 mt-10 -112.8 133.48 54.78 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -177.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.439 HG12 ' CD1' ' A' ' 92' ' ' ILE . 29.2 m -110.82 123.1 66.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 178.17 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -120.1 122.31 40.76 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -92.99 145.77 24.12 Favored 'General case' 0 N--CA 1.422 -1.868 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -87.04 -175.35 5.31 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.1 mtpm? -78.13 14.07 1.27 Allowed 'General case' 0 C--N 1.313 -0.99 0 O-C-N 121.935 -0.478 . . . . 0.0 111.915 -176.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -95.69 -130.67 6.34 Favored Glycine 0 N--CA 1.436 -1.331 0 N-CA-C 112.247 -0.341 . . . . 0.0 112.247 -179.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -97.23 145.79 25.73 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 -177.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.451 HH11 ' HG2' ' A' ' 81' ' ' ARG . 11.8 ttt-85 -90.15 -13.71 35.11 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 119.09 -1.044 . . . . 0.0 109.472 -178.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 23.2 p . . . . . 0 N--CA 1.432 -1.331 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.523 176.303 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 . . . . . 0 C--O 1.213 -0.854 0 N-CA-C 105.755 -1.943 . . . . 0.0 105.755 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -75.72 134.64 16.64 Favored Glycine 0 C--O 1.206 -1.594 0 C-N-CA 120.539 -0.839 . . . . 0.0 113.777 -173.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 62.7 mt -112.22 110.66 21.04 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 123.26 0.624 . . . . 0.0 111.741 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.471 ' HB3' ' HZ ' ' A' ' 34' ' ' PHE . . . -157.58 163.44 38.33 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 171.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.46 ' OH ' ' HB3' ' A' ' 98' ' ' MET . 35.6 t80 -95.14 141.73 28.42 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.439 ' CD1' HG12 ' A' ' 74' ' ' VAL . 49.5 mm -99.69 123.57 52.54 Favored 'Isoleucine or valine' 0 C--O 1.252 1.198 0 CA-C-O 121.206 0.526 . . . . 0.0 111.096 -179.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.508 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 96.2 m-85 -111.05 131.35 55.13 Favored 'General case' 0 C--N 1.29 -1.999 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 172.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.29 100.42 10.01 Favored 'General case' 0 C--N 1.286 -2.177 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 177.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.6 t70 47.57 57.32 6.02 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 122.474 1.131 . . . . 0.0 110.526 -177.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 77.27 -5.15 52.13 Favored Glycine 0 CA--C 1.53 0.989 0 CA-C-N 114.605 -1.18 . . . . 0.0 114.86 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 32.7 mtmm -104.37 124.25 48.86 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 117.625 0.712 . . . . 0.0 111.144 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . 0.46 ' HB3' ' OH ' ' A' ' 91' ' ' TYR . 2.1 mpt? -63.23 112.82 2.84 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 123.907 0.883 . . . . 0.0 112.059 -176.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 91.9 t -73.2 -46.16 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.23 -177.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.457 ' O ' HG22 ' A' ' 104' ' ' VAL . 46.2 t30 -63.93 -37.23 86.65 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.121 -178.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -54.94 -44.13 74.0 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.157 176.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.91 -44.22 93.6 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.504 179.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 97.2 mt -58.03 -52.22 66.45 Favored 'General case' 0 C--O 1.244 0.779 0 CA-C-O 121.389 0.614 . . . . 0.0 111.209 178.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.475 HG11 ' CG1' ' A' ' 111' ' ' VAL . 27.2 m -70.78 -38.0 71.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.496 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -176.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.414 ' HG3' ' HB3' ' B' ' 141' ' ' SER . 82.4 mtp180 -65.0 -16.22 63.18 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 175.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -93.62 -5.6 48.38 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.766 174.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.29 25.1 69.27 Favored Glycine 0 CA--C 1.507 -0.438 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.68 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 90.4 mt -88.87 -15.97 33.13 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.744 0.307 . . . . 0.0 111.047 -178.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -157.26 174.3 15.66 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -178.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.652 ' HB2' ' HB3' ' A' ' 40' ' ' ASP . 18.4 mttt -119.28 170.98 8.63 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 176.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.52 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 32.8 m -108.05 107.32 22.53 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -177.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.702 0 C-N-CA 119.599 -0.84 . . . . 0.0 112.92 176.55 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 . . . . . 0 CA--C 1.539 0.522 0 N-CA-C 111.289 0.107 . . . . 0.0 111.289 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -37.76 -61.68 0.61 Allowed 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 126.731 2.012 . . . . 0.0 113.087 -178.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -47.58 -54.32 12.13 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.475 1.11 . . . . 0.0 113.883 -173.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.1 mt -60.54 -43.75 96.85 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.815 -177.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 138' ' ' LEU . . . . . 0.437 ' HB3' HG11 ' A' ' 111' ' ' VAL . 4.1 mm? -69.36 -38.03 77.88 Favored 'General case' 0 N--CA 1.432 -1.355 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.477 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -57.16 -45.6 83.48 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-O 120.859 0.361 . . . . 0.0 110.39 176.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -62.48 -43.4 98.92 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.931 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 141' ' ' SER . . . . . 0.414 ' HB3' ' HG3' ' A' ' 105' ' ' ARG . 25.2 m -65.24 -41.24 94.56 Favored 'General case' 0 N--CA 1.438 -1.03 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.539 -178.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.438 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 34.4 tt0 -67.06 -50.77 60.78 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.198 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.88 -34.78 70.13 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.819 0.699 . . . . 0.0 111.908 -177.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 144' ' ' GLN . . . . . 0.453 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 57.8 tt0 -61.94 -48.01 82.31 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -70.56 -32.66 70.16 Favored 'General case' 0 C--O 1.245 0.853 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.771 -178.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 146' ' ' LYS . . . . . 0.438 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 81.6 mttt -57.9 -51.21 70.56 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 123.661 0.601 . . . . 0.0 109.645 176.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -71.07 -22.87 62.06 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.548 -176.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 22.8 mm-40 -87.24 -4.35 59.09 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 121.073 -0.251 . . . . 0.0 111.588 178.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . 0.596 ' O ' ' HB3' ' B' ' 154' ' ' SER . 10.0 mmpt? 54.71 57.36 5.78 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.076 0.95 . . . . 0.0 108.855 -176.049 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 98.2 mt -95.49 119.3 33.74 Favored 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 120.084 -0.646 . . . . 0.0 112.539 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 50.9 -84.41 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 127.633 2.373 . . . . 0.0 114.181 175.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 152' ' ' ILE . . . . . 0.568 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 58.5 mt -68.56 -34.06 63.27 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.41 0 CA-C-O 121.764 0.792 . . . . 0.0 109.784 178.118 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 60.0 m95 -81.53 -11.1 59.3 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.767 -172.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . 0.596 ' HB3' ' O ' ' B' ' 149' ' ' LYS . 79.6 p -91.14 0.86 57.45 Favored 'General case' 0 N--CA 1.423 -1.803 0 C-N-CA 119.73 -0.788 . . . . 0.0 112.438 -178.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . 0.568 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 5.6 pt-20 -93.82 -17.76 22.74 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 174.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 13.7 t70 . . . . . 0 N--CA 1.431 -1.409 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.3 -170.984 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.6 m-70 . . . . . 0 N--CA 1.468 0.438 0 CA-C-O 119.882 -0.104 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 21.2 pttp -110.42 141.92 42.85 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 176.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -139.34 143.75 37.36 Favored Pre-proline 0 C--N 1.276 -2.607 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.29 177.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -62.04 147.91 94.2 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.825 2.35 . . . . 0.0 113.487 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.02 166.09 25.41 Favored 'General case' 0 C--N 1.307 -1.266 0 C-N-CA 124.499 1.12 . . . . 0.0 108.965 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.45 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 57.2 m -100.76 132.03 46.36 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 178.658 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.452 ' HA ' HD13 ' A' ' 25' ' ' LEU . 54.2 tp -79.98 126.23 30.77 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 120.995 0.426 . . . . 0.0 110.316 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.3 mm -92.07 -54.62 7.12 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.674 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 175.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -166.42 149.08 6.88 Favored 'General case' 0 N--CA 1.425 -1.702 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.809 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -82.45 128.84 34.66 Favored 'General case' 0 N--CA 1.438 -1.075 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 171.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 47.5 mm -102.79 -51.8 8.71 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.719 0 CA-C-O 121.057 0.456 . . . . 0.0 109.961 -174.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -133.65 -176.8 4.28 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.66 50.54 4.01 Favored Glycine 0 C--O 1.222 -0.643 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 175.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.623 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 5.6 t70 -178.61 -59.91 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 -170.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.544 ' HA ' ' O ' ' A' ' 34' ' ' PHE . 21.5 m -82.32 120.14 25.03 Favored 'General case' 0 N--CA 1.409 -2.507 0 CA-C-N 113.597 -1.638 . . . . 0.0 111.246 -176.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.6 m -126.9 144.56 36.69 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.353 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 177.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -98.25 119.57 37.14 Favored 'General case' 0 C--N 1.292 -1.893 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -176.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.601 HD11 HG21 ' A' ' 72' ' ' ILE . 3.1 mm? -120.42 158.27 27.54 Favored 'General case' 0 CA--C 1.5 -0.963 0 CA-C-O 121.462 0.648 . . . . 0.0 111.985 -176.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.45 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 27.0 ttt -124.07 105.98 9.99 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 174.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -113.8 116.46 29.38 Favored 'General case' 0 C--N 1.292 -1.909 0 C-N-CA 119.191 -1.004 . . . . 0.0 110.086 -178.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 94.6 mttt 57.73 38.14 27.41 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.482 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 91.77 -1.52 75.11 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-N 114.354 -1.294 . . . . 0.0 113.83 175.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -107.74 106.22 57.97 Favored Pre-proline 0 C--N 1.314 -0.963 0 CA-C-N 117.183 0.492 . . . . 0.0 110.437 -177.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.558 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 33.9 Cg_endo -90.89 125.22 1.02 Allowed 'Trans proline' 0 N--CA 1.448 -1.149 0 C-N-CA 123.007 2.471 . . . . 0.0 112.908 178.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 63.6 mtt -141.32 156.23 45.87 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.016 178.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.3 m -90.67 103.83 16.48 Favored 'General case' 0 C--N 1.294 -1.844 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 178.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.544 ' O ' ' HA ' ' A' ' 22' ' ' THR . 73.5 m-85 -95.29 125.25 39.79 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 -170.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.623 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 6.7 mmm180 -95.68 146.12 24.75 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 125.417 1.487 . . . . 0.0 108.281 175.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.46 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 93.3 mt -82.65 125.21 30.95 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 121.631 0.729 . . . . 0.0 111.484 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 69.3 mt -79.0 139.38 38.21 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.333 174.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.555 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 87.9 mt 73.77 10.99 4.66 Favored 'General case' 0 C--O 1.218 -0.598 0 C-N-CA 125.158 1.383 . . . . 0.0 111.919 178.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.42 ' CG2' HD22 ' A' ' 100' ' ' ASN . 66.6 t -128.85 136.32 60.08 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.242 0 CA-C-O 121.084 0.468 . . . . 0.0 110.093 -179.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -121.68 107.87 12.87 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.0 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.42 ' HB ' ' HB2' ' A' ' 21' ' ' ASP . 8.7 m . . . . . 0 C--N 1.31 -1.122 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.778 176.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.857 0 CA-C-O 119.31 -0.717 . . . . 0.0 112.833 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -46.06 -54.84 4.19 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 124.006 3.137 . . . . 0.0 113.125 177.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -60.3 -46.59 89.33 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.04 -44.57 96.41 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.271 0.558 . . . . 0.0 110.853 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.6 m -69.17 -44.61 71.87 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.928 -178.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.503 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -65.19 -41.63 94.39 Favored 'General case' 0 C--O 1.209 -1.044 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.924 -178.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -59.96 -43.7 94.89 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 122.588 0.355 . . . . 0.0 110.315 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.2 m -60.7 -50.99 71.25 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.624 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.76 -36.83 85.59 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.837 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.503 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 98.2 mttt -56.96 -46.83 81.89 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 174.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.1 mmt -65.65 -51.5 59.02 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 32.9 m -74.36 -31.61 28.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -174.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -81.12 -28.22 35.23 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 119.536 -0.866 . . . . 0.0 110.944 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -82.01 -25.56 34.59 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.83 177.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.402 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -58.74 145.86 38.82 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 123.209 0.604 . . . . 0.0 111.683 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -79.46 -37.29 37.26 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.401 ' HE3' ' HB2' ' A' ' 71' ' ' LYS . 44.2 mtmt -133.59 145.48 50.09 Favored 'General case' 0 CA--C 1.484 -1.563 0 CA-C-N 114.625 -1.171 . . . . 0.0 108.85 -178.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.601 HG21 HD11 ' A' ' 25' ' ' LEU . 4.2 mp -117.52 118.54 58.84 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.612 0 N-CA-C 105.348 -2.094 . . . . 0.0 105.348 171.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.606 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 31.5 mt-10 -112.84 141.36 46.74 Favored 'General case' 0 C--N 1.28 -2.453 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -173.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.516 HG12 ' CD1' ' A' ' 92' ' ' ILE . 30.6 m -112.71 124.57 69.5 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.277 -178.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 91' ' ' TYR . 35.5 tt0 -109.75 115.56 30.07 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 175.53 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -87.94 127.46 35.37 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-O 121.397 0.617 . . . . 0.0 111.639 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -95.8 166.44 11.8 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.086 -0.961 . . . . 0.0 111.798 -174.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -62.31 -24.05 67.09 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 125.847 1.659 . . . . 0.0 110.904 -177.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -55.05 -84.07 0.04 OUTLIER Glycine 0 CA--C 1.493 -1.315 0 O-C-N 123.549 0.531 . . . . 0.0 114.309 -175.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.558 ' HB2' HD12 ' A' ' 89' ' ' LEU . 24.8 mt-30 -149.86 149.61 30.72 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 178.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -84.37 -34.64 23.57 Favored 'General case' 0 C--N 1.285 -2.205 0 CA-C-O 121.599 0.714 . . . . 0.0 109.092 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.446 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 6.9 p . . . . . 0 C--N 1.305 -1.348 0 CA-C-N 114.922 -1.035 . . . . 0.0 108.809 -179.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 . . . . . 0 CA--C 1.509 -0.604 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.446 ' HA2' ' HA ' ' A' ' 82' ' ' THR . . . -88.55 161.18 30.89 Favored Glycine 0 N--CA 1.427 -1.922 0 N-CA-C 109.118 -1.593 . . . . 0.0 109.118 177.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.558 HD12 ' HB2' ' A' ' 80' ' ' GLN . 91.1 mt -130.24 118.37 21.26 Favored 'General case' 0 C--N 1.286 -2.174 0 CA-C-N 117.38 0.59 . . . . 0.0 110.318 -177.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.17 168.01 28.63 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.239 0.543 . . . . 0.0 110.716 -178.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.459 ' HB3' ' HB3' ' A' ' 75' ' ' GLU . 18.2 t80 -97.79 126.47 43.16 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 105.363 -2.088 . . . . 0.0 105.363 173.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.516 ' CD1' HG12 ' A' ' 74' ' ' VAL . 47.8 mm -99.84 129.97 49.66 Favored 'Isoleucine or valine' 0 C--O 1.246 0.874 0 C-N-CA 119.75 -0.78 . . . . 0.0 112.912 -176.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.606 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 41.1 m-85 -110.62 145.32 38.1 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.434 173.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.402 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -109.41 99.35 8.6 Favored 'General case' 0 C--N 1.29 -1.982 0 N-CA-C 106.417 -1.697 . . . . 0.0 106.417 173.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.317 3.7 p30 42.13 57.42 3.28 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 114.228 1.196 . . . . 0.0 114.228 -176.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.62 -18.49 52.48 Favored Glycine 0 N--CA 1.432 -1.594 0 CA-C-N 114.948 -1.024 . . . . 0.0 113.992 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -90.47 147.35 23.46 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-N 117.114 0.457 . . . . 0.0 110.069 -177.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 57.4 mtt -92.4 108.1 19.71 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-O 121.471 0.653 . . . . 0.0 111.853 -177.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 62.4 t -67.67 -42.32 86.34 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 CA-C-N 114.51 -1.223 . . . . 0.0 109.763 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.46 ' ND2' ' HB3' ' A' ' 36' ' ' LEU . 11.8 m120 -54.13 -49.08 70.01 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.828 177.09 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -54.08 -56.08 21.42 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.377 175.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.83 -41.08 73.71 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 89.6 mt -65.06 -46.58 80.62 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 57.8 t -73.12 -38.26 54.66 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.158 0 CA-C-O 120.588 0.232 . . . . 0.0 110.866 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.513 ' CZ ' ' HA ' ' B' ' 141' ' ' SER . 12.7 tpp180 -65.33 -34.89 79.4 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.556 0.743 . . . . 0.0 110.898 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -84.94 -3.34 58.7 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.205 177.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.543 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 70.69 38.26 67.25 Favored Glycine 0 N--CA 1.432 -1.614 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.661 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 82.8 mt -103.79 -10.9 17.91 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 121.628 0.728 . . . . 0.0 109.287 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -150.18 169.9 20.23 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 114.475 -1.238 . . . . 0.0 108.923 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.432 ' HG3' HD13 ' B' ' 152' ' ' ILE . 93.4 mttt -123.21 159.01 29.57 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 176.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.5 p -83.79 124.24 39.52 Favored 'Isoleucine or valine' 0 C--O 1.246 0.913 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.846 177.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.555 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . . . . . . 0 C--N 1.305 -1.331 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 . . . . . 0 N--CA 1.471 0.598 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -47.01 -49.68 20.6 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.865 0.866 . . . . 0.0 111.967 -178.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . 0.496 ' O ' ' HG3' ' B' ' 140' ' ' LYS . 9.4 pt20 -51.48 -48.77 62.74 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.738 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 85.0 mt -70.35 -44.88 67.24 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.427 -177.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.65 -34.06 77.4 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.422 -178.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 139' ' ' ARG . . . . . 0.558 ' O ' ' HD3' ' B' ' 139' ' ' ARG . 0.0 OUTLIER -76.31 -36.35 58.35 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.574 -179.905 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . 0.496 ' HG3' ' O ' ' B' ' 136' ' ' GLN . 29.6 mtpp -69.24 -29.69 67.67 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-O 121.066 0.46 . . . . 0.0 110.132 177.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 141' ' ' SER . . . . . 0.513 ' HA ' ' CZ ' ' A' ' 105' ' ' ARG . 22.6 t -61.2 -55.05 36.58 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-N 114.806 -1.088 . . . . 0.0 108.342 175.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.481 ' HG3' ' CH2' ' B' ' 153' ' ' TRP . 33.2 tt0 -59.48 -53.15 61.39 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.63 -1.168 . . . . 0.0 111.087 178.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.6 -42.58 75.06 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -176.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -71.72 -46.97 56.95 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.052 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -65.0 -31.92 73.39 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.919 -177.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 146' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 87.7 mttt -59.62 -47.98 83.48 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.247 0.546 . . . . 0.0 110.363 175.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -70.52 -31.8 69.02 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.548 -176.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -76.25 -22.1 55.54 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.6 177.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' B' ' 154' ' ' SER . 51.0 mtpt 56.47 65.13 1.49 Allowed 'General case' 0 N--CA 1.441 -0.902 0 C-N-CA 124.434 1.093 . . . . 0.0 110.477 -174.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 89.5 mt -94.96 122.02 37.18 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.239 -179.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 151' ' ' ASN . . . . . 0.543 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 39.6 m-80 46.4 -89.16 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 126.25 1.82 . . . . 0.0 114.191 179.279 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 152' ' ' ILE . . . . . 0.432 HD13 ' HG3' ' A' ' 110' ' ' LYS . 13.3 tt -70.29 -30.94 45.28 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.751 0 CA-C-O 121.3 0.571 . . . . 0.0 110.027 -177.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 153' ' ' TRP . . . . . 0.481 ' CH2' ' HG3' ' B' ' 142' ' ' GLU . 65.9 m95 -78.26 -7.22 56.92 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 121.683 0.754 . . . . 0.0 110.172 -178.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . 0.423 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 8.2 t -102.85 19.4 19.4 Favored 'General case' 0 N--CA 1.408 -2.542 0 CA-C-N 115.394 -0.821 . . . . 0.0 108.905 179.083 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -71.34 -16.38 62.43 Favored 'General case' 0 C--N 1.351 0.673 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 174.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 15.7 t70 . . . . . 0 N--CA 1.436 -1.139 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.362 176.169 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 54.6 m80 . . . . . 0 CA--C 1.503 -0.847 0 CA-C-O 121.181 0.515 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 74' ' ' VAL . 27.7 ttpp -115.32 131.38 56.95 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.012 179.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.59 163.83 46.94 Favored Pre-proline 0 C--N 1.296 -1.749 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -79.72 150.36 21.36 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.192 1.928 . . . . 0.0 112.185 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.25 156.84 46.79 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.109 177.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.468 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 18.0 m -101.32 138.41 38.38 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 177.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 61.7 tp -76.11 126.52 31.15 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 -179.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 48.2 mm -98.41 -55.11 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 175.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 58.5 pttt -175.12 148.09 0.97 Allowed 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 122.432 0.293 . . . . 0.0 111.198 178.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -104.32 115.64 30.75 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 174.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.6 mp -86.91 -47.31 16.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.195 0 CA-C-O 121.416 0.627 . . . . 0.0 109.744 -175.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -138.95 175.71 9.32 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.279 -176.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.03 52.96 4.45 Favored Glycine 0 C--N 1.316 -0.581 0 N-CA-C 108.572 -1.811 . . . . 0.0 108.572 172.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.478 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 7.7 t70 -172.53 -58.97 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 -172.406 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 23.8 m -98.41 117.46 32.88 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 114.438 -1.255 . . . . 0.0 110.89 -176.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.4 m -133.45 156.43 41.66 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.427 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -121.24 125.08 46.21 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.467 -0.77 . . . . 0.0 109.965 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.0 mp -131.16 159.11 38.63 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.093 0.473 . . . . 0.0 110.436 -178.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.468 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 49.0 ttm -116.09 115.92 26.94 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.105 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -121.92 132.45 54.56 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 59.3 mttp 60.83 26.34 16.19 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.958 0.903 . . . . 0.0 110.586 -176.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 82.62 3.41 90.52 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 121.148 -0.548 . . . . 0.0 112.047 -177.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -105.24 113.03 64.94 Favored Pre-proline 0 C--N 1.315 -0.918 0 O-C-N 122.541 -0.388 . . . . 0.0 110.914 -178.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -85.93 120.22 1.94 Allowed 'Trans proline' 0 N--CA 1.443 -1.472 0 C-N-CA 122.389 2.059 . . . . 0.0 112.047 177.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 49.7 mtt -132.35 156.09 47.25 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.021 176.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.4 m -88.48 115.97 26.38 Favored 'General case' 0 N--CA 1.418 -2.043 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -102.14 166.88 10.36 Favored 'General case' 0 N--CA 1.414 -2.225 0 CA-C-O 122.127 0.965 . . . . 0.0 111.157 -177.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.478 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 18.4 ttp180 -139.2 136.63 35.23 Favored 'General case' 0 N--CA 1.405 -2.714 0 N-CA-C 107.124 -1.435 . . . . 0.0 107.124 172.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.0 mp -69.8 119.08 13.49 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 123.997 0.811 . . . . 0.0 110.23 -176.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.0 mt -57.66 131.47 50.36 Favored 'General case' 0 CA--C 1.499 -0.991 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.145 177.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.467 ' HB2' HD22 ' B' ' 138' ' ' LEU . 87.5 mt 73.19 19.92 3.46 Favored 'General case' 0 C--O 1.217 -0.648 0 O-C-N 125.205 1.565 . . . . 0.0 112.696 175.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.7 t -111.15 125.9 68.51 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 177.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -125.47 110.13 13.54 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.9 p . . . . . 0 C--N 1.306 -1.297 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 169.491 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.241 0 CA-C-O 119.772 -0.46 . . . . 0.0 112.612 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.453 ' HA ' ' OG ' ' A' ' 59' ' ' SER . 20.2 Cg_exo -69.79 -12.45 32.85 Favored 'Trans proline' 0 C--N 1.369 1.651 0 C-N-CA 122.454 2.103 . . . . 0.0 111.755 176.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -78.48 -48.71 14.79 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 177.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.41 -37.68 80.55 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.862 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.453 ' OG ' ' HA ' ' A' ' 56' ' ' PRO . 26.1 p -68.17 -36.98 80.47 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.16 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -67.8 -43.63 79.23 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 176.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.29 -48.41 81.73 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.659 -179.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.453 HG23 HD21 ' A' ' 103' ' ' LEU . 12.2 p -62.94 -48.85 77.12 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.907 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -56.77 -46.92 81.16 Favored 'General case' 0 CA--C 1.509 -0.621 0 O-C-N 123.349 0.406 . . . . 0.0 111.8 179.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -56.76 -46.17 81.59 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.423 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 49.1 ttm -68.46 -46.47 69.69 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 123.366 0.416 . . . . 0.0 111.881 -177.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.8 m -70.33 -36.65 67.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -177.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -71.95 -34.88 69.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.733 0.302 . . . . 0.0 110.834 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -71.95 -37.77 69.91 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.152 0.501 . . . . 0.0 110.79 -178.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.68 153.73 40.87 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.304 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -86.22 -18.22 32.72 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-O 121.125 0.488 . . . . 0.0 110.766 179.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -130.46 125.74 35.16 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.382 -175.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 64.0 mt -106.86 112.74 41.13 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.84 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 170.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.6 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 26.8 mt-10 -115.42 137.23 52.27 Favored 'General case' 0 C--N 1.285 -2.229 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.365 -172.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.466 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 18.9 m -110.89 121.23 63.22 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 175.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.482 ' HB3' ' HB2' ' A' ' 91' ' ' TYR . 40.6 tt0 -110.76 121.09 44.47 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -95.84 147.0 24.11 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 178.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.529 ' OD1' ' HG2' ' A' ' 78' ' ' LYS . 10.8 t70 -85.0 -179.36 7.04 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 -177.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.529 ' HG2' ' OD1' ' A' ' 77' ' ' ASP . 21.2 pttp -73.05 -16.15 61.49 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 123.115 0.566 . . . . 0.0 112.084 -172.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -89.99 -107.15 1.25 Allowed Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.865 -179.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -110.9 165.06 12.16 Favored 'General case' 0 C--N 1.309 -1.193 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.826 -173.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 63.2 mtp180 -109.57 -21.4 12.47 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.83 -174.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 22.9 p . . . . . 0 C--N 1.3 -1.574 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.763 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.428 ' HG2' ' HB2' ' A' ' 35' ' ' ARG . 10.4 tpp85 . . . . . 0 N--CA 1.414 -2.268 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -95.63 133.49 11.51 Favored Glycine 0 N--CA 1.432 -1.591 0 N-CA-C 108.595 -1.802 . . . . 0.0 108.595 173.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.2 pp -112.84 125.66 54.59 Favored 'General case' 0 N--CA 1.411 -2.415 0 CA-C-N 118.138 0.969 . . . . 0.0 112.91 -177.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -152.63 162.29 41.43 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.313 -179.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.482 ' HB2' ' HB3' ' A' ' 75' ' ' GLU . 83.6 m-85 -87.49 128.6 35.23 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 105.58 -2.007 . . . . 0.0 105.58 174.057 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 48.4 mm -99.32 123.9 52.29 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.663 0 C-N-CA 120.029 -0.668 . . . . 0.0 109.241 -177.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.6 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 6.1 m-85 -116.84 143.56 45.54 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.536 178.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -121.55 100.24 6.91 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 175.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.1 t70 46.77 58.72 4.45 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 124.802 1.241 . . . . 0.0 111.323 -175.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.96 -22.5 11.73 Favored Glycine 0 N--CA 1.444 -0.829 0 CA-C-N 114.818 -1.083 . . . . 0.0 114.475 179.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -80.32 129.55 34.58 Favored 'General case' 0 CA--C 1.501 -0.92 0 CA-C-N 117.475 0.638 . . . . 0.0 111.309 -178.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -75.68 105.84 6.93 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 52.2 t -73.19 -39.18 56.1 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.09 0 CA-C-O 121.452 0.644 . . . . 0.0 109.554 -178.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -64.61 -44.41 90.68 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.689 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -66.42 -33.78 76.48 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.995 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.42 -37.81 84.82 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.09 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.453 HD21 HG23 ' A' ' 62' ' ' THR . 84.9 mt -63.13 -44.45 95.57 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.042 177.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 44.0 t -69.7 -37.78 74.71 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.156 0 CA-C-O 121.549 0.69 . . . . 0.0 109.591 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -61.72 -44.85 96.12 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 124.953 1.301 . . . . 0.0 111.693 179.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -83.59 2.12 38.83 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.27 -177.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.463 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 66.04 35.87 91.2 Favored Glycine 0 N--CA 1.43 -1.759 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 -179.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.6 mt -96.69 -18.61 19.56 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -151.19 164.85 35.6 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 115.232 -0.895 . . . . 0.0 108.816 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.415 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 94.5 mttt -104.39 168.79 8.87 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 176.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.443 HG12 ' OE2' ' B' ' 142' ' ' GLU . 7.4 p -79.12 132.54 31.9 Favored 'Isoleucine or valine' 0 C--O 1.251 1.173 0 C-N-CA 118.205 -1.398 . . . . 0.0 107.937 175.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.466 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.546 -178.409 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 14.0 p80 . . . . . 0 C--O 1.266 1.925 0 CA-C-O 121.76 0.791 . . . . 0.0 112.005 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.466 ' OE1' ' HG2' ' B' ' 136' ' ' GLN . 0.2 OUTLIER -65.44 -33.52 76.13 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.855 179.334 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . 0.566 ' O ' ' HG2' ' B' ' 140' ' ' LYS . 15.2 mm100 -57.8 -34.17 69.35 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.799 177.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 64.1 mt -66.24 -42.68 88.28 Favored 'General case' 0 C--O 1.242 0.689 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 138' ' ' LEU . . . . . 0.467 HD22 ' HB2' ' A' ' 38' ' ' LEU . 6.8 mp -69.54 -30.94 68.88 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 120.352 -0.539 . . . . 0.0 111.75 175.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -69.85 -28.19 65.47 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 176.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . 0.566 ' HG2' ' O ' ' B' ' 136' ' ' GLN . 3.9 mmmp? -61.63 -42.34 98.76 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 174.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 2.6 p -71.89 -41.17 68.28 Favored 'General case' 0 N--CA 1.426 -1.641 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.904 176.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.578 ' HG3' ' CZ2' ' B' ' 153' ' ' TRP . 39.4 tt0 -61.39 -58.02 9.91 Favored 'General case' 0 C--O 1.211 -0.931 0 O-C-N 123.244 0.34 . . . . 0.0 111.839 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . 0.423 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -56.34 -39.21 72.47 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 123.477 0.485 . . . . 0.0 111.435 -176.239 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 144' ' ' GLN . . . . . 0.415 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 52.0 tt0 -70.21 -45.25 66.96 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.179 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -69.48 -28.18 65.85 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.492 -178.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 146' ' ' LYS . . . . . 0.508 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 92.8 mttt -58.9 -44.31 91.18 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 174.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 74.7 mmtt -71.8 -35.27 69.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.898 -178.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . 0.445 ' HB2' ' HG ' ' B' ' 150' ' ' LEU . 20.4 mm-40 -66.61 -29.84 69.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.822 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . 0.438 ' O ' ' HB2' ' B' ' 154' ' ' SER . 46.5 mtpt 59.75 57.42 3.18 Favored 'General case' 0 CA--C 1.505 -0.757 0 C-N-CA 124.737 1.215 . . . . 0.0 109.03 -174.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . 0.445 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 87.9 mt -87.85 117.67 26.86 Favored 'General case' 0 CA--C 1.489 -1.392 0 CA-C-N 114.291 -1.322 . . . . 0.0 110.659 -178.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 151' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 88.3 m-20 52.52 -89.46 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.903 0 O-C-N 124.673 1.233 . . . . 0.0 114.127 172.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 13.0 tt -72.98 -25.8 22.38 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.222 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -178.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 153' ' ' TRP . . . . . 0.578 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 55.2 m95 -79.39 -7.94 58.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.892 0.853 . . . . 0.0 109.459 178.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . 0.438 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 35.2 t -103.79 26.73 8.25 Favored 'General case' 0 N--CA 1.419 -1.988 0 CA-C-N 114.457 -1.247 . . . . 0.0 108.426 174.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -62.23 -34.11 75.87 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 174.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 5.6 t70 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 127.71 2.404 . . . . 0.0 114.17 170.756 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 . . . . . 0 N--CA 1.426 -1.642 0 CA-C-O 121.187 0.518 . . . . 0.0 109.871 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.415 ' HB3' ' HB2' ' A' ' 75' ' ' GLU . 21.3 pttp -111.48 153.58 25.96 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 115.26 -0.882 . . . . 0.0 108.869 177.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -138.68 162.18 54.4 Favored Pre-proline 0 C--N 1.278 -2.51 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 176.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.568 ' HA ' ' O ' ' A' ' 72' ' ' ILE . 19.5 Cg_exo -74.51 155.77 45.32 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 122.294 1.996 . . . . 0.0 111.629 178.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -138.83 166.64 23.91 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.477 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 30.6 m -104.32 139.79 38.81 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 177.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.4 tp -88.69 133.52 34.19 Favored 'General case' 0 C--N 1.306 -1.301 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.234 -177.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 66.6 mt -92.55 -59.22 3.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.549 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 175.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -174.49 161.6 3.34 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.949 -1.023 . . . . 0.0 108.562 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.466 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -97.75 151.23 20.38 Favored 'General case' 0 C--N 1.29 -2.004 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 174.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.0 mm -112.89 -56.56 4.21 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -135.3 -160.59 1.07 Allowed 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 -176.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -76.45 -38.04 34.27 Favored Glycine 0 C--N 1.303 -1.298 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.134 -179.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.509 ' OD2' HG22 ' A' ' 41' ' ' THR . 4.0 p30 -106.42 -12.33 15.68 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 120.788 0.327 . . . . 0.0 111.603 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.43 111.87 24.63 Favored 'General case' 0 N--CA 1.425 -1.676 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.521 -174.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.9 m -136.91 147.43 27.18 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 C-N-CA 122.66 0.384 . . . . 0.0 110.48 -177.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -103.14 118.39 36.68 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 121.426 0.631 . . . . 0.0 111.188 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.9 mp -127.44 156.29 42.32 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.949 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.477 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 26.2 ttt -118.01 98.92 6.57 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 178.447 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.406 ' CD1' ' HZ ' ' A' ' 34' ' ' PHE . 7.6 p90 -98.67 111.76 24.03 Favored 'General case' 0 C--N 1.308 -1.204 0 C-N-CA 119.896 -0.722 . . . . 0.0 111.159 -174.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 37.4 mtpt 57.96 37.75 26.78 Favored 'General case' 0 C--O 1.245 0.862 0 CA-C-N 114.106 -1.406 . . . . 0.0 109.871 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 90.83 6.63 67.18 Favored Glycine 0 N--CA 1.436 -1.36 0 CA-C-N 114.001 -1.454 . . . . 0.0 113.703 177.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -112.59 106.17 55.7 Favored Pre-proline 0 C--N 1.311 -1.077 0 O-C-N 122.112 -0.64 . . . . 0.0 110.772 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -77.38 124.86 7.35 Favored 'Trans proline' 0 CA--C 1.534 0.504 0 C-N-CA 123.243 2.629 . . . . 0.0 112.648 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 53.7 mtt -145.57 156.54 43.75 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 122.948 0.499 . . . . 0.0 110.734 176.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.6 m -89.53 117.5 28.48 Favored 'General case' 0 N--CA 1.422 -1.866 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 172.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.406 ' HZ ' ' CD1' ' A' ' 27' ' ' TYR . 39.2 m-85 -95.96 145.64 25.26 Favored 'General case' 0 C--N 1.281 -2.379 0 CA-C-O 121.645 0.736 . . . . 0.0 112.488 -175.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.451 HH11 ' HD2' ' A' ' 35' ' ' ARG . 3.1 tpp85 -115.13 125.11 53.08 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 170.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.449 ' HA ' ' O ' ' A' ' 90' ' ' ALA . 71.3 mt -71.98 119.2 15.83 Favored 'General case' 0 C--N 1.288 -2.078 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.192 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.489 HD21 ' HB3' ' A' ' 89' ' ' LEU . 74.1 mt -60.42 139.57 57.63 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.756 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.522 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 88.2 mt 74.0 -0.38 3.37 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.924 1.29 . . . . 0.0 112.684 -178.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.5 t -115.21 133.8 60.32 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -179.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.448 ' HB2' ' HB2' ' A' ' 112' ' ' ALA . 16.4 t70 -142.28 108.39 5.22 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 175.385 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.509 HG22 ' OD2' ' A' ' 21' ' ' ASP . 14.1 t . . . . . 0 CA--C 1.6 2.868 0 N-CA-C 115.009 1.485 . . . . 0.0 115.009 -178.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.732 0 CA-C-O 119.63 -0.539 . . . . 0.0 112.566 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -52.26 -36.57 68.24 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.805 2.336 . . . . 0.0 112.506 176.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -61.48 -50.54 72.32 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.84 -50.96 66.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.71 -177.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.5 m -59.89 -38.79 83.23 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 120.919 0.39 . . . . 0.0 111.463 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.42 -36.18 76.45 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.113 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -61.92 -50.03 73.81 Favored 'General case' 0 C--O 1.241 0.605 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.46 ' O ' HG22 ' A' ' 66' ' ' VAL . 27.9 m -57.49 -49.72 75.37 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 123.972 0.795 . . . . 0.0 110.03 177.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.466 ' HG2' ' HB3' ' A' ' 17' ' ' ALA . 25.1 mtpp -54.98 -52.99 61.37 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 178.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -59.23 -40.18 85.08 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 120.676 0.274 . . . . 0.0 111.601 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.6 mmt -72.45 -50.96 22.4 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 62' ' ' THR . 22.2 m -77.08 -28.89 16.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -174.289 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -77.86 -35.51 50.92 Favored 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 119.848 -0.741 . . . . 0.0 111.28 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -79.26 -14.7 58.87 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 121.267 0.556 . . . . 0.0 110.737 177.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.59 133.82 56.45 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.112 -178.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -80.25 -62.93 1.53 Allowed 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 176.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -106.42 118.86 37.76 Favored 'General case' 0 N--CA 1.425 -1.724 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.568 ' O ' ' HA ' ' A' ' 11' ' ' PRO . 64.9 mt -99.62 118.72 46.64 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.497 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 178.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.503 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 3.5 mm-40 -111.24 133.64 53.43 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -175.55 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.6 m -110.92 118.5 57.45 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.725 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 174.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.415 ' HB2' ' HB3' ' A' ' 9' ' ' LYS . 34.2 tt0 -107.76 121.24 44.31 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 120.638 0.256 . . . . 0.0 110.408 -177.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -98.59 129.7 45.12 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 -177.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.474 ' OD2' HD13 ' A' ' 37' ' ' LEU . 2.2 p30 -94.8 -173.86 3.11 Favored 'General case' 0 N--CA 1.426 -1.631 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -176.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -75.76 -8.02 55.84 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.573 0.749 . . . . 0.0 112.288 -174.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -79.88 -70.88 1.3 Allowed Glycine 0 N--CA 1.428 -1.885 0 N-CA-C 111.696 -0.562 . . . . 0.0 111.696 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -145.61 150.57 36.6 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 -176.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -102.36 -39.07 7.34 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 122.033 0.921 . . . . 0.0 109.048 176.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 15.2 p . . . . . 0 N--CA 1.429 -1.478 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.407 -178.075 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 48.4 ttp180 . . . . . 0 N--CA 1.45 -0.461 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -82.17 143.66 23.12 Favored Glycine 0 C--N 1.305 -1.191 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.489 ' HB3' HD21 ' A' ' 37' ' ' LEU . 91.5 mt -127.36 108.46 10.86 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -179.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.449 ' O ' ' HA ' ' A' ' 36' ' ' LEU . . . -156.63 166.19 34.11 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.851 -177.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -91.61 142.38 27.69 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 170.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 14.0 tt -113.3 135.7 51.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.453 0 C-N-CA 118.316 -1.354 . . . . 0.0 111.559 -178.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.503 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 8.5 m-85 -116.46 139.03 50.9 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.675 176.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -109.0 100.17 9.4 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.7 t70 46.35 57.88 5.0 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 124.725 1.21 . . . . 0.0 111.431 -177.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.63 -23.55 12.68 Favored Glycine 0 CA--C 1.52 0.393 0 CA-C-N 114.846 -1.07 . . . . 0.0 114.02 177.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.2 mtmm -90.57 119.39 30.78 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -177.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . 0.45 ' HA ' ' HA ' ' A' ' 93' ' ' TYR . 41.7 ttp -83.98 103.68 13.43 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 121.951 0.881 . . . . 0.0 112.991 -175.108 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 43.7 t -67.02 -29.18 45.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.653 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.443 HD22 ' HB3' ' A' ' 36' ' ' LEU . 24.1 t-20 -53.54 -52.17 60.54 Favored 'General case' 0 C--O 1.258 1.517 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.106 -178.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.664 ' O ' ' HG2' ' A' ' 105' ' ' ARG . 6.9 pt-20 -77.31 -30.29 54.06 Favored 'General case' 0 N--CA 1.412 -2.365 0 C-N-CA 118.216 -1.394 . . . . 0.0 110.123 -179.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -56.83 -38.98 73.4 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 122.779 0.432 . . . . 0.0 110.904 -179.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 99.1 mt -60.84 -46.7 89.52 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.172 175.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.404 HG21 HD23 ' B' ' 138' ' ' LEU . 66.1 t -70.15 -37.35 71.51 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.186 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.492 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.664 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 33.9 mmm-85 -58.22 -41.62 84.46 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.23 0.612 . . . . 0.0 110.481 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -83.49 -4.68 58.74 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.719 -177.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.88 33.89 80.96 Favored Glycine 0 N--CA 1.439 -1.152 0 C-N-CA 120.156 -1.021 . . . . 0.0 111.092 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.3 mt -91.05 -6.24 54.11 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 122.16 0.981 . . . . 0.0 108.667 178.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -152.13 165.69 34.0 Favored 'General case' 0 N--CA 1.405 -2.701 0 CA-C-N 114.295 -1.321 . . . . 0.0 107.775 -179.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -103.82 152.09 22.31 Favored 'General case' 0 N--CA 1.409 -2.5 0 N-CA-C 105.136 -2.172 . . . . 0.0 105.136 176.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.7 p -77.28 128.99 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 118.384 -1.326 . . . . 0.0 109.601 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.522 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . . . . . . 0 C--N 1.293 -1.882 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 173.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 . . . . . 0 CA--C 1.497 -1.091 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -62.37 -45.43 93.21 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 114.23 -1.35 . . . . 0.0 113.005 -168.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -60.05 -42.94 95.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.033 0.444 . . . . 0.0 110.082 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.85 -50.17 73.32 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.623 -177.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 138' ' ' LEU . . . . . 0.404 HD23 HG21 ' A' ' 104' ' ' VAL . 9.1 mp -68.86 -38.49 79.76 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 -179.042 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -61.77 -41.73 98.08 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.977 0.417 . . . . 0.0 109.948 176.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . 0.482 ' HA ' ' HE3' ' B' ' 140' ' ' LYS . 1.4 tpmt? -71.2 -37.77 72.09 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.704 -179.137 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.4 m -65.78 -37.17 85.6 Favored 'General case' 0 C--O 1.244 0.811 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.488 178.238 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.658 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 29.8 tt0 -65.52 -41.86 92.65 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.445 175.558 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -54.24 -46.01 72.47 Favored 'General case' 0 CA--C 1.518 -0.281 0 O-C-N 123.555 0.534 . . . . 0.0 110.399 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 144' ' ' GLN . . . . . 0.475 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 2.6 mp0 -64.78 -46.19 83.14 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.172 175.236 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -58.31 -36.22 73.02 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 123.038 0.535 . . . . 0.0 112.369 -179.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 146' ' ' LYS . . . . . 0.658 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 50.8 mttm -59.76 -47.67 84.73 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 176.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -65.32 -41.91 93.5 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.636 -178.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 20.8 mm-40 -71.89 -18.27 62.05 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.914 -178.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . 0.581 ' O ' ' HB2' ' B' ' 154' ' ' SER . 29.6 mtpp 56.77 65.57 1.37 Allowed 'General case' 0 N--CA 1.437 -1.079 0 C-N-CA 124.098 0.959 . . . . 0.0 110.698 -176.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 94.4 mt -99.76 126.81 45.89 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.146 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 46.67 -93.96 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 125.549 1.54 . . . . 0.0 114.563 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 65.1 mt -63.88 -31.33 52.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 CA-C-O 121.586 0.708 . . . . 0.0 110.708 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 153' ' ' TRP . . . . . 0.443 ' CG ' ' HA ' ' B' ' 146' ' ' LYS . 49.1 m95 -83.98 -3.68 58.17 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.778 0.799 . . . . 0.0 110.247 -179.032 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . 0.581 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 11.8 t -115.0 28.75 8.5 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 177.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -75.06 -25.48 58.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.043 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 9.8 t70 . . . . . 0 C--N 1.298 -1.656 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 -176.836 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.2 m170 . . . . . 0 CA--C 1.505 -0.756 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.494 ' HG2' ' HB2' ' A' ' 75' ' ' GLU . 46.4 mtmt -89.64 109.68 20.63 Favored 'General case' 0 N--CA 1.432 -1.362 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 170.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.476 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 7.2 pt-20 -112.73 138.24 22.02 Favored Pre-proline 0 C--N 1.273 -2.759 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.651 178.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 17.3 Cg_exo -67.37 136.65 40.73 Favored 'Trans proline' 0 C--O 1.24 0.605 0 C-N-CA 122.575 2.183 . . . . 0.0 113.199 -176.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -128.31 159.46 35.21 Favored 'General case' 0 N--CA 1.425 -1.676 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.753 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.415 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 72.9 m -110.93 128.7 55.91 Favored 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 177.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 57.4 tp -69.38 128.13 35.49 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 120.631 0.253 . . . . 0.0 110.638 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.4 mm -95.05 -55.1 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 173.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -171.54 137.91 1.1 Allowed 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.437 179.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.513 ' HA ' HG13 ' A' ' 23' ' ' VAL . . . -86.67 105.75 17.13 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 175.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.4 mm -74.41 -49.16 32.85 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.594 -175.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.479 ' HB3' ' H ' ' A' ' 22' ' ' THR . 5.3 t70 -142.91 -163.71 1.69 Allowed 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 106.851 -1.537 . . . . 0.0 106.851 -173.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -110.8 44.69 1.45 Allowed Glycine 0 C--N 1.293 -1.818 0 N-CA-C 107.555 -2.218 . . . . 0.0 107.555 176.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -167.21 -52.23 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 113.144 -1.528 . . . . 0.0 107.905 -170.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.479 ' H ' ' HB3' ' A' ' 19' ' ' ASP . 31.1 m -105.88 122.34 45.91 Favored 'General case' 0 N--CA 1.428 -1.567 0 CA-C-N 114.281 -1.327 . . . . 0.0 108.931 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.513 HG13 ' HA ' ' A' ' 17' ' ' ALA . 22.9 t -133.89 145.08 33.9 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.678 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 -178.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -107.19 125.21 50.81 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 119.589 1.086 . . . . 0.0 109.804 -179.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.431 ' O ' ' HA ' ' A' ' 31' ' ' PRO . 4.7 mp -136.12 158.41 44.47 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-O 121.076 0.465 . . . . 0.0 110.74 -178.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.416 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 59.4 ttp -110.31 106.05 15.29 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 11.1 p90 -111.94 121.33 44.73 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 178.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp 58.29 27.71 15.63 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 123.627 0.771 . . . . 0.0 111.002 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.439 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 94.1 3.25 63.75 Favored Glycine 0 N--CA 1.444 -0.772 0 CA-C-N 115.796 -0.638 . . . . 0.0 113.167 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.416 ' O ' ' HA ' ' A' ' 26' ' ' MET . 14.1 mm100 -103.67 101.39 23.93 Favored Pre-proline 0 C--N 1.313 -1.007 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 179.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.439 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 2.0 Cg_endo -81.85 85.08 1.76 Allowed 'Trans proline' 0 N--CA 1.448 -1.196 0 C-N-CA 122.532 2.155 . . . . 0.0 109.783 175.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 29.5 mmt -100.29 156.27 17.32 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.757 -175.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.401 ' O ' ' HB3' ' A' ' 87' ' ' ARG . 9.1 m -84.27 113.23 20.97 Favored 'General case' 0 N--CA 1.409 -2.493 0 N-CA-C 105.916 -1.883 . . . . 0.0 105.916 174.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -95.61 148.16 22.81 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-O 121.78 0.8 . . . . 0.0 111.842 -176.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.2 tpp85 -122.2 129.77 52.57 Favored 'General case' 0 C--N 1.278 -2.541 0 N-CA-C 105.758 -1.941 . . . . 0.0 105.758 173.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.422 ' HB3' HD22 ' A' ' 100' ' ' ASN . 86.0 mt -72.37 119.2 16.24 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 175.428 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.435 HD21 ' HB3' ' A' ' 89' ' ' LEU . 17.9 mt -55.89 129.03 37.93 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 -177.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 11.1 mt 69.77 33.45 2.92 Favored 'General case' 0 C--N 1.356 0.873 0 O-C-N 124.787 1.304 . . . . 0.0 112.424 164.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.417 HG13 ' HB1' ' A' ' 109' ' ' ALA . 69.2 t -110.56 128.93 66.52 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.185 0 CA-C-N 114.678 -1.146 . . . . 0.0 108.09 178.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.45 ' HB2' ' HB2' ' A' ' 112' ' ' ALA . 16.8 t70 -103.84 108.27 19.51 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -179.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 36.7 p . . . . . 0 CA--C 1.561 1.385 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 176.499 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.211 -1.302 0 CA-C-O 118.805 -0.997 . . . . 0.0 113.813 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -51.07 -45.45 36.62 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 122.755 2.304 . . . . 0.0 112.406 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -63.75 -48.1 78.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.854 -179.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.33 -41.65 66.26 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.276 -177.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.3 p -63.23 -43.6 97.62 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -178.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.99 -41.05 95.76 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-O 120.937 0.398 . . . . 0.0 110.519 179.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -64.98 -50.92 64.47 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.458 177.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.539 ' O ' HG22 ' A' ' 66' ' ' VAL . 61.5 m -55.87 -46.97 78.13 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 123.9 0.75 . . . . 0.0 110.975 -179.085 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -56.54 -53.97 51.29 Favored 'General case' 0 C--O 1.214 -0.775 0 O-C-N 123.395 0.435 . . . . 0.0 111.608 178.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -64.2 -32.31 73.84 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 120.91 0.386 . . . . 0.0 111.52 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 11.4 tpt -67.74 -45.83 73.87 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.706 -178.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.539 HG22 ' O ' ' A' ' 62' ' ' THR . 28.8 m -89.61 -31.77 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 -175.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -75.96 -20.42 57.93 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.987 0.423 . . . . 0.0 111.552 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -90.38 -15.21 31.46 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.327 0.584 . . . . 0.0 110.504 175.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.437 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -77.58 149.16 34.87 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.747 -176.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -76.66 -65.62 0.91 Allowed 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.626 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.4 mtmm -109.52 135.43 50.53 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 -178.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 69.6 mt -104.74 119.93 54.44 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.091 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 175.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.452 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 32.9 mt-10 -113.32 136.56 52.62 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -177.261 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.47 HG12 HG12 ' A' ' 92' ' ' ILE . 33.1 m -110.41 126.15 67.68 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.873 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 176.011 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.494 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 40.8 tt0 -115.62 115.55 26.61 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -92.2 148.98 21.73 Favored 'General case' 0 C--N 1.287 -2.126 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -84.63 -178.78 6.98 Favored 'General case' 0 C--O 1.245 0.817 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 -176.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -8.07 54.94 Favored 'General case' 0 N--CA 1.44 -0.946 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 -172.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -93.32 -98.75 1.49 Allowed Glycine 0 N--CA 1.421 -2.364 0 C-N-CA 120.213 -0.994 . . . . 0.0 112.148 178.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.43 ' HB3' ' O ' ' A' ' 82' ' ' THR . 21.9 mp0 -98.71 127.11 44.53 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.295 0.569 . . . . 0.0 112.378 -176.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -89.2 -27.9 20.34 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 174.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.43 ' O ' ' HB3' ' A' ' 80' ' ' GLN . 11.0 p . . . . . 0 N--CA 1.422 -1.825 0 CA-C-N 114.618 -1.174 . . . . 0.0 109.952 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.401 ' HB3' ' O ' ' A' ' 33' ' ' THR . 69.8 mtt180 . . . . . 0 N--CA 1.449 -0.508 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -104.21 128.96 9.67 Favored Glycine 0 N--CA 1.431 -1.65 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 174.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.435 ' HB3' HD21 ' A' ' 37' ' ' LEU . 76.6 mt -110.01 108.35 18.55 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 117.154 0.477 . . . . 0.0 109.754 -179.493 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.11 167.33 30.76 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-O 121.654 0.74 . . . . 0.0 111.913 -178.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -96.94 127.48 42.95 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 104.332 -2.47 . . . . 0.0 104.332 170.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.47 HG12 HG12 ' A' ' 74' ' ' VAL . 55.3 mt -98.55 126.83 51.58 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.108 0 C-N-CA 117.684 -1.607 . . . . 0.0 111.578 -178.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.452 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 6.2 m-85 -105.77 127.1 52.89 Favored 'General case' 0 N--CA 1.428 -1.555 0 N-CA-C 107.478 -1.305 . . . . 0.0 107.478 176.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.437 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -104.34 99.93 9.64 Favored 'General case' 0 C--N 1.28 -2.451 0 N-CA-C 106.676 -1.601 . . . . 0.0 106.676 179.119 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 12.5 t70 45.39 57.73 4.67 Favored 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 125.797 1.639 . . . . 0.0 110.725 -172.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.87 -25.73 7.29 Favored Glycine 0 CA--C 1.526 0.722 0 CA-C-N 114.475 -1.239 . . . . 0.0 113.952 179.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -81.33 114.38 20.07 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -178.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 33.3 ttm -73.99 108.88 7.07 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 120.519 -0.472 . . . . 0.0 110.163 -176.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.0 t -66.12 -34.85 72.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 -178.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.422 HD22 ' HB3' ' A' ' 36' ' ' LEU . 26.8 t-20 -57.76 -50.59 72.72 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.938 178.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.437 ' HG3' ' OG ' ' B' ' 141' ' ' SER . 22.4 tt0 -65.86 -42.74 90.03 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.647 175.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.74 -44.11 77.26 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 122.92 0.488 . . . . 0.0 112.286 -178.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 90.0 mt -62.93 -44.09 97.01 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.844 0.354 . . . . 0.0 110.865 178.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.449 ' HA ' ' O ' ' A' ' 109' ' ' ALA . 58.6 t -70.43 -37.4 70.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.25 -179.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 10.3 tpp180 -67.16 -25.78 66.33 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.803 0.841 . . . . 0.0 110.2 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.457 ' O ' ' HB3' ' B' ' 150' ' ' LEU . 25.5 mm-40 -95.42 0.1 53.04 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.501 178.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.467 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 65.09 22.99 69.35 Favored Glycine 0 C--O 1.218 -0.848 0 C-N-CA 121.245 -0.502 . . . . 0.0 112.523 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 82.2 mt -81.67 -21.07 38.35 Favored 'General case' 0 CA--C 1.495 -1.139 0 CA-C-O 121.743 0.782 . . . . 0.0 108.981 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.449 ' O ' ' HA ' ' A' ' 104' ' ' VAL . . . -154.86 159.15 40.32 Favored 'General case' 0 N--CA 1.409 -2.524 0 N-CA-C 106.673 -1.603 . . . . 0.0 106.673 -179.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.411 ' HG3' ' HB3' ' A' ' 40' ' ' ASP . 15.4 pttp -121.23 157.86 29.36 Favored 'General case' 0 N--CA 1.416 -2.126 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.7 p -92.77 120.81 42.74 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 119.725 -0.79 . . . . 0.0 112.099 -172.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.45 ' HB2' ' HB2' ' A' ' 40' ' ' ASP . . . . . . . . 0 N--CA 1.436 -1.148 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 72.7 m80 . . . . . 0 N--CA 1.443 -0.78 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' B' ' 139' ' ' ARG . 12.3 pt-20 -51.7 -46.33 63.87 Favored 'General case' 0 C--N 1.358 0.946 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -171.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -66.37 -38.52 87.75 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 123.091 0.244 . . . . 0.0 111.236 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 79.4 mt -60.93 -48.43 81.86 Favored 'General case' 0 C--O 1.246 0.871 0 CA-C-O 121.913 0.863 . . . . 0.0 109.616 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 44.7 mt -69.69 -37.28 76.55 Favored 'General case' 0 N--CA 1.42 -1.93 0 N-CA-C 113.888 1.069 . . . . 0.0 113.888 -178.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 139' ' ' ARG . . . . . 0.554 ' HG2' ' O ' ' B' ' 135' ' ' GLU . 16.7 ptt-85 -70.7 -28.01 64.43 Favored 'General case' 0 N--CA 1.435 -1.205 0 C-N-CA 119.333 -0.947 . . . . 0.0 112.392 177.05 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -67.57 -41.24 84.46 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 173.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 141' ' ' SER . . . . . 0.437 ' OG ' ' HG3' ' A' ' 101' ' ' GLU . 43.3 m -59.11 -44.78 92.0 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.418 177.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.668 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 40.8 tt0 -66.13 -45.43 81.1 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 115.043 -0.981 . . . . 0.0 109.994 179.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -51.46 -47.3 63.16 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.894 0.877 . . . . 0.0 112.692 -178.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -64.55 -46.68 81.78 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 123.225 0.328 . . . . 0.0 111.024 177.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -61.07 -37.3 82.2 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.101 -178.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 146' ' ' LYS . . . . . 0.668 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 86.7 mttt -57.71 -48.85 78.42 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.136 0.493 . . . . 0.0 109.819 177.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -72.53 -37.15 68.39 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.439 -174.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -72.64 -12.21 60.95 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.603 178.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . 0.622 ' O ' ' HB2' ' B' ' 154' ' ' SER . 29.0 mmmt 59.74 53.33 4.94 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 -178.112 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . 0.457 ' HB3' ' O ' ' A' ' 106' ' ' GLN . 79.7 mt -92.17 121.42 33.68 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.09 -177.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 151' ' ' ASN . . . . . 0.467 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 45.9 m-80 50.46 -90.55 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.236 1.815 . . . . 0.0 113.704 176.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 152' ' ' ILE . . . . . 0.521 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 55.1 mt -63.48 -38.0 81.04 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.945 0 CA-C-O 121.407 0.622 . . . . 0.0 109.957 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 153' ' ' TRP . . . . . 0.468 ' CG ' ' HA ' ' B' ' 146' ' ' LYS . 60.5 m95 -79.77 -4.91 54.07 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-O 121.225 0.536 . . . . 0.0 111.574 -176.22 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . 0.622 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 32.5 t -95.62 9.54 39.88 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.724 175.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 9.2 pt-20 -70.19 -30.56 67.7 Favored 'General case' 0 C--N 1.35 0.59 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 173.26 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 18.0 t70 . . . . . 0 N--CA 1.447 -0.614 0 C-N-CA 126.153 1.781 . . . . 0.0 110.267 178.936 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 . . . . . 0 C--O 1.247 0.938 0 CA-C-O 120.451 0.167 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -71.39 154.91 41.21 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.65 176.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -139.41 152.52 69.3 Favored Pre-proline 0 C--N 1.277 -2.558 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.529 176.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -77.02 140.36 20.05 Favored 'Trans proline' 0 N--CA 1.447 -1.209 0 C-N-CA 121.989 1.793 . . . . 0.0 111.268 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -119.57 166.79 12.69 Favored 'General case' 0 C--N 1.288 -2.079 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.482 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 11.7 m -105.01 134.43 48.13 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 178.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.467 ' HB2' HD12 ' A' ' 72' ' ' ILE . 64.5 tp -72.99 133.61 44.36 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 120.931 0.396 . . . . 0.0 110.793 -179.131 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 64.8 mt -106.01 -59.11 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.751 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 172.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.4 pttt -170.95 134.02 0.94 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.162 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -95.5 106.25 18.31 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 107.759 -1.201 . . . . 0.0 107.759 174.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 48.3 mm -71.3 -50.13 43.16 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-O 121.399 0.619 . . . . 0.0 109.528 -176.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.498 ' HA ' ' CB ' ' A' ' 59' ' ' SER . 7.5 t70 -139.89 -162.33 1.32 Allowed 'General case' 0 C--N 1.294 -1.83 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 -178.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -91.84 -7.59 64.35 Favored Glycine 0 C--N 1.302 -1.314 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 177.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.456 ' HB2' ' OG1' ' A' ' 41' ' ' THR . 13.8 t70 -95.18 -56.97 2.55 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 113.813 -1.193 . . . . 0.0 110.117 -179.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -111.46 130.12 55.81 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.014 -176.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.3 p -137.92 138.35 43.96 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 C-N-CA 124.461 1.105 . . . . 0.0 108.281 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.8 tttp -100.11 122.5 43.06 Favored 'General case' 0 C--N 1.293 -1.878 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 -175.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.0 mp -125.71 159.4 32.39 Favored 'General case' 0 CA--C 1.497 -1.066 0 CA-C-O 121.358 0.599 . . . . 0.0 110.477 -178.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.482 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 43.6 ttm -118.0 120.03 36.58 Favored 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 114.737 -1.119 . . . . 0.0 108.368 177.159 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.8 p90 -120.41 114.13 21.36 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 59.1 mttp 60.95 27.45 17.31 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.821 0.848 . . . . 0.0 111.856 -177.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.13 2.76 64.01 Favored Glycine 0 C--N 1.314 -0.669 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.684 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 26' ' ' MET . 42.5 mt-30 -97.97 109.27 50.78 Favored Pre-proline 0 C--N 1.313 -0.983 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 177.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 30' ' ' GLN . 14.0 Cg_endo -88.86 106.4 0.45 Allowed 'Trans proline' 0 N--CA 1.443 -1.46 0 C-N-CA 122.732 2.288 . . . . 0.0 111.949 179.261 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -119.81 145.45 46.61 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.037 178.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 10.6 m -85.47 104.5 15.31 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 175.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -95.19 142.77 27.23 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-O 121.481 0.658 . . . . 0.0 111.155 -174.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.41 ' HD3' ' OD1' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -113.12 132.85 55.28 Favored 'General case' 0 C--N 1.275 -2.635 0 N-CA-C 104.416 -2.438 . . . . 0.0 104.416 174.016 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.511 ' HB2' ' HB ' ' A' ' 39' ' ' VAL . 6.6 mp -66.57 130.33 42.82 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -175.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.2 mt -62.11 127.36 30.98 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.787 174.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.404 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 74.4 mt 75.18 8.22 4.02 Favored 'General case' 0 C--O 1.221 -0.429 0 O-C-N 124.751 1.282 . . . . 0.0 113.062 176.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.511 ' HB ' ' HB2' ' A' ' 36' ' ' LEU . 84.9 t -118.12 125.8 74.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -135.56 123.57 22.79 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 178.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.456 ' OG1' ' HB2' ' A' ' 21' ' ' ASP . 73.8 p . . . . . 0 CA--C 1.569 1.701 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 1.577 0 CA-C-O 119.664 -0.52 . . . . 0.0 112.847 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -55.9 -22.99 40.39 Favored 'Trans proline' 0 C--N 1.37 1.675 0 C-N-CA 123.073 2.516 . . . . 0.0 114.237 176.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -86.3 -36.13 19.5 Favored 'General case' 0 C--O 1.209 -1.066 0 C-N-CA 120.113 -0.635 . . . . 0.0 109.817 178.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.35 -43.3 92.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.505 0.669 . . . . 0.0 110.16 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.498 ' CB ' ' HA ' ' A' ' 19' ' ' ASP . 8.8 p -68.05 -40.4 82.83 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.22 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.07 -46.63 64.55 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.13 -177.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -56.2 -44.78 79.77 Favored 'General case' 0 CA--C 1.507 -0.702 0 C-N-CA 123.795 0.838 . . . . 0.0 110.075 -179.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.442 ' O ' HG22 ' A' ' 66' ' ' VAL . 39.5 m -62.15 -45.17 94.61 Favored 'General case' 0 N--CA 1.439 -1.024 0 O-C-N 123.992 0.808 . . . . 0.0 110.591 179.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.533 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 49.1 mttp -58.0 -54.55 45.7 Favored 'General case' 0 C--O 1.212 -0.917 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 176.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -60.07 -33.86 72.65 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.509 -0.768 . . . . 0.0 112.046 -176.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.12 -51.44 21.39 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 179.741 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.442 HG22 ' O ' ' A' ' 62' ' ' THR . 32.8 m -71.5 -26.23 26.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -176.357 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.533 ' HG2' ' O ' ' A' ' 63' ' ' LYS . 79.9 mm-40 -71.9 -35.18 69.64 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.782 0.801 . . . . 0.0 109.191 174.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -73.59 -41.56 62.72 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.2 -178.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.13 146.64 54.05 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -177.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.8 mptt -78.09 -60.08 2.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.911 0.862 . . . . 0.0 108.714 179.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -107.06 128.08 54.05 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.521 -174.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.467 HD12 ' HB2' ' A' ' 14' ' ' LEU . 60.3 mt -100.56 124.11 53.91 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.345 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 170.382 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.568 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 21.5 mt-10 -112.34 133.38 54.47 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -173.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 28.9 m -111.97 129.51 67.3 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.187 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.969 179.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -128.93 142.58 50.89 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -110.13 116.29 31.28 Favored 'General case' 0 N--CA 1.423 -1.795 0 N-CA-C 110.552 -0.166 . . . . 0.0 110.552 177.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -102.29 -175.15 2.75 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 178.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.9 64.61 4.8 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 -172.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -128.27 -106.31 1.31 Allowed Glycine 0 C--N 1.292 -1.9 0 CA-C-N 114.779 -1.101 . . . . 0.0 110.477 174.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -137.91 145.94 42.71 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 -99.3 -10.06 22.81 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 120.356 -0.538 . . . . 0.0 109.736 178.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.448 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 40.1 p . . . . . 0 N--CA 1.435 -1.223 0 CA-C-O 120.857 0.36 . . . . 0.0 110.528 177.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 . . . . . 0 N--CA 1.442 -0.871 0 CA-C-O 121.163 0.506 . . . . 0.0 110.311 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.448 ' HA2' ' HA ' ' A' ' 82' ' ' THR . . . -119.01 162.5 13.47 Favored Glycine 0 N--CA 1.421 -2.351 0 N-CA-C 108.971 -1.652 . . . . 0.0 108.971 174.046 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 74.8 mt -134.16 129.51 35.93 Favored 'General case' 0 C--N 1.29 -1.993 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 176.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -153.16 157.66 40.64 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.078 0.466 . . . . 0.0 110.004 179.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -90.96 112.31 24.14 Favored 'General case' 0 C--N 1.294 -1.841 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 176.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 45.6 mm -98.81 126.56 51.97 Favored 'Isoleucine or valine' 0 C--O 1.257 1.451 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -170.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.568 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 4.4 m-85 -112.98 152.75 29.03 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 106.133 -1.803 . . . . 0.0 106.133 173.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -130.32 100.07 5.25 Favored 'General case' 0 C--N 1.28 -2.438 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 175.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.7 t70 45.63 58.02 4.57 Favored 'General case' 0 C--O 1.244 0.793 0 C-N-CA 125.017 1.327 . . . . 0.0 113.298 -179.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.86 -25.12 23.15 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.382 -0.913 . . . . 0.0 114.432 176.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -100.29 150.33 22.67 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 117.551 0.676 . . . . 0.0 109.304 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 58.6 mtm -97.13 119.87 36.43 Favored 'General case' 0 N--CA 1.414 -2.238 0 C-N-CA 120.336 -0.546 . . . . 0.0 111.429 178.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 38.4 t -63.38 -37.93 80.81 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.27 0 CA-C-N 114.621 -1.172 . . . . 0.0 108.404 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -59.24 -42.61 91.47 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 114.527 -1.215 . . . . 0.0 110.851 177.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -65.57 -56.09 14.17 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.85 -51.01 62.6 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.775 0.83 . . . . 0.0 112.636 -176.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 90.0 mt -58.15 -45.55 87.2 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 60.8 t -73.23 -36.81 50.66 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.04 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 30.0 mmt180 -65.97 -34.52 78.3 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 122.544 0.338 . . . . 0.0 111.541 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -87.14 2.16 50.73 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.645 178.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.04 33.19 86.51 Favored Glycine 0 C--O 1.226 -0.406 0 CA-C-N 116.34 -0.391 . . . . 0.0 112.995 177.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.3 mt -105.32 4.28 30.77 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 120.882 0.372 . . . . 0.0 110.559 -178.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -155.84 160.16 39.97 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.515 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -112.61 171.77 7.32 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 7.3 p -78.15 126.04 38.12 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.724 0 CA-C-O 121.476 0.655 . . . . 0.0 110.185 178.144 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.444 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.602 178.188 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 . . . . . 0 CA--C 1.504 -0.794 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.486 ' CG ' ' HE ' ' B' ' 139' ' ' ARG . 43.6 tt0 -62.28 -45.84 91.46 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.798 -177.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -57.86 -38.44 75.73 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.294 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 85.1 mt -67.02 -50.04 63.4 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.187 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.03 -26.51 65.91 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 139' ' ' ARG . . . . . 0.486 ' HE ' ' CG ' ' B' ' 135' ' ' GLU . 47.7 mtt180 -76.24 -22.25 55.4 Favored 'General case' 0 C--O 1.211 -0.971 0 C-N-CA 119.788 -0.765 . . . . 0.0 110.733 175.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -74.08 -32.0 63.06 Favored 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 172.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 13.6 m -65.85 -44.8 84.39 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.253 -0.885 . . . . 0.0 108.629 174.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.466 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 0.0 OUTLIER -64.99 -38.86 92.37 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.047 176.75 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -58.59 -39.79 81.36 Favored 'General case' 0 C--O 1.243 0.76 0 C-N-CA 122.7 0.4 . . . . 0.0 110.937 177.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 144' ' ' GLN . . . . . 0.445 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 53.8 tt0 -69.18 -48.56 61.86 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.836 179.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -64.25 -34.35 77.91 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.223 -175.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 146' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 80.7 mttt -58.32 -50.22 74.4 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.065 0.459 . . . . 0.0 111.124 174.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -70.46 -22.76 62.65 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.127 -177.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . 0.475 ' HB2' ' HG ' ' B' ' 150' ' ' LEU . 34.5 mm-40 -89.57 -7.71 54.25 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.31 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . 0.575 ' O ' ' HB2' ' B' ' 154' ' ' SER . 30.5 mmmt 52.08 52.51 14.23 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.543 1.137 . . . . 0.0 109.02 -177.024 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . 0.475 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 95.5 mt -88.36 113.38 23.9 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.23 -177.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 54.61 -89.26 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 125.841 1.656 . . . . 0.0 114.072 172.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 22.4 mt -65.01 -36.66 78.35 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.128 0 CA-C-O 121.049 0.452 . . . . 0.0 110.444 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 64.5 m95 -77.59 -9.25 58.84 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-O 121.523 0.678 . . . . 0.0 111.286 -177.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . 0.575 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 32.9 t -92.66 10.59 29.95 Favored 'General case' 0 N--CA 1.428 -1.575 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.574 175.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . 0.413 ' HG3' ' N ' ' B' ' 156' ' ' ASP . 6.6 pt-20 -55.14 -37.7 67.29 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 121.24 0.543 . . . . 0.0 110.418 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 156' ' ' ASP . . . . . 0.413 ' N ' ' HG3' ' B' ' 155' ' ' GLU . 29.4 t70 . . . . . 0 N--CA 1.423 -1.805 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -177.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.45 -0.466 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.7 tptm -108.13 131.88 54.17 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 114.712 -1.131 . . . . 0.0 108.569 -177.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -128.38 144.76 53.15 Favored Pre-proline 0 C--N 1.303 -1.43 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_exo -81.09 138.48 11.36 Favored 'Trans proline' 0 N--CA 1.447 -1.215 0 C-N-CA 121.89 1.726 . . . . 0.0 108.762 170.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -130.36 141.0 50.58 Favored 'General case' 0 C--N 1.289 -2.043 0 CA-C-O 121.152 0.501 . . . . 0.0 111.747 -177.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.486 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 38.0 m -90.23 127.24 36.08 Favored 'General case' 0 N--CA 1.416 -2.149 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 176.219 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.0 tp -78.47 129.71 35.2 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-O 120.623 0.249 . . . . 0.0 111.317 -177.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 71.7 mt -93.83 -56.94 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.625 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 175.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.448 ' HE3' ' HA ' ' A' ' 16' ' ' LYS . 1.8 tpmt? -175.2 145.22 0.77 Allowed 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 179.006 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.438 ' HA ' HG23 ' A' ' 23' ' ' VAL . . . -94.71 112.72 24.46 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 173.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.4 mp -82.75 -63.31 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.04 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 -173.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.417 ' HA ' ' HB3' ' A' ' 59' ' ' SER . 8.1 t70 -114.47 -164.07 0.91 Allowed 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 -176.222 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.67 -29.58 38.82 Favored Glycine 0 C--N 1.304 -1.215 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 -178.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.619 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 2.4 p30 -104.62 -30.44 9.97 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 120.869 -0.332 . . . . 0.0 111.452 178.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.75 116.14 31.95 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-O 121.84 0.829 . . . . 0.0 112.472 -175.064 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.438 HG23 ' HA ' ' A' ' 17' ' ' ALA . 3.5 p -131.85 142.32 43.32 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 -178.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.2 tttp -104.34 118.89 37.71 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.607 -0.683 . . . . 0.0 109.561 -173.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.457 HD11 HG21 ' A' ' 72' ' ' ILE . 3.6 mm? -119.06 159.3 24.16 Favored 'General case' 0 CA--C 1.502 -0.892 0 CA-C-O 121.731 0.777 . . . . 0.0 111.6 -178.224 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.486 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 46.0 ttm -121.7 102.15 8.03 Favored 'General case' 0 C--N 1.285 -2.214 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 174.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -105.29 117.62 34.47 Favored 'General case' 0 C--N 1.292 -1.913 0 C-N-CA 119.23 -0.988 . . . . 0.0 109.473 -176.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.9 mttt 61.96 30.62 18.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.748 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.02 -2.55 69.14 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 115.139 -0.937 . . . . 0.0 113.488 177.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.404 ' O ' ' HA ' ' A' ' 26' ' ' MET . 34.4 tt0 -103.84 112.48 65.57 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 117.013 0.406 . . . . 0.0 111.091 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -79.64 116.09 3.47 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 122.52 2.147 . . . . 0.0 111.924 177.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 51.0 ttm -136.43 141.2 43.58 Favored 'General case' 0 N--CA 1.423 -1.82 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.9 m -82.79 122.56 28.36 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 176.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.458 ' HA ' ' O ' ' A' ' 88' ' ' GLY . 56.4 m-85 -112.2 160.78 17.26 Favored 'General case' 0 N--CA 1.423 -1.796 0 CA-C-O 121.852 0.834 . . . . 0.0 112.762 -176.059 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.619 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 37.7 mtt180 -119.54 148.31 43.45 Favored 'General case' 0 C--N 1.288 -2.086 0 CA-C-N 113.508 -1.678 . . . . 0.0 106.565 167.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.406 ' HB2' HG21 ' A' ' 39' ' ' VAL . 5.9 mp -77.49 135.96 38.3 Favored 'General case' 0 C--N 1.289 -2.057 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.982 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.517 HD21 HD13 ' A' ' 89' ' ' LEU . 22.9 mt -70.34 152.73 43.82 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.357 175.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.466 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 3.6 mt 68.28 19.86 8.9 Favored 'General case' 0 C--O 1.212 -0.919 0 C-N-CA 125.964 1.706 . . . . 0.0 110.98 177.116 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.406 HG21 ' HB2' ' A' ' 36' ' ' LEU . 66.0 t -110.04 125.12 67.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 CA-C-O 121.27 0.557 . . . . 0.0 109.671 -178.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.551 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 26.6 t70 -98.33 108.07 20.69 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 105.601 -2.0 . . . . 0.0 105.601 173.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.442 HG21 ' NH2' ' A' ' 35' ' ' ARG . 5.0 t . . . . . 0 C--N 1.288 -2.09 0 CA-C-N 114.697 -1.138 . . . . 0.0 111.698 -173.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.328 0 CA-C-O 119.229 -0.761 . . . . 0.0 114.545 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -55.49 -34.03 88.18 Favored 'Trans proline' 0 C--N 1.364 1.351 0 C-N-CA 123.051 2.501 . . . . 0.0 113.514 178.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -71.26 -48.43 51.02 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.071 0.462 . . . . 0.0 110.446 178.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.525 ' HA ' HD13 ' A' ' 108' ' ' LEU . . . -65.07 -40.12 94.23 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.519 -178.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.476 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 29.8 p -65.28 -43.92 89.67 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.721 -178.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.27 -37.16 86.49 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.089 0.471 . . . . 0.0 110.706 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -67.95 -47.55 68.33 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.878 179.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.565 ' O ' HG22 ' A' ' 66' ' ' VAL . 58.5 m -58.84 -41.65 87.45 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.09 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 59' ' ' SER . 48.2 mttp -54.24 -54.71 36.29 Favored 'General case' 0 C--N 1.35 0.615 0 O-C-N 123.233 0.333 . . . . 0.0 110.848 178.353 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -66.39 -32.01 73.13 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.335 -176.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 17.4 tpt -67.0 -51.08 59.44 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.972 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 62' ' ' THR . 29.6 m -83.51 -27.53 7.6 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -175.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -81.46 -20.29 40.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -85.18 -20.63 29.92 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.585 0.707 . . . . 0.0 110.619 178.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -77.97 160.47 28.17 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.034 178.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -84.6 -57.95 2.92 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -105.46 144.19 32.57 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.081 -174.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.457 HG21 HD11 ' A' ' 25' ' ' LEU . 4.0 mp -116.86 120.39 64.9 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.811 0 N-CA-C 105.987 -1.857 . . . . 0.0 105.987 174.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.496 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 22.5 mt-10 -112.81 133.28 54.88 Favored 'General case' 0 C--N 1.279 -2.466 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -175.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 30.2 m -110.87 122.75 65.93 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.321 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -118.26 140.36 49.93 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-O 121.326 0.584 . . . . 0.0 111.374 -176.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.403 ' CD1' ' HB2' ' A' ' 81' ' ' ARG . 34.2 t80 -104.76 126.28 51.68 Favored 'General case' 0 N--CA 1.421 -1.923 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.897 179.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -85.68 -173.47 4.65 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 178.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -71.78 -12.29 61.23 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.903 -0.498 . . . . 0.0 112.091 -175.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -79.79 -118.05 0.31 Allowed Glycine 0 CA--C 1.525 0.708 0 N-CA-C 114.557 0.583 . . . . 0.0 114.557 -178.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -124.36 153.34 41.98 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 -176.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.403 ' HB2' ' CD1' ' A' ' 76' ' ' PHE . 43.0 ttm180 -106.97 -15.63 14.65 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 121.832 0.825 . . . . 0.0 108.876 174.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 2.2 p . . . . . 0 C--N 1.299 -1.62 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.96 178.796 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 9.7 tpp180 . . . . . 0 N--CA 1.428 -1.574 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.458 ' O ' ' HA ' ' A' ' 34' ' ' PHE . . . -95.53 142.43 16.09 Favored Glycine 0 N--CA 1.432 -1.573 0 N-CA-C 109.18 -1.568 . . . . 0.0 109.18 175.446 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.517 HD13 HD21 ' A' ' 37' ' ' LEU . 0.4 OUTLIER -134.38 135.15 42.45 Favored 'General case' 0 N--CA 1.419 -1.987 0 CA-C-N 117.9 0.85 . . . . 0.0 112.504 177.06 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -152.49 156.49 39.51 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -83.31 130.73 35.08 Favored 'General case' 0 N--CA 1.434 -1.259 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 178.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 60.5 mt -103.72 126.54 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.025 0 CA-C-O 121.563 0.697 . . . . 0.0 112.02 -175.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.496 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 79.1 m-85 -107.43 132.44 53.18 Favored 'General case' 0 N--CA 1.423 -1.805 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 172.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.27 99.36 8.97 Favored 'General case' 0 C--N 1.285 -2.237 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 177.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.3 t70 45.83 53.25 9.04 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 125.155 1.382 . . . . 0.0 111.355 -176.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 84.1 -5.02 81.65 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 115.617 -0.72 . . . . 0.0 114.641 179.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -96.89 141.07 30.52 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 117.927 0.863 . . . . 0.0 109.681 177.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 62.9 mtm -84.29 110.58 18.69 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-O 121.37 0.605 . . . . 0.0 110.901 179.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 54.9 t -65.94 -42.2 91.4 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 CA-C-N 114.525 -1.216 . . . . 0.0 111.49 -176.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -69.41 -30.41 68.36 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.057 0.456 . . . . 0.0 110.46 -178.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -62.12 -38.47 89.07 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 175.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -69.58 -36.72 76.52 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.237 178.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 89.2 mt -64.02 -44.16 93.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.35 177.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 66.3 t -69.74 -32.5 52.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 121.018 0.437 . . . . 0.0 110.27 178.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.93 -17.25 64.4 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.265 0.555 . . . . 0.0 111.008 179.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -108.86 -3.68 17.44 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 121.086 0.469 . . . . 0.0 110.033 176.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.537 ' HA3' ' O ' ' B' ' 150' ' ' LEU . . . 63.08 42.47 99.54 Favored Glycine 0 N--CA 1.437 -1.244 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.034 -177.191 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.525 HD13 ' HA ' ' A' ' 58' ' ' ALA . 75.8 mt -90.68 -20.57 22.34 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 121.006 0.432 . . . . 0.0 110.39 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -155.1 173.51 16.49 Favored 'General case' 0 N--CA 1.433 -1.275 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.523 -177.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.551 ' HB2' ' HB3' ' A' ' 40' ' ' ASP . 89.6 mttt -118.14 168.78 10.25 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 105.472 -2.048 . . . . 0.0 105.472 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 11.6 m -106.83 127.84 62.07 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 C-N-CA 117.378 -1.729 . . . . 0.0 111.937 178.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.494 ' HB2' ' HB2' ' A' ' 40' ' ' ASP . . . . . . . . 0 C--N 1.306 -1.296 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 175.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 . . . . . 0 N--CA 1.449 -0.497 0 N-CA-C 110.689 -0.115 . . . . 0.0 110.689 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -67.45 -50.27 59.98 Favored 'General case' 0 CA--C 1.501 -0.904 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 -172.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . 0.489 ' O ' ' HG3' ' B' ' 140' ' ' LYS . 72.7 mt-30 -52.24 -45.33 65.3 Favored 'General case' 0 C--N 1.314 -0.939 0 O-C-N 124.07 0.856 . . . . 0.0 111.784 -175.429 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.9 mt -63.59 -50.3 69.98 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 120.828 0.346 . . . . 0.0 110.871 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.64 -38.9 87.84 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.688 -178.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 77.0 mtt-85 -75.24 -29.15 60.14 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -176.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' B' ' 136' ' ' GLN . 63.5 mttm -70.56 -34.42 72.2 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.546 174.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 47.4 m -67.13 -41.75 85.62 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.489 174.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.522 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 40.0 tt0 -57.47 -52.77 64.03 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.427 176.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -51.84 -49.38 62.96 Favored 'General case' 0 C--O 1.24 0.558 0 O-C-N 123.782 0.676 . . . . 0.0 111.525 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 144' ' ' GLN . . . . . 0.47 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 27.5 tt0 -61.93 -47.19 86.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.417 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -63.28 -36.77 84.79 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 123.536 0.734 . . . . 0.0 111.746 -177.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 146' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 87.7 mttt -57.62 -48.81 78.41 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.344 0.593 . . . . 0.0 109.844 176.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -66.11 -32.33 73.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.858 -178.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 22.4 mm-40 -73.51 -20.58 60.63 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.456 178.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt 54.93 65.01 1.62 Allowed 'General case' 0 CA--C 1.506 -0.733 0 C-N-CA 124.501 1.12 . . . . 0.0 110.615 -172.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . 0.537 ' O ' ' HA3' ' A' ' 107' ' ' GLY . 95.7 mt -89.33 108.19 19.49 Favored 'General case' 0 C--N 1.301 -1.528 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.092 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 151' ' ' ASN . . . . . 0.408 ' HB3' ' O ' ' A' ' 107' ' ' GLY . 61.5 t30 48.45 -81.64 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 126.635 1.974 . . . . 0.0 114.525 175.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 12.6 tt -72.85 -25.15 21.83 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.499 0 CA-C-O 121.475 0.655 . . . . 0.0 109.833 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 153' ' ' TRP . . . . . 0.494 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 52.4 m95 -82.08 -4.74 57.51 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 121.783 0.802 . . . . 0.0 109.243 178.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 11.7 t -110.27 31.92 5.54 Favored 'General case' 0 N--CA 1.407 -2.606 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 175.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -69.67 -26.52 64.42 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 119.61 -0.836 . . . . 0.0 109.636 176.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 . . . . . 0 C--O 1.237 0.435 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 173.237 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 67.7 t60 . . . . . 0 N--CA 1.453 -0.302 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -106.83 153.56 22.3 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.158 0.504 . . . . 0.0 110.06 179.246 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 7.8 pt-20 -139.97 149.08 57.52 Favored Pre-proline 0 C--N 1.272 -2.785 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 172.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 8.0 Cg_exo -74.3 144.16 32.61 Favored 'Trans proline' 0 C--O 1.247 0.973 0 C-N-CA 121.924 1.749 . . . . 0.0 111.505 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.402 ' HB1' ' HB3' ' A' ' 25' ' ' LEU . . . -132.1 152.38 51.25 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.277 179.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.494 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 22.7 m -98.21 131.69 44.35 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.438 ' HA ' HD13 ' A' ' 25' ' ' LEU . 61.4 tp -76.27 124.21 27.13 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 120.943 0.402 . . . . 0.0 111.437 -178.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 70.0 mt -95.64 -60.21 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.224 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 176.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -154.81 160.2 41.1 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 123.756 0.822 . . . . 0.0 109.994 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.97 121.75 45.86 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 106.73 -1.582 . . . . 0.0 106.73 173.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.9 mp -92.95 -56.98 4.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.402 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.092 -175.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -141.57 -167.82 2.51 Favored 'General case' 0 C--N 1.311 -1.071 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 -177.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.532 ' HA2' ' OG1' ' A' ' 62' ' ' THR . . . -88.24 51.89 4.02 Favored Glycine 0 N--CA 1.44 -1.063 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 178.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.434 ' OD1' ' HD3' ' A' ' 35' ' ' ARG . 2.6 t70 179.06 -59.97 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.143 0 C-N-CA 125.813 1.645 . . . . 0.0 108.087 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.4 m -82.46 110.08 17.26 Favored 'General case' 0 N--CA 1.405 -2.706 0 CA-C-N 114.048 -1.433 . . . . 0.0 110.634 -175.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.1 t -125.15 152.82 31.98 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.2 tttp -111.19 117.67 33.86 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 118.793 0.724 . . . . 0.0 109.39 -175.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.481 ' HB2' ' CE1' ' A' ' 34' ' ' PHE . 3.3 mm? -123.62 153.94 40.02 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.614 0.721 . . . . 0.0 111.358 -175.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.531 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 49.1 ttm -112.29 109.1 18.56 Favored 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 174.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -115.96 116.19 27.49 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.165 -177.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.48 ' HA ' ' HE2' ' A' ' 28' ' ' LYS . 9.8 mmpt? 63.84 26.92 14.46 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.423 1.089 . . . . 0.0 109.577 -178.132 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.402 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 92.8 4.96 64.92 Favored Glycine 0 C--N 1.303 -1.263 0 CA-C-N 114.603 -1.18 . . . . 0.0 113.32 179.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.531 ' O ' ' HA ' ' A' ' 26' ' ' MET . 46.4 mt-30 -97.03 106.93 34.54 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.53 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.402 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 5.8 Cg_exo -80.42 102.49 1.42 Allowed 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 122.694 2.263 . . . . 0.0 110.354 177.424 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 89.6 mtp -133.98 150.64 51.27 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-O 121.371 0.605 . . . . 0.0 110.814 -177.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.6 m -86.47 126.74 34.63 Favored 'General case' 0 N--CA 1.415 -2.2 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 177.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.481 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 33.2 m-85 -97.15 157.95 15.68 Favored 'General case' 0 C--N 1.292 -1.903 0 C-N-CA 123.174 0.589 . . . . 0.0 111.853 -177.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.434 ' HD3' ' OD1' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -139.08 133.78 32.03 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 104.104 -2.554 . . . . 0.0 104.104 -179.187 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.6 mt -84.61 132.66 34.47 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.897 0.856 . . . . 0.0 112.265 -174.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.473 HD21 ' HB3' ' A' ' 89' ' ' LEU . 74.1 mt -73.31 138.34 45.37 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.115 177.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 38.8 mt 66.75 17.88 10.63 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.265 1.426 . . . . 0.0 112.964 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 59.5 t -110.64 136.92 45.16 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -126.15 106.67 9.73 Favored 'General case' 0 C--N 1.288 -2.103 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 174.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 19.6 m . . . . . 0 C--N 1.285 -2.22 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 177.975 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.365 0 CA-C-O 119.206 -0.775 . . . . 0.0 112.741 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -51.55 -29.49 32.3 Favored 'Trans proline' 0 C--N 1.363 1.315 0 C-N-CA 123.154 2.569 . . . . 0.0 113.082 177.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -72.77 -47.58 45.55 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 122.554 0.342 . . . . 0.0 110.283 178.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.33 -44.85 93.73 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.69 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.568 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 12.9 m -59.21 -46.87 87.31 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.111 178.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.11 -46.26 89.84 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -177.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -59.37 -40.86 87.86 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.742 -177.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.532 ' OG1' ' HA2' ' A' ' 20' ' ' GLY . 30.2 m -64.45 -47.15 80.15 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.217 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.568 ' HG3' ' O ' ' A' ' 59' ' ' SER . 55.2 mtpt -60.46 -44.03 96.31 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.379 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp -56.15 -54.04 49.85 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.625 177.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 53.0 ttm -66.07 -42.17 89.77 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.729 -175.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 35.1 m -71.65 -37.75 64.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.921 -0.712 . . . . 0.0 112.351 -178.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -75.36 -24.78 57.34 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -78.67 -21.63 47.99 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.508 0.671 . . . . 0.0 110.203 178.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.487 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -78.62 147.08 33.78 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.518 -178.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.25 -47.49 7.75 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.4 mtmp? -110.07 139.08 45.59 Favored 'General case' 0 CA--C 1.494 -1.211 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 3.8 mp -112.25 135.0 52.96 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.404 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 176.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.531 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 7.0 mm-40 -111.99 132.89 54.51 Favored 'General case' 0 N--CA 1.422 -1.826 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 -177.082 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.443 HG12 ' CD1' ' A' ' 92' ' ' ILE . 35.4 m -116.74 118.91 60.35 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 175.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.451 ' HA ' ' HA ' ' A' ' 9' ' ' LYS . 25.1 tt0 -116.25 136.45 53.0 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 121.395 0.617 . . . . 0.0 112.539 -173.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -108.48 140.22 42.12 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 125.222 1.409 . . . . 0.0 111.104 -176.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -122.89 -179.3 4.21 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -73.74 69.55 1.33 Allowed 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 124.766 1.226 . . . . 0.0 112.549 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -150.75 -164.03 11.7 Favored Glycine 0 C--N 1.28 -2.557 0 CA-C-N 113.297 -1.774 . . . . 0.0 109.573 174.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -89.81 142.47 27.66 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 176.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -101.51 -10.6 19.99 Favored 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.697 -176.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.3 p . . . . . 0 C--N 1.29 -2.005 0 O-C-N 122.114 -0.366 . . . . 0.0 110.157 178.122 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 . . . . . 0 N--CA 1.426 -1.633 0 CA-C-O 120.796 0.331 . . . . 0.0 110.47 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.66 115.01 3.97 Favored Glycine 0 N--CA 1.426 -1.987 0 N-CA-C 110.711 -0.956 . . . . 0.0 110.711 179.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.473 ' HB3' HD21 ' A' ' 37' ' ' LEU . 69.5 mt -86.41 101.55 13.23 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -157.19 167.81 29.26 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 -177.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.431 ' CE1' ' HB2' ' A' ' 37' ' ' LEU . 11.9 m-85 -90.21 127.51 36.14 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.352 175.425 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.443 ' CD1' HG12 ' A' ' 74' ' ' VAL . 51.0 mm -99.17 122.91 51.47 Favored 'Isoleucine or valine' 0 C--O 1.261 1.7 0 C-N-CA 120.193 -0.603 . . . . 0.0 109.508 177.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.531 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 14.1 m-85 -114.48 135.93 53.57 Favored 'General case' 0 N--CA 1.427 -1.623 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 174.6 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.487 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -105.45 109.17 21.05 Favored 'General case' 0 C--N 1.278 -2.529 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 -178.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 11.1 t70 46.95 40.45 9.28 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.614 1.566 . . . . 0.0 111.319 -177.193 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 96.03 -14.35 64.72 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.339 -0.846 . . . . 0.0 113.792 177.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 8.4 mptt -92.29 140.84 29.2 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -179.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . 0.414 ' HG3' ' CD1' ' A' ' 93' ' ' TYR . 1.9 mpt? -85.08 105.05 15.53 Favored 'General case' 0 C--N 1.297 -1.689 0 O-C-N 122.294 -0.254 . . . . 0.0 111.63 -176.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 30.0 t -66.59 -44.91 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-O 122.256 1.027 . . . . 0.0 108.456 -179.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.447 HD22 ' C ' ' A' ' 100' ' ' ASN . 0.1 OUTLIER -56.45 -43.61 79.67 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 113.37 -1.741 . . . . 0.0 110.721 -179.259 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -66.83 -51.44 55.57 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.517 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.48 -45.24 76.98 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.111 -0.95 . . . . 0.0 112.066 -177.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.2 mt -54.65 -52.67 61.58 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 178.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 62.0 t -71.01 -37.83 69.43 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.737 -178.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 23.5 ttp85 -69.94 -21.49 63.26 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 -179.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -95.93 3.71 53.33 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.977 175.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.74 29.49 73.84 Favored Glycine 0 C--N 1.331 0.287 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.792 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.9 mt -95.08 -15.03 23.73 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.192 0.52 . . . . 0.0 110.198 -179.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -149.24 162.27 40.35 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -106.22 171.47 7.33 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 10.2 p -93.56 133.57 34.23 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 177.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.292 -1.932 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 174.537 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 5.5 p80 . . . . . 0 C--O 1.235 0.328 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -67.75 -48.34 66.68 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.212 -173.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -60.08 -33.56 72.25 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.069 -0.969 . . . . 0.0 112.937 -178.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 91.8 mt -59.54 -47.71 84.48 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.324 0.583 . . . . 0.0 109.538 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 138' ' ' LEU . . . . . 0.444 HD11 ' ND2' ' A' ' 100' ' ' ASN . 4.4 mm? -68.5 -40.61 80.81 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.404 178.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 -63.96 -36.46 84.05 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.486 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -68.63 -43.72 75.73 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.707 0.289 . . . . 0.0 110.718 175.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.0 m -61.41 -45.39 94.52 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.945 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.493 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 0.1 OUTLIER -68.78 -43.11 76.41 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.207 178.434 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -60.1 -44.36 94.9 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.803 0.335 . . . . 0.0 110.722 179.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 144' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 35.5 tt0 -67.43 -47.85 69.01 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.774 -179.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.91 85.4 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -177.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 146' ' ' LYS . . . . . 0.493 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 84.6 mttt -62.25 -47.35 84.76 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.888 175.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -69.92 -31.36 69.09 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 123.447 0.467 . . . . 0.0 112.019 -175.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 11.8 mm-40 -79.95 -17.68 52.36 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.89 178.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . 0.63 ' O ' ' HB3' ' B' ' 154' ' ' SER . 13.0 mmmm 60.25 65.45 1.08 Allowed 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -174.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . 0.478 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 97.6 mt -98.98 123.44 43.28 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 115.925 -0.579 . . . . 0.0 112.287 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 49.45 -88.51 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 126.324 1.85 . . . . 0.0 114.951 173.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 48.3 mt -66.29 -37.35 79.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.165 0.507 . . . . 0.0 110.226 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 62.7 m95 -77.25 -21.0 54.38 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.575 -175.095 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . 0.63 ' HB3' ' O ' ' B' ' 149' ' ' LYS . 80.7 p -91.89 21.11 5.11 Favored 'General case' 0 N--CA 1.419 -1.989 0 CA-C-O 121.338 0.59 . . . . 0.0 111.049 -178.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -64.33 -31.97 73.38 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 170.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 27.0 t70 . . . . . 0 N--CA 1.42 -1.948 0 CA-C-N 113.076 -1.875 . . . . 0.0 107.832 -179.378 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.6 m80 . . . . . 0 CA--C 1.502 -0.867 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -96.6 145.45 25.73 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.68 175.332 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.401 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 11.2 pt-20 -139.28 149.72 61.76 Favored Pre-proline 0 C--N 1.287 -2.15 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 5.1 Cg_exo -78.39 140.96 17.61 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 122.272 1.981 . . . . 0.0 113.172 -177.021 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.437 ' O ' ' HB ' ' A' ' 72' ' ' ILE . . . -132.24 154.83 49.24 Favored 'General case' 0 N--CA 1.424 -1.761 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.433 178.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.478 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 50.0 m -98.52 122.46 41.74 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.2 tp -66.56 118.84 10.73 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 176.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 39.0 mm -90.09 -56.9 4.69 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -165.0 153.93 12.47 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.567 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -111.25 123.11 49.54 Favored 'General case' 0 C--N 1.287 -2.15 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 176.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.3 mp -90.79 -64.32 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -175.016 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -130.65 -173.71 3.15 Favored 'General case' 0 C--N 1.31 -1.138 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 179.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.67 54.63 4.39 Favored Glycine 0 C--N 1.314 -0.654 0 N-CA-C 111.401 -0.68 . . . . 0.0 111.401 -178.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.543 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 4.2 p-10 -177.14 -36.51 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -178.115 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 p -111.33 112.06 23.55 Favored 'General case' 0 N--CA 1.422 -1.832 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.92 -178.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.8 m -131.63 143.19 41.14 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.645 0 CA-C-N 114.6 -1.182 . . . . 0.0 108.178 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 33' ' ' THR . 81.0 tttt -104.8 117.77 34.88 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 122.023 -0.423 . . . . 0.0 110.069 -176.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.2 mp -120.49 147.01 45.69 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.502 -179.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.629 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 44.1 ttm -108.15 108.96 20.25 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 175.128 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -115.38 130.7 56.97 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -178.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 32.4 pttt 41.77 35.74 0.54 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.849 1.26 . . . . 0.0 113.559 -174.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.445 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 95.32 -0.92 64.07 Favored Glycine 0 N--CA 1.442 -0.9 0 CA-C-N 114.929 -1.032 . . . . 0.0 114.668 177.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.629 ' O ' ' HA ' ' A' ' 26' ' ' MET . 1.8 mp0 -99.09 105.8 34.33 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 117.973 0.886 . . . . 0.0 111.458 178.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.445 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 1.7 Cg_endo -82.79 104.13 1.26 Allowed 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 122.261 1.974 . . . . 0.0 109.686 173.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 86.8 mtp -128.54 143.25 50.93 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 120.658 0.266 . . . . 0.0 110.562 -177.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.408 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 15.8 m -80.48 116.22 20.41 Favored 'General case' 0 N--CA 1.421 -1.92 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 174.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -98.19 154.62 17.64 Favored 'General case' 0 C--N 1.293 -1.891 0 C-N-CA 124.04 0.936 . . . . 0.0 111.551 -177.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.543 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -122.47 122.98 40.23 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 103.73 -2.693 . . . . 0.0 103.73 174.048 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.6 mp -61.77 126.0 25.81 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 123.389 0.431 . . . . 0.0 111.766 -177.184 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.432 HD21 ' HB3' ' A' ' 89' ' ' LEU . 71.7 mt -57.63 134.76 56.45 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.364 175.41 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.543 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 44.0 mt 70.04 16.77 7.5 Favored 'General case' 0 C--O 1.215 -0.714 0 C-N-CA 124.957 1.303 . . . . 0.0 113.002 179.354 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.599 HG23 HD22 ' A' ' 100' ' ' ASN . 55.6 t -119.49 127.5 75.86 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.755 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 177.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -137.15 129.52 29.78 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 123.432 0.457 . . . . 0.0 110.179 177.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.9 m . . . . . 0 N--CA 1.426 -1.657 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 174.283 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.297 0 CA-C-O 119.634 -0.537 . . . . 0.0 113.7 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -58.15 -22.57 57.12 Favored 'Trans proline' 0 C--N 1.361 1.203 0 C-N-CA 122.792 2.328 . . . . 0.0 113.154 177.321 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -82.69 -37.94 24.08 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.949 0.404 . . . . 0.0 109.914 178.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.63 -47.14 85.05 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.799 177.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.523 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 16.3 p -62.16 -44.7 96.04 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.367 179.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.59 -47.52 81.91 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 122.684 0.394 . . . . 0.0 111.499 -179.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -64.37 -40.64 96.23 Favored 'General case' 0 C--O 1.244 0.807 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.353 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 38.7 m -61.06 -45.14 95.98 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.9 178.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.567 ' HG2' ' HB3' ' A' ' 17' ' ' ALA . 61.4 mtpt -59.83 -52.94 63.32 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.593 -178.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.462 ' N ' ' HE2' ' A' ' 64' ' ' LYS . 0.3 OUTLIER -62.14 -33.46 74.54 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 179.258 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 53.3 tpp -65.5 -44.53 86.75 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 120.713 0.292 . . . . 0.0 110.8 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.7 m -75.39 -25.03 17.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.972 179.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.531 ' HG3' ' O ' ' A' ' 63' ' ' LYS . 44.9 mt-10 -71.43 -31.57 67.37 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.915 0.388 . . . . 0.0 110.053 174.059 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -78.13 -9.67 59.27 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 123.858 0.863 . . . . 0.0 111.319 -177.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.03 128.36 36.26 Favored 'General case' 0 C--O 1.252 1.211 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.459 -178.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 49.1 mttp -68.16 -47.81 67.03 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 105.755 -1.942 . . . . 0.0 105.755 171.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.462 ' H ' ' HB3' ' A' ' 95' ' ' ASP . 4.2 mtpm? -132.96 133.51 43.28 Favored 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 105.25 -2.13 . . . . 0.0 105.25 -179.108 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.437 ' HB ' ' O ' ' A' ' 12' ' ' ALA . 3.8 mp -91.72 119.96 39.98 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.361 0 N-CA-C 105.803 -1.925 . . . . 0.0 105.803 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.579 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 5.5 mm-40 -112.53 133.5 54.56 Favored 'General case' 0 C--N 1.294 -1.817 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.067 -171.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.5 m -110.94 125.62 68.28 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 174.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -114.01 131.33 56.39 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -178.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.466 ' CE1' ' HB2' ' A' ' 81' ' ' ARG . 60.3 t80 -102.47 122.58 44.6 Favored 'General case' 0 N--CA 1.421 -1.878 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.382 178.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.412 ' CG ' ' H ' ' A' ' 78' ' ' LYS . 14.9 t70 -94.52 -173.51 3.06 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-N 114.925 -1.034 . . . . 0.0 108.442 178.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.412 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 82.1 mttt -81.58 17.03 1.52 Allowed 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 125.002 1.321 . . . . 0.0 111.184 -173.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -107.19 -121.91 4.79 Favored Glycine 0 N--CA 1.44 -1.083 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.377 -178.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -110.81 149.14 30.99 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 122.509 0.323 . . . . 0.0 110.638 -176.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.466 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . 43.2 ttp180 -110.23 -8.16 14.78 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.577 0.703 . . . . 0.0 109.172 177.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 2.1 p . . . . . 0 C--N 1.316 -0.856 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.515 -179.651 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . 0.441 ' CG ' ' HB2' ' A' ' 35' ' ' ARG . 9.8 tpp180 . . . . . 0 N--CA 1.426 -1.659 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.23 146.27 23.73 Favored Glycine 0 N--CA 1.439 -1.159 0 N-CA-C 109.821 -1.312 . . . . 0.0 109.821 177.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.432 ' HB3' HD21 ' A' ' 37' ' ' LEU . 93.0 mt -126.64 119.91 28.2 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.05 161.65 40.39 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.443 ' CZ ' ' HB3' ' A' ' 100' ' ' ASN . 29.9 t80 -91.89 123.45 35.28 Favored 'General case' 0 N--CA 1.412 -2.369 0 N-CA-C 105.469 -2.049 . . . . 0.0 105.469 174.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 38.1 mm -99.44 130.84 47.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 CA-C-O 120.879 0.371 . . . . 0.0 110.736 -172.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.579 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 87.4 m-85 -122.09 147.59 45.93 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 174.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.13 98.95 8.59 Favored 'General case' 0 C--N 1.284 -2.241 0 N-CA-C 105.342 -2.095 . . . . 0.0 105.342 171.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.462 ' HB3' ' H ' ' A' ' 71' ' ' LYS . 4.2 p30 45.41 31.24 0.83 Allowed 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 125.045 1.338 . . . . 0.0 113.608 -175.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.49 -5.41 35.36 Favored Glycine 0 CA--C 1.524 0.633 0 CA-C-N 115.949 -0.568 . . . . 0.0 113.712 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -83.26 125.02 31.14 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 173.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 1.5 mpt? -67.4 102.85 1.17 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 117.868 0.303 . . . . 0.0 110.26 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 49.5 t -66.5 -38.69 82.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.599 HD22 HG23 ' A' ' 39' ' ' VAL . 6.7 t-20 -57.78 -51.68 68.59 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.438 176.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.493 ' O ' ' HG3' ' A' ' 105' ' ' ARG . 35.1 tt0 -69.96 -34.94 74.07 Favored 'General case' 0 C--O 1.204 -1.32 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.696 -174.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.49 -43.3 88.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.925 0.393 . . . . 0.0 110.293 177.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.7 mt -65.33 -42.81 92.53 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.757 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 100' ' ' ASN . 84.2 t -65.48 -41.48 91.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.346 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 101' ' ' GLU . 17.1 mtm180 -70.29 -16.39 63.01 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.082 0.553 . . . . 0.0 111.701 -178.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -105.56 1.85 27.84 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.586 176.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 59.55 44.37 96.84 Favored Glycine 0 C--O 1.219 -0.795 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.525 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.3 mt -106.27 10.4 31.75 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -177.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -165.5 170.33 14.51 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 178.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.406 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 96.8 mttt -116.57 147.12 42.14 Favored 'General case' 0 CA--C 1.491 -1.296 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 175.021 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.543 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 99.1 t -73.79 133.85 30.81 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 C-N-CA 120.122 -0.631 . . . . 0.0 109.744 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.644 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 179.475 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 134' ' ' HIS . . . . . 0.502 ' O ' ' HG ' ' B' ' 138' ' ' LEU . 64.4 m-70 . . . . . 0 N--CA 1.479 0.977 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -37.44 -63.67 0.43 Allowed 'General case' 0 C--O 1.205 -1.253 0 C-N-CA 126.279 1.832 . . . . 0.0 113.907 -174.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -61.96 -33.55 74.49 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -170.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 88.0 mt -70.47 -47.25 61.48 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 122.052 0.929 . . . . 0.0 108.775 176.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 138' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' B' ' 134' ' ' HIS . 62.5 mt -67.79 -41.18 83.58 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 114.387 -1.279 . . . . 0.0 111.763 -176.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -75.44 -19.73 59.29 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.216 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 17.3 tppt? -72.6 -38.89 67.68 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 173.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 45.2 m -66.81 -35.45 80.09 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.404 174.414 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.555 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 24.6 tt0 -62.68 -54.08 44.81 Favored 'General case' 0 C--O 1.205 -1.24 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.245 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.56 -35.92 66.25 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 123.19 0.596 . . . . 0.0 111.226 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 144' ' ' GLN . . . . . 0.614 ' HA ' HE21 ' B' ' 144' ' ' GLN . 0.0 OUTLIER -70.97 -47.85 56.65 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.952 176.95 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -65.07 -35.41 81.07 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 122.45 0.3 . . . . 0.0 111.66 -178.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 146' ' ' LYS . . . . . 0.555 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 82.6 mttt -60.88 -46.18 91.63 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 177.009 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -62.53 -35.52 79.67 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.082 -177.345 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 43.7 mm-40 -88.86 -6.43 57.33 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-N 114.592 -1.185 . . . . 0.0 112.41 -174.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . 0.564 ' O ' ' HB2' ' B' ' 154' ' ' SER . 35.4 mmtp 53.61 54.35 10.13 Favored 'General case' 0 CA--C 1.512 -0.497 0 O-C-N 123.964 0.79 . . . . 0.0 110.927 -178.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 95.6 mt -82.92 114.76 21.43 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.783 -179.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 51.31 -93.28 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.475 1.51 . . . . 0.0 114.734 176.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 12.1 mt -64.38 -36.19 76.47 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.851 0 C-N-CA 122.605 0.362 . . . . 0.0 111.748 -179.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 153' ' ' TRP . . . . . 0.406 ' CH2' ' HG2' ' A' ' 110' ' ' LYS . 60.3 m95 -67.97 -23.14 65.01 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.043 0.449 . . . . 0.0 110.363 -179.284 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . 0.564 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 10.1 t -85.79 42.98 1.0 Allowed 'General case' 0 N--CA 1.442 -0.871 0 CA-C-O 122.116 0.96 . . . . 0.0 108.792 179.227 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -74.22 -22.66 59.26 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 114.684 -1.143 . . . . 0.0 108.41 172.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 19.5 t70 . . . . . 0 N--CA 1.432 -1.355 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 175.305 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 23.0 m170 . . . . . 0 N--CA 1.44 -0.944 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.421 ' HA ' ' O ' ' A' ' 74' ' ' VAL . 36.6 ttmt -121.01 135.16 55.28 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 114.377 -1.283 . . . . 0.0 109.094 -179.122 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -138.95 157.35 71.71 Favored Pre-proline 0 C--N 1.296 -1.735 0 C-N-CA 122.504 0.322 . . . . 0.0 110.848 177.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -71.18 148.09 55.24 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 122.358 2.039 . . . . 0.0 112.75 -178.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.24 161.51 37.25 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.951 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.433 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 20.4 m -109.78 145.36 36.81 Favored 'General case' 0 C--N 1.293 -1.891 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 176.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.7 tp -83.95 134.98 34.64 Favored 'General case' 0 C--N 1.295 -1.769 0 C-N-CA 120.089 -0.645 . . . . 0.0 109.752 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 41.3 mm -91.79 -57.58 4.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 171.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -168.84 141.73 2.82 Favored 'General case' 0 N--CA 1.416 -2.171 0 CA-C-N 115.164 -0.925 . . . . 0.0 108.899 178.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.484 ' HA ' HG23 ' A' ' 23' ' ' VAL . . . -99.93 110.1 22.44 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 171.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.6 mp -89.54 -53.79 8.74 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-O 121.376 0.608 . . . . 0.0 110.034 -174.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -129.99 169.08 15.72 Favored 'General case' 0 C--N 1.291 -1.947 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -175.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.31 -29.48 73.27 Favored Glycine 0 C--N 1.306 -1.104 0 O-C-N 123.987 0.805 . . . . 0.0 111.775 178.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.575 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 2.3 m-20 -96.99 -46.99 5.98 Favored 'General case' 0 CA--C 1.492 -1.274 0 CA-C-O 120.952 0.406 . . . . 0.0 110.866 177.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.6 m -96.72 113.33 24.87 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-O 121.472 0.653 . . . . 0.0 111.84 -171.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.484 HG23 ' HA ' ' A' ' 17' ' ' ALA . 5.8 p -135.07 144.76 33.56 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.182 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.109 -177.44 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -106.98 123.01 47.57 Favored 'General case' 0 CA--C 1.49 -1.353 0 O-C-N 121.63 -0.669 . . . . 0.0 111.524 -179.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.9 mp -125.82 151.03 47.34 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.987 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.497 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 25.9 ttt -117.52 106.26 12.96 Favored 'General case' 0 C--N 1.289 -2.054 0 CA-C-N 114.911 -1.041 . . . . 0.0 108.871 -178.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -113.39 123.66 50.6 Favored 'General case' 0 C--N 1.287 -2.131 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 96.4 mttt 58.79 27.73 16.43 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 123.399 0.679 . . . . 0.0 111.803 177.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.444 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 93.82 6.6 61.99 Favored Glycine 0 N--CA 1.44 -1.062 0 C-N-CA 120.83 -0.7 . . . . 0.0 113.104 179.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.497 ' O ' ' HA ' ' A' ' 26' ' ' MET . 17.9 mm-40 -107.3 98.37 22.64 Favored Pre-proline 0 C--N 1.318 -0.775 0 CA-C-N 116.85 0.325 . . . . 0.0 110.562 178.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 6.0 Cg_exo -80.76 97.16 1.0 Allowed 'Trans proline' 0 C--O 1.243 0.742 0 C-N-CA 122.98 2.453 . . . . 0.0 110.565 174.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 49.8 ttm -112.87 145.62 40.37 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.387 -176.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 32.1 m -82.16 120.08 24.87 Favored 'General case' 0 N--CA 1.42 -1.957 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 174.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.431 ' HA ' ' O ' ' A' ' 88' ' ' GLY . 74.9 m-85 -114.38 154.2 28.51 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-O 121.399 0.619 . . . . 0.0 111.682 -177.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.575 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 37.8 mtp180 -118.23 148.09 42.75 Favored 'General case' 0 C--N 1.288 -2.109 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.058 164.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.419 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 5.2 mp -77.66 123.32 26.5 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.668 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 68.1 mt -63.94 142.04 58.55 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.432 176.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.637 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 67.3 mt 72.65 10.56 5.59 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.336 1.055 . . . . 0.0 112.503 177.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 97.5 t -113.49 140.85 31.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.223 0.535 . . . . 0.0 111.979 -176.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.4 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 17.8 t70 -135.1 107.52 7.31 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 172.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 82.3 p . . . . . 0 CA--C 1.571 1.772 0 N-CA-C 116.555 2.058 . . . . 0.0 116.555 179.29 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.423 0 CA-C-O 119.341 -0.7 . . . . 0.0 112.611 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -53.89 -34.98 78.33 Favored 'Trans proline' 0 C--N 1.368 1.601 0 C-N-CA 123.256 2.637 . . . . 0.0 113.764 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -66.4 -38.3 87.19 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.29 0.567 . . . . 0.0 109.628 -179.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.92 -48.44 63.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.871 177.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.453 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 19.1 m -57.71 -39.61 77.62 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.024 179.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.03 -34.88 78.51 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.142 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -69.63 -41.93 74.98 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 -177.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.463 ' O ' HG22 ' A' ' 66' ' ' VAL . 28.8 m -59.4 -47.99 83.33 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 175.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 59' ' ' SER . 60.8 mtpt -55.23 -51.89 65.14 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.682 178.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -64.22 -34.17 77.47 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -177.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 20.1 mmt -70.36 -47.93 58.7 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.659 177.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.463 HG22 ' O ' ' A' ' 62' ' ' THR . 33.9 m -75.18 -36.53 37.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -176.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -75.28 -23.94 57.49 Favored 'General case' 0 C--O 1.24 0.583 0 O-C-N 122.111 -0.368 . . . . 0.0 111.904 -179.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -78.98 -40.32 31.99 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.057 175.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -56.27 132.66 51.36 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 123.688 0.795 . . . . 0.0 112.329 -177.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -75.02 -50.33 16.87 Favored 'General case' 0 CA--C 1.501 -0.937 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 175.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -104.3 119.91 40.02 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.954 -178.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 69.4 mt -102.3 128.94 54.5 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.664 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 175.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.55 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 23.2 mt-10 -122.5 139.16 54.2 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 120.504 0.192 . . . . 0.0 110.758 -176.201 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.421 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 18.1 m -113.73 128.69 70.5 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 175.062 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -122.62 115.71 22.59 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.0 p90 -91.56 124.89 36.06 Favored 'General case' 0 N--CA 1.417 -2.12 0 CA-C-O 121.409 0.623 . . . . 0.0 111.323 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . 0.401 ' CG ' ' H ' ' A' ' 78' ' ' LYS . 17.1 t70 -91.67 176.8 6.41 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.255 -176.025 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.438 ' H ' ' HG2' ' A' ' 78' ' ' LYS . 18.0 pttm -82.14 -5.65 58.6 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 126.56 1.944 . . . . 0.0 112.109 -177.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -81.77 -138.45 2.63 Favored Glycine 0 C--O 1.246 0.87 0 C-N-CA 120.584 -0.817 . . . . 0.0 111.468 176.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -74.22 120.84 20.34 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 176.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -108.56 -8.18 15.56 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 121.82 0.819 . . . . 0.0 109.141 -176.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 10.0 p . . . . . 0 N--CA 1.438 -1.039 0 CA-C-N 114.986 -1.007 . . . . 0.0 110.331 179.317 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.1 mtm180 . . . . . 0 CA--C 1.484 -1.568 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . 0.431 ' O ' ' HA ' ' A' ' 34' ' ' PHE . . . -93.42 149.72 19.58 Favored Glycine 0 N--CA 1.42 -2.373 0 N-CA-C 109.29 -1.524 . . . . 0.0 109.29 176.182 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 89.3 mt -123.52 120.35 32.64 Favored 'General case' 0 C--N 1.287 -2.116 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 179.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -149.98 167.44 26.69 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 120.832 0.349 . . . . 0.0 110.489 -176.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.505 ' CZ ' ' HB2' ' A' ' 100' ' ' ASN . 5.4 t80 -94.25 133.02 38.22 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 105.618 -1.993 . . . . 0.0 105.618 174.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 44.4 mm -103.32 125.39 57.82 Favored 'Isoleucine or valine' 0 C--O 1.249 1.064 0 CA-C-O 120.919 0.39 . . . . 0.0 110.315 -175.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.55 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 61.8 m-85 -109.63 133.16 53.43 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 177.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.53 103.44 12.96 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -178.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.8 t70 46.98 40.46 9.38 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 125.69 1.596 . . . . 0.0 111.944 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.54 -25.0 24.38 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 115.034 -0.985 . . . . 0.0 113.584 177.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -97.09 160.46 14.33 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 117.081 0.44 . . . . 0.0 110.682 -176.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . 0.49 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 3.8 mpp? -92.47 116.18 28.75 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -174.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 49.1 t -73.05 -46.8 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 120.817 0.342 . . . . 0.0 110.697 -178.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.505 ' HB2' ' CZ ' ' A' ' 91' ' ' TYR . 1.4 m-20 -54.43 -50.92 66.49 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.025 -0.988 . . . . 0.0 112.25 -173.474 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.488 ' HB3' HD22 ' B' ' 138' ' ' LEU . 9.8 pt-20 -75.22 -27.34 59.51 Favored 'General case' 0 N--CA 1.426 -1.646 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -179.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.87 -39.78 95.5 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.038 0.447 . . . . 0.0 110.131 176.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 82.8 mt -56.72 -45.91 81.63 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.5 175.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 46.7 t -73.14 -35.4 47.54 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.109 -178.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 13.2 mmm180 -55.92 -41.47 74.61 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.983 0.913 . . . . 0.0 111.862 176.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -87.17 1.42 53.1 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.041 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.514 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 70.22 37.33 71.66 Favored Glycine 0 C--O 1.222 -0.595 0 C-N-CA 121.536 -0.364 . . . . 0.0 112.631 179.087 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 83.6 mt -106.61 -8.85 16.78 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-O 121.01 0.433 . . . . 0.0 110.733 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -147.47 154.28 40.59 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.279 -178.19 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.4 ' HB2' ' HB3' ' A' ' 40' ' ' ASP . 94.9 mttt -105.3 166.23 10.56 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.411 HG12 ' OE2' ' B' ' 142' ' ' GLU . 7.3 p -86.99 122.61 39.12 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 CA-C-O 121.762 0.791 . . . . 0.0 110.914 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.637 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . . . . . . 0 C--N 1.295 -1.787 0 N-CA-C 107.135 -1.431 . . . . 0.0 107.135 174.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 134' ' ' HIS . . . . . 0.432 ' O ' HD23 ' B' ' 138' ' ' LEU . 11.2 m-70 . . . . . 0 C--O 1.208 -1.114 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.464 ' OE2' ' HD2' ' B' ' 139' ' ' ARG . 2.3 tm-20 -57.61 -42.59 83.59 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.451 -1.25 . . . . 0.0 112.459 -172.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -69.81 -42.59 73.49 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-O 121.466 0.651 . . . . 0.0 109.449 -178.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 95.3 mt -60.95 -45.56 94.22 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.317 178.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 138' ' ' LEU . . . . . 0.488 HD22 ' HB3' ' A' ' 101' ' ' GLU . 4.3 mm? -60.38 -47.41 86.17 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.743 176.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 139' ' ' ARG . . . . . 0.464 ' HD2' ' OE2' ' B' ' 135' ' ' GLU . 53.3 mtt180 -62.62 -41.08 98.8 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 178.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -64.48 -35.47 81.05 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.553 176.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 30.7 m -68.35 -41.9 80.04 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.228 177.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.525 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 38.5 tt0 -64.56 -50.66 66.42 Favored 'General case' 0 CA--C 1.495 -1.162 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.146 179.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . 0.519 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -56.64 -39.22 73.3 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.857 0.723 . . . . 0.0 110.896 -179.097 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 144' ' ' GLN . . . . . 0.485 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 35.4 tt0 -65.1 -47.67 76.39 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.689 178.239 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -63.62 -33.48 75.71 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.02 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 146' ' ' LYS . . . . . 0.545 ' HA ' ' CG ' ' B' ' 153' ' ' TRP . 79.8 mttt -62.4 -45.76 91.68 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.216 177.226 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . 0.519 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 34.7 mmtp -66.71 -44.97 80.19 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.602 -178.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 22.5 mm-40 -75.43 -10.21 59.25 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.323 -176.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp 58.26 48.94 11.88 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.013 0.925 . . . . 0.0 110.588 -178.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . 0.425 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 95.7 mt -86.02 115.39 23.59 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.277 -177.033 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 151' ' ' ASN . . . . . 0.514 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 40.3 m-80 53.67 -81.47 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 126.107 1.763 . . . . 0.0 113.019 178.248 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 152' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 107' ' ' GLY . 67.3 mt -56.85 -60.35 2.08 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.328 0 C-N-CA 124.183 0.993 . . . . 0.0 110.426 -178.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 153' ' ' TRP . . . . . 0.545 ' CG ' ' HA ' ' B' ' 146' ' ' LYS . 62.4 m95 -71.62 -7.83 50.26 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 114.291 -1.322 . . . . 0.0 113.414 -166.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 27.1 t -74.93 -0.67 19.42 Favored 'General case' 0 CA--C 1.567 1.633 0 CA-C-O 121.134 0.492 . . . . 0.0 109.808 174.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -64.39 -17.64 63.94 Favored 'General case' 0 C--O 1.25 1.1 0 C-N-CA 124.757 1.223 . . . . 0.0 111.023 173.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 N--CA 1.445 -0.689 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.146 -178.117 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . 0.563 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 46.3 m-70 . . . . . 0 C--O 1.212 -0.911 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -113.8 117.68 32.15 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 120.685 0.279 . . . . 0.0 111.239 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -139.01 157.72 70.95 Favored Pre-proline 0 C--N 1.305 -1.344 0 CA-C-O 119.441 -0.314 . . . . 0.0 110.993 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -78.92 147.98 21.76 Favored 'Trans proline' 0 C--O 1.243 0.766 0 C-N-CA 121.998 1.799 . . . . 0.0 111.431 178.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -136.13 156.85 48.09 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 178.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.457 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 87.8 m -94.7 132.83 39.02 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.72 -178.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.497 ' HB2' HD12 ' A' ' 72' ' ' ILE . 60.7 tp -77.04 127.17 32.2 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 120.578 0.228 . . . . 0.0 111.026 -179.101 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 51.0 mm -98.79 -54.7 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 N-CA-C 107.375 -1.342 . . . . 0.0 107.375 172.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -170.67 157.15 5.56 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.065 179.46 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.423 ' HB2' HG21 ' A' ' 66' ' ' VAL . . . -111.04 120.61 42.94 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 174.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.45 ' HB ' ' O ' ' A' ' 22' ' ' THR . 67.0 mt -89.47 -64.12 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -175.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -129.14 -164.46 1.4 Allowed 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -177.272 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -88.64 48.33 3.53 Favored Glycine 0 CA--C 1.507 -0.452 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.556 ' HB3' HG23 ' A' ' 41' ' ' THR . 1.9 t70 178.5 -61.91 0.01 OUTLIER 'General case' 0 CA--C 1.496 -1.123 0 C-N-CA 125.565 1.546 . . . . 0.0 108.534 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.45 ' O ' ' HB ' ' A' ' 18' ' ' ILE . 24.1 m -76.58 106.71 8.39 Favored 'General case' 0 N--CA 1.404 -2.752 0 CA-C-N 114.094 -1.412 . . . . 0.0 109.995 -174.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 24.6 m -131.63 164.54 34.24 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 -179.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -121.7 114.27 20.89 Favored 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 118.514 0.597 . . . . 0.0 109.812 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.502 HD21 HG21 ' A' ' 72' ' ' ILE . 7.4 mp -126.32 159.18 33.86 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-O 121.217 0.532 . . . . 0.0 111.517 177.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.457 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 57.5 ttp -114.77 117.08 29.77 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.523 179.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.5 p90 -122.91 131.65 53.83 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 54.2 mttp 55.97 27.44 11.21 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.7 0.8 . . . . 0.0 112.514 -176.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 88.97 3.84 75.91 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 121.077 -0.582 . . . . 0.0 112.89 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.414 ' O ' ' HA ' ' A' ' 26' ' ' MET . 14.7 mm100 -106.29 104.96 52.52 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 116.842 0.321 . . . . 0.0 110.744 -179.058 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -78.98 107.37 2.23 Favored 'Trans proline' 0 C--O 1.247 0.962 0 C-N-CA 122.696 2.264 . . . . 0.0 110.264 175.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 65.5 mtt -127.32 154.13 45.32 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-O 121.137 0.494 . . . . 0.0 110.783 -177.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.9 m -81.2 136.62 35.87 Favored 'General case' 0 N--CA 1.42 -1.947 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 175.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.455 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 39.2 m-85 -105.05 149.05 26.13 Favored 'General case' 0 C--N 1.277 -2.568 0 CA-C-O 121.319 0.58 . . . . 0.0 112.257 -178.125 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.536 HH12 ' HA ' ' A' ' 40' ' ' ASP . 12.7 tpt85 -130.63 119.21 22.12 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 104.285 -2.487 . . . . 0.0 104.285 176.679 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.424 ' CD2' HG12 ' A' ' 92' ' ' ILE . 26.5 mt -83.98 137.76 33.46 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-O 122.142 0.972 . . . . 0.0 112.437 -169.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.487 HD21 ' HB3' ' A' ' 89' ' ' LEU . 98.5 mt -73.38 130.8 40.94 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 114.646 -1.161 . . . . 0.0 110.205 178.449 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.507 HD12 ' OH ' ' A' ' 91' ' ' TYR . 87.3 mt 73.78 7.41 4.95 Favored 'General case' 0 C--O 1.212 -0.869 0 C-N-CA 124.464 1.106 . . . . 0.0 113.438 176.106 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.7 t -125.01 125.66 69.9 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.716 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 175.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.536 ' HA ' HH12 ' A' ' 35' ' ' ARG . 11.0 t70 -105.58 140.68 38.29 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 179.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.556 HG23 ' HB3' ' A' ' 21' ' ' ASP . 1.0 OUTLIER . . . . . 0 N--CA 1.425 -1.693 0 O-C-N 124.254 0.971 . . . . 0.0 110.399 -171.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.853 0 CA-C-O 118.822 -0.988 . . . . 0.0 113.85 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -50.84 -50.56 13.42 Favored 'Trans proline' 0 C--N 1.37 1.676 0 C-N-CA 122.735 2.29 . . . . 0.0 112.684 176.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -63.07 -42.78 99.73 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.22 -45.59 90.93 Favored 'General case' 0 C--O 1.243 0.761 0 CA-C-O 121.066 0.46 . . . . 0.0 111.353 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.45 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 36.1 p -70.17 -41.91 73.17 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.365 -179.115 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.48 -42.1 92.59 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 122.199 0.2 . . . . 0.0 111.046 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -55.47 -43.9 75.97 Favored 'General case' 0 C--O 1.242 0.686 0 C-N-CA 122.715 0.406 . . . . 0.0 109.929 178.052 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.8 m -63.95 -46.3 85.31 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.033 177.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' A' ' 59' ' ' SER . 49.7 mttp -57.39 -54.93 41.28 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.227 -179.582 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.98 -29.69 70.83 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -177.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.574 ' SD ' HG22 ' A' ' 99' ' ' VAL . 49.6 ttm -72.64 -46.12 55.59 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 119.621 -0.831 . . . . 0.0 111.194 179.367 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.423 HG21 ' HB2' ' A' ' 17' ' ' ALA . 33.8 m -73.39 -30.11 29.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 C-N-CA 120.338 -0.545 . . . . 0.0 112.172 -177.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -76.02 -23.55 55.18 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 120.549 0.214 . . . . 0.0 111.364 177.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -77.53 -31.84 53.61 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.492 0.663 . . . . 0.0 109.829 177.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.746 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -65.89 157.74 29.79 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 114.913 -1.04 . . . . 0.0 112.32 -178.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.48 ' N ' ' HD3' ' A' ' 70' ' ' LYS . 2.3 mppt? -110.42 -39.93 4.79 Favored 'General case' 0 C--N 1.291 -1.95 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 175.397 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.6 mtmt -120.75 121.81 39.02 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 114.748 -1.115 . . . . 0.0 108.506 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.502 HG21 HD21 ' A' ' 25' ' ' LEU . 61.0 mt -113.16 135.48 52.52 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.147 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 178.268 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.561 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 33.8 mm-40 -112.45 141.4 46.23 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -179.007 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.3 m -114.75 127.31 72.32 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.076 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 174.083 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.563 ' HA ' ' O ' ' A' ' 8' ' ' HIS . 40.2 tt0 -121.83 117.23 26.01 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.477 -179.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -95.84 143.41 27.08 Favored 'General case' 0 C--O 1.254 1.324 0 C-N-CA 123.781 0.832 . . . . 0.0 109.437 -177.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -87.98 -174.26 4.62 Favored 'General case' 0 C--O 1.253 1.255 0 CA-C-O 120.96 0.41 . . . . 0.0 111.117 -173.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.457 ' HE2' ' HA ' ' A' ' 78' ' ' LYS . 9.3 mmpt? -72.95 -21.06 60.93 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 124.087 0.955 . . . . 0.0 112.618 -170.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -99.22 -80.7 1.55 Allowed Glycine 0 C--N 1.314 -0.664 0 C-N-CA 119.303 -1.427 . . . . 0.0 114.882 -170.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -122.69 128.39 50.51 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 122.401 -0.47 . . . . 0.0 110.012 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.424 ' HD2' ' N ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -103.4 -4.67 23.81 Favored 'General case' 0 N--CA 1.427 -1.578 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.219 -173.185 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 21.9 p . . . . . 0 C--N 1.307 -1.257 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -179.188 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 . . . . . 0 N--CA 1.439 -1.004 0 CA-C-O 120.507 0.194 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -100.44 137.7 13.41 Favored Glycine 0 N--CA 1.434 -1.438 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 174.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.487 ' HB3' HD21 ' A' ' 37' ' ' LEU . 95.3 mt -100.98 107.05 18.42 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 -178.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -154.38 168.06 27.91 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.437 0.637 . . . . 0.0 112.542 -175.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.507 ' OH ' HD12 ' A' ' 38' ' ' LEU . 2.5 m-85 -94.59 134.95 36.61 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.396 -1.274 . . . . 0.0 108.571 170.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.424 HG12 ' CD2' ' A' ' 36' ' ' LEU . 47.8 mm -99.89 126.09 53.42 Favored 'Isoleucine or valine' 0 C--O 1.254 1.328 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 175.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.561 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 31.1 m-85 -120.48 131.75 54.88 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 174.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.746 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -106.28 98.49 8.16 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 177.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.479 1.1 p30 31.95 57.32 0.34 Allowed 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 116.214 1.931 . . . . 0.0 116.214 -176.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 103.84 -21.95 36.83 Favored Glycine 0 N--CA 1.427 -1.925 0 CA-C-N 114.135 -1.393 . . . . 0.0 113.77 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -89.56 123.73 33.9 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -178.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . 0.499 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 4.5 mpp? -84.32 101.6 12.06 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.255 178.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.574 HG22 ' SD ' ' A' ' 65' ' ' MET . 37.9 t -62.87 -46.06 97.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -54.86 -47.81 73.72 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 113.812 -1.54 . . . . 0.0 110.893 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.42 ' HB3' ' HB2' ' A' ' 98' ' ' MET . 13.7 tp10 -62.09 -50.64 71.13 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.734 0.814 . . . . 0.0 109.994 179.27 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.63 -41.14 85.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.582 -0.735 . . . . 0.0 112.192 -176.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 99' ' ' VAL . 95.8 mt -58.4 -46.34 86.6 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-O 120.738 0.304 . . . . 0.0 111.814 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.8 t -73.29 -43.87 56.08 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-O 121.191 0.52 . . . . 0.0 109.99 178.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 21.8 tpt180 -60.95 -40.32 92.87 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.951 -176.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -84.0 -5.45 59.23 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.426 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 68.93 38.68 85.11 Favored Glycine 0 CA--C 1.503 -0.661 0 N-CA-C 111.575 -0.61 . . . . 0.0 111.575 -178.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.8 mt -94.27 -22.07 18.62 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -140.57 174.43 10.52 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 115.284 -0.871 . . . . 0.0 108.842 -177.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -111.54 166.08 11.45 Favored 'General case' 0 C--N 1.309 -1.166 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.492 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 73.6 t -83.89 127.07 40.12 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.237 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.076 177.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.496 -1.133 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -179.902 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 3.0 p80 . . . . . 0 C--O 1.247 0.93 0 CA-C-O 121.117 0.484 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . 0.427 ' HA ' ' CD1' ' A' ' 38' ' ' LEU . 36.3 tt0 -58.56 -44.48 89.72 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.37 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -61.47 -34.17 75.01 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.396 -176.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 82.9 mt -63.3 -50.97 68.0 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-O 121.126 0.488 . . . . 0.0 110.002 179.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 138' ' ' LEU . . . . . 0.41 ' HA ' HD23 ' B' ' 138' ' ' LEU . 24.7 mt -69.92 -34.42 73.45 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 178.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 139' ' ' ARG . . . . . 0.417 ' HG2' HG11 ' A' ' 111' ' ' VAL . 15.4 mtp85 -69.23 -31.49 70.09 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 179.03 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -77.26 -22.66 51.78 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.359 0.599 . . . . 0.0 111.138 174.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.1 m -76.4 -38.09 56.18 Favored 'General case' 0 N--CA 1.427 -1.605 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 173.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.571 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 36.4 tt0 -60.48 -42.98 97.37 Favored 'General case' 0 C--O 1.209 -1.069 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 173.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.96 -43.37 66.3 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 123.451 0.7 . . . . 0.0 111.452 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 144' ' ' GLN . . . . . 0.496 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 75.3 mt-30 -70.7 -48.36 55.07 Favored 'General case' 0 CA--C 1.497 -1.084 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.154 177.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -57.91 -38.85 76.61 Favored 'General case' 0 C--O 1.244 0.777 0 O-C-N 123.945 0.778 . . . . 0.0 112.038 -176.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 146' ' ' LYS . . . . . 0.571 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 89.4 mttt -57.62 -51.72 68.37 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 175.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -64.13 -45.15 89.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.109 -178.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 23.3 mm-40 -64.14 -14.08 52.51 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 124.093 0.957 . . . . 0.0 113.035 -178.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . 0.48 ' O ' ' HB2' ' B' ' 154' ' ' SER . 0.0 OUTLIER 62.39 40.95 10.57 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -178.932 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . 0.412 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 90.5 mt -76.41 109.7 10.35 Favored 'General case' 0 C--N 1.315 -0.918 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.238 -175.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 151' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 2.7 m-20 46.1 -88.3 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.415 1.886 . . . . 0.0 114.224 179.492 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 13.1 tt -68.19 -27.63 37.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 -176.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 153' ' ' TRP . . . . . 0.522 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 63.9 m95 -80.8 -7.25 59.36 Favored 'General case' 0 N--CA 1.435 -1.198 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.545 -178.143 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . 0.48 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 22.5 t -81.6 13.38 3.14 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 120.985 0.421 . . . . 0.0 110.052 177.058 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -81.96 -20.81 37.8 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 172.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 156' ' ' ASP . . . . . 0.475 ' HB3' ' HE2' ' B' ' 149' ' ' LYS . 14.2 t70 . . . . . 0 N--CA 1.443 -0.82 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.27 -176.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 . . . . . 0 N--CA 1.428 -1.531 0 CA-C-O 120.435 0.159 . . . . 0.0 111.058 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.432 ' HA ' ' O ' ' A' ' 74' ' ' VAL . 43.1 mtmt -65.29 143.98 57.43 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 124.481 1.113 . . . . 0.0 112.562 -172.186 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -126.86 158.09 69.53 Favored Pre-proline 0 C--N 1.297 -1.71 0 N-CA-C 105.31 -2.107 . . . . 0.0 105.31 167.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -74.34 147.34 36.91 Favored 'Trans proline' 0 C--N 1.322 -0.817 0 C-N-CA 122.163 1.909 . . . . 0.0 112.096 -178.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.01 155.47 47.96 Favored 'General case' 0 N--CA 1.428 -1.566 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.429 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 37.5 m -103.19 123.07 46.02 Favored 'General case' 0 N--CA 1.415 -2.195 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 49.1 tp -69.29 124.76 24.69 Favored 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.4 mm -88.15 -52.33 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 N-CA-C 107.159 -1.422 . . . . 0.0 107.159 174.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -174.87 161.92 3.1 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 176.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -103.55 147.52 27.08 Favored 'General case' 0 C--N 1.285 -2.196 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 174.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.0 mp -107.25 -58.08 3.99 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 N-CA-C 107.359 -1.349 . . . . 0.0 107.359 176.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -140.91 173.58 11.34 Favored 'General case' 0 CA--C 1.484 -1.562 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.517 178.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -82.91 60.63 4.87 Favored Glycine 0 CA--C 1.5 -0.878 0 N-CA-C 108.449 -1.86 . . . . 0.0 108.449 174.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.463 ' HB2' ' HB ' ' A' ' 41' ' ' THR . 7.2 t70 -174.86 -56.98 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 124.691 1.196 . . . . 0.0 108.682 -172.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 34.8 m -119.04 127.78 53.74 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.966 178.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 15.9 m -135.52 167.57 24.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 C-N-CA 124.356 1.062 . . . . 0.0 109.796 -176.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -121.09 117.88 28.32 Favored 'General case' 0 C--N 1.316 -0.856 0 O-C-N 121.852 -0.53 . . . . 0.0 110.044 -177.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.407 ' HB2' ' CD1' ' A' ' 34' ' ' PHE . 7.0 mp -127.92 159.5 34.75 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.473 0.654 . . . . 0.0 111.667 -178.453 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.47 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 57.7 ttp -119.92 111.19 17.63 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 175.047 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.6 p90 -109.91 114.93 28.88 Favored 'General case' 0 C--N 1.293 -1.85 0 C-N-CA 118.709 -1.197 . . . . 0.0 109.962 -177.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt 63.28 28.44 15.73 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.736 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.449 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 94.82 2.78 62.67 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 114.868 -1.06 . . . . 0.0 113.072 -178.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.47 ' O ' ' HA ' ' A' ' 26' ' ' MET . 1.9 mp0 -99.72 101.97 15.47 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 117.022 0.411 . . . . 0.0 111.488 178.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.449 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 4.4 Cg_exo -78.09 113.7 3.46 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.351 2.034 . . . . 0.0 110.828 177.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 26.4 mmt -136.25 156.06 49.21 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.954 -178.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.0 m -95.04 112.21 23.94 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 176.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.407 ' CD1' ' HB2' ' A' ' 25' ' ' LEU . 60.2 m-85 -95.85 145.07 25.65 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-O 121.526 0.679 . . . . 0.0 112.129 -174.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -123.07 117.75 26.14 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 105.464 -2.05 . . . . 0.0 105.464 176.607 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.401 ' HG ' ' CG1' ' A' ' 92' ' ' ILE . 6.7 mp -60.62 116.14 4.15 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 123.945 0.778 . . . . 0.0 112.219 -174.166 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.402 HD21 ' HB3' ' A' ' 89' ' ' LEU . 74.1 mt -70.19 140.35 52.51 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.571 175.723 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.5 mt 76.54 10.07 2.92 Favored 'General case' 0 C--O 1.217 -0.625 0 C-N-CA 125.534 1.534 . . . . 0.0 110.705 -175.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.48 HG13 ' HB1' ' A' ' 109' ' ' ALA . 53.8 t -126.02 138.21 55.29 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.135 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 176.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -148.13 106.58 3.77 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 179.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.463 ' HB ' ' HB2' ' A' ' 21' ' ' ASP . 3.3 m . . . . . 0 CA--C 1.598 2.821 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 175.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 2.266 0 CA-C-O 119.173 -0.793 . . . . 0.0 114.429 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -64.83 -25.85 60.16 Favored 'Trans proline' 0 C--N 1.373 1.82 0 CA-C-N 120.488 2.144 . . . . 0.0 112.379 178.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -80.06 -28.15 39.26 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.581 -177.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.19 -48.06 81.71 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 174.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.408 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 14.6 m -62.84 -34.54 77.56 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.21 177.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.46 -46.9 81.11 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.893 0.378 . . . . 0.0 110.056 177.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -60.82 -41.63 96.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.913 177.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.514 ' O ' HG22 ' A' ' 66' ' ' VAL . 54.2 m -58.38 -48.63 79.99 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.127 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 59' ' ' SER . 56.2 mtpt -56.37 -51.84 66.82 Favored 'General case' 0 CA--C 1.509 -0.61 0 O-C-N 123.601 0.563 . . . . 0.0 110.734 178.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -58.74 -39.76 81.84 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.213 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 13.2 tpt -69.9 -47.73 61.37 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.663 -179.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 62' ' ' THR . 35.8 m -77.85 -34.68 19.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 -175.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -76.47 -19.49 57.97 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-O 121.027 0.442 . . . . 0.0 110.693 -179.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -89.93 -10.02 46.69 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.287 176.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -78.8 133.68 37.04 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 120.904 0.383 . . . . 0.0 111.767 -175.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -73.31 -34.13 65.55 Favored 'General case' 0 CA--C 1.502 -0.874 0 CA-C-O 121.439 0.637 . . . . 0.0 111.219 176.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -131.66 123.1 27.11 Favored 'General case' 0 C--N 1.292 -1.899 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 4.4 mp -101.71 121.54 52.79 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.314 0 N-CA-C 104.983 -2.228 . . . . 0.0 104.983 173.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.557 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 24.4 mt-10 -119.08 145.51 45.85 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-O 120.793 0.33 . . . . 0.0 110.904 -173.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.432 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 11.0 m -120.96 133.39 67.77 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.759 179.119 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -135.64 134.42 39.23 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.555 ' HB3' ' HG2' ' A' ' 81' ' ' ARG . 89.9 m-85 -95.28 148.03 22.85 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.469 -175.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -85.81 163.71 17.99 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 -179.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -73.1 -6.05 43.12 Favored 'General case' 0 C--O 1.246 0.887 0 C-N-CA 123.167 0.587 . . . . 0.0 111.955 -178.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -96.44 -99.28 1.89 Allowed Glycine 0 N--CA 1.433 -1.542 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 175.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 19.5 mp0 -93.52 134.93 35.27 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 121.041 0.448 . . . . 0.0 111.125 -176.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.555 ' HG2' ' HB3' ' A' ' 76' ' ' PHE . 55.8 mtt180 -111.67 -27.61 8.46 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.922 175.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 16.2 p . . . . . 0 CA--C 1.511 -0.528 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.568 -176.83 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 . . . . . 0 N--CA 1.442 -0.842 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -90.28 121.52 6.23 Favored Glycine 0 N--CA 1.422 -2.254 0 N-CA-C 108.172 -1.971 . . . . 0.0 108.172 173.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.402 ' HB3' HD21 ' A' ' 37' ' ' LEU . 90.4 mt -101.33 107.4 18.74 Favored 'General case' 0 C--N 1.289 -2.023 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 -177.594 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -153.92 167.33 30.09 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.463 -176.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -87.31 142.33 27.97 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 173.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.401 ' CG1' ' HG ' ' A' ' 36' ' ' LEU . 50.0 mm -108.31 123.32 63.83 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 178.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.557 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 17.4 m-85 -115.44 150.5 36.35 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 177.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -120.59 99.93 6.83 Favored 'General case' 0 C--N 1.291 -1.956 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 176.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.315 4.4 p-10 44.08 57.91 3.96 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 125.07 1.348 . . . . 0.0 113.638 -177.303 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.16 -23.34 27.45 Favored Glycine 0 N--CA 1.432 -1.601 0 CA-C-N 114.884 -1.053 . . . . 0.0 114.176 178.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -93.16 123.84 36.72 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -177.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . 0.478 ' HG3' ' CB ' ' A' ' 101' ' ' GLU . 25.7 ptp -79.0 116.38 19.27 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-O 121.971 0.891 . . . . 0.0 111.125 -179.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 56.3 t -65.17 -31.37 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.599 -175.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 25.2 p-10 -65.11 -31.15 72.2 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.871 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.478 ' CB ' ' HG3' ' A' ' 98' ' ' MET . 5.1 tp10 -63.8 -51.47 64.62 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 173.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.46 -45.57 84.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.9 -177.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.2 mt -61.66 -41.15 97.13 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.747 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 96.7 t -70.66 -43.18 77.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.749 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 -67.29 -26.63 66.63 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 86.7 mm-40 -93.65 -4.23 51.04 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 120.829 0.347 . . . . 0.0 111.196 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.463 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 66.35 44.13 91.21 Favored Glycine 0 C--O 1.215 -1.082 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.741 -179.051 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 90.9 mt -113.16 7.85 18.05 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-O 121.511 0.672 . . . . 0.0 109.779 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.48 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -159.38 171.04 20.51 Favored 'General case' 0 N--CA 1.427 -1.588 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -179.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.563 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 95.3 mttt -120.97 161.47 21.55 Favored 'General case' 0 N--CA 1.424 -1.734 0 N-CA-C 104.921 -2.251 . . . . 0.0 104.921 177.045 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.6 p -76.56 150.73 6.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.701 0 C-N-CA 118.739 -1.184 . . . . 0.0 109.159 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.296 -1.737 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 175.43 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 6.9 p80 . . . . . 0 N--CA 1.448 -0.563 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -53.56 -50.47 65.47 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.873 175.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -48.77 -37.99 20.58 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.621 1.168 . . . . 0.0 112.977 -176.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 95.2 mt -70.41 -50.08 42.24 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.974 0.416 . . . . 0.0 110.599 -179.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 19.8 mt -69.58 -41.24 76.06 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-O 121.563 0.697 . . . . 0.0 111.361 -178.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 139' ' ' ARG . . . . . 0.475 ' O ' ' HB3' ' B' ' 142' ' ' GLU . 64.4 ttt180 -67.32 -31.91 72.51 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.431 -175.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -78.74 -24.43 44.82 Favored 'General case' 0 N--CA 1.432 -1.326 0 C-N-CA 119.654 -0.819 . . . . 0.0 111.116 176.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 51.0 m -69.03 -36.97 78.34 Favored 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 171.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 142' ' ' GLU . . . . . 0.646 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 28.1 tt0 -56.62 -49.25 75.53 Favored 'General case' 0 C--O 1.204 -1.324 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.358 174.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.81 -45.47 59.4 Favored 'General case' 0 C--O 1.255 1.379 0 CA-C-O 121.44 0.638 . . . . 0.0 111.512 -178.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 144' ' ' GLN . . . . . 0.499 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 29.0 tt0 -67.1 -47.78 70.16 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.586 178.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -60.06 -34.0 72.81 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 123.532 0.733 . . . . 0.0 112.17 -178.255 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 146' ' ' LYS . . . . . 0.646 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 60.2 mttm -55.15 -51.37 66.67 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 175.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -71.77 -27.42 62.95 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.252 -178.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 148' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 9.5 mm-40 -73.25 -16.19 61.4 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.931 176.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt 51.92 55.63 9.0 Favored 'General case' 0 CA--C 1.505 -0.754 0 C-N-CA 125.052 1.341 . . . . 0.0 110.838 -178.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 95.0 mt -86.37 114.06 22.85 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.211 -178.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 151' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 44.3 m-80 48.23 -87.53 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.314 1.846 . . . . 0.0 114.257 177.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 10.7 tt -72.01 -24.89 23.1 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-O 120.932 0.396 . . . . 0.0 110.286 -175.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 153' ' ' TRP . . . . . 0.626 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 52.6 m95 -80.64 -10.43 59.73 Favored 'General case' 0 CA--C 1.506 -0.731 0 CA-C-O 121.771 0.796 . . . . 0.0 110.288 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 22.6 t -87.33 12.82 11.05 Favored 'General case' 0 N--CA 1.419 -1.993 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.001 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -66.62 -31.24 71.81 Favored 'General case' 0 C--N 1.356 0.871 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 172.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 20.9 t70 . . . . . 0 C--O 1.254 1.318 0 C-N-CA 125.007 1.323 . . . . 0.0 113.261 173.266 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.901 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 25.8 m 71.48 -58.67 0.57 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.297 1.039 . . . . 0.0 111.116 -178.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.3 t -88.81 157.99 18.29 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 15.2 m -79.78 -37.17 35.89 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 178.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -82.81 120.45 25.65 Favored 'General case' 0 N--CA 1.433 -1.291 0 CA-C-N 114.963 -1.017 . . . . 0.0 108.315 175.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.3 ttpp -87.91 125.98 34.8 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 176.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.548 HD13 ' HA ' ' A' ' 77' ' ' ASP . 96.0 mt -66.1 165.53 13.37 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 124.043 0.84 . . . . 0.0 112.972 -175.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -86.75 113.15 22.35 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-N 115.274 -0.876 . . . . 0.0 112.072 -172.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.453 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 37.0 ttmt -115.73 134.37 55.09 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 114.093 -1.412 . . . . 0.0 108.554 177.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -138.19 146.34 51.31 Favored Pre-proline 0 C--N 1.3 -1.558 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 176.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -69.22 150.59 71.67 Favored 'Trans proline' 0 C--O 1.246 0.891 0 C-N-CA 122.228 1.952 . . . . 0.0 112.388 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -141.45 165.04 28.61 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.142 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.547 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 8.4 m -100.23 133.81 44.08 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 52.4 tp -81.84 124.76 29.97 Favored 'General case' 0 C--N 1.308 -1.223 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 178.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.453 HD11 ' HB2' ' A' ' 26' ' ' MET . 59.4 mt -95.78 -54.87 6.63 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 176.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -162.68 153.83 17.49 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.197 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.459 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -111.32 107.47 16.75 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 176.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.4 mt -81.04 -63.53 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.237 0 CA-C-O 121.59 0.71 . . . . 0.0 109.357 -173.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -112.77 -171.37 1.85 Allowed 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 115.186 -0.916 . . . . 0.0 109.856 -176.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -92.29 40.18 2.92 Favored Glycine 0 C--O 1.202 -1.884 0 N-CA-C 109.779 -1.328 . . . . 0.0 109.779 177.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.612 ' OD1' ' HG2' ' A' ' 35' ' ' ARG . 2.5 t0 -174.9 -57.46 0.01 OUTLIER 'General case' 0 CA--C 1.505 -0.761 0 N-CA-C 106.534 -1.654 . . . . 0.0 106.534 -174.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.3 111.37 18.92 Favored 'General case' 0 N--CA 1.425 -1.704 0 CA-C-N 113.826 -1.534 . . . . 0.0 109.103 -176.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.425 HG12 ' HA ' ' A' ' 17' ' ' ALA . 22.2 m -134.6 163.16 37.48 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.892 0 C-N-CA 123.499 0.72 . . . . 0.0 109.058 -176.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -116.26 116.26 27.44 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.619 -0.676 . . . . 0.0 110.107 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.8 mp -121.92 159.44 26.88 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 121.409 0.623 . . . . 0.0 111.001 178.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.547 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 26.9 ttt -120.08 105.93 11.48 Favored 'General case' 0 C--N 1.288 -2.075 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 -178.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.425 ' CD1' ' HZ ' ' A' ' 34' ' ' PHE . 11.3 p90 -106.74 120.61 42.46 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -177.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 60.9 mttp 55.79 28.71 12.72 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 121.438 0.637 . . . . 0.0 111.916 -178.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.402 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 93.43 6.08 62.96 Favored Glycine 0 N--CA 1.434 -1.464 0 C-N-CA 120.513 -0.851 . . . . 0.0 113.197 178.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.465 ' O ' ' HA ' ' A' ' 26' ' ' MET . 84.0 mm-40 -105.62 104.01 46.29 Favored Pre-proline 0 C--N 1.311 -1.081 0 CA-C-N 117.122 0.461 . . . . 0.0 110.938 178.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.402 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 6.2 Cg_exo -76.77 117.09 4.4 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 122.682 2.254 . . . . 0.0 110.703 176.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 25.8 mmt -137.42 147.58 45.5 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 90.3 m -85.59 116.73 24.05 Favored 'General case' 0 N--CA 1.425 -1.685 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 173.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.425 ' HZ ' ' CD1' ' A' ' 27' ' ' TYR . 90.5 m-85 -102.53 157.59 16.82 Favored 'General case' 0 C--N 1.291 -1.962 0 C-N-CA 123.686 0.794 . . . . 0.0 109.847 -177.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.612 ' HG2' ' OD1' ' A' ' 21' ' ' ASP . 11.9 ttt-85 -132.66 156.44 46.96 Favored 'General case' 0 C--N 1.286 -2.157 0 N-CA-C 104.127 -2.546 . . . . 0.0 104.127 172.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.467 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 84.1 mt -89.88 116.88 28.28 Favored 'General case' 0 C--N 1.299 -1.63 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -170.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.485 HD21 ' HB3' ' A' ' 89' ' ' LEU . 37.3 mt -55.71 135.82 51.21 Favored 'General case' 0 C--O 1.245 0.816 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.009 178.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.499 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 95.6 mt 72.24 13.14 5.73 Favored 'General case' 0 C--O 1.209 -1.031 0 O-C-N 124.872 1.357 . . . . 0.0 112.132 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 57.3 t -125.88 143.38 39.59 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.433 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -140.08 107.8 5.64 Favored 'General case' 0 C--O 1.249 1.052 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 175.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.441 HG23 ' O ' ' A' ' 108' ' ' LEU . 2.6 m -122.52 -60.36 0.03 OUTLIER Pre-proline 0 CA--C 1.571 1.785 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 -173.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.423 ' HD2' ' NH2' ' A' ' 35' ' ' ARG . 7.2 Cg_exo -68.57 -65.94 0.04 OUTLIER 'Trans proline' 0 C--N 1.378 2.097 0 C-N-CA 122.418 2.078 . . . . 0.0 113.826 -164.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -99.1 124.0 43.79 Favored 'General case' 0 N--CA 1.405 -2.678 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 176.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.2 m -78.53 157.7 28.75 Favored 'General case' 0 C--N 1.282 -2.355 0 CA-C-N 115.262 -0.881 . . . . 0.0 108.88 -176.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -55.62 -39.39 70.75 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 121.681 0.753 . . . . 0.0 109.098 176.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.411 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 48.1 t-80 -170.63 104.2 0.42 Allowed Pre-proline 0 C--O 1.204 -1.33 0 N-CA-C 104.896 -2.261 . . . . 0.0 104.896 171.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -57.71 98.39 0.09 OUTLIER 'Trans proline' 0 C--O 1.239 0.57 0 C-N-CA 122.223 1.949 . . . . 0.0 112.274 -176.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 46' ' ' HIS . 26.6 mtpp -83.11 -40.92 19.17 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.016 -175.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.421 ' HG2' ' OE2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -83.04 -12.5 57.12 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 120.21 -0.596 . . . . 0.0 109.564 176.404 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 87.55 -71.31 2.66 Favored Glycine 0 N--CA 1.443 -0.854 0 N-CA-C 108.8 -1.72 . . . . 0.0 108.8 -173.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.7 t -83.89 43.68 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.062 0 CA-C-O 123.311 1.529 . . . . 0.0 107.589 177.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.421 ' OE2' ' HG2' ' A' ' 49' ' ' LYS . 32.7 tt0 -91.46 -13.86 31.51 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 114.059 -1.428 . . . . 0.0 109.477 -175.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt -89.32 -37.71 14.7 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 59.68 31.16 20.72 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-O 121.285 0.564 . . . . 0.0 112.075 -177.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -44.53 -54.76 6.36 Favored Glycine 0 CA--C 1.539 1.552 0 CA-C-N 114.185 -1.371 . . . . 0.0 116.328 -176.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo -49.06 -52.0 9.55 Favored 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 123.059 2.506 . . . . 0.0 113.774 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -70.45 -48.57 55.25 Favored 'General case' 0 C--O 1.206 -1.197 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.5 -48.1 72.28 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -177.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.517 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 46.0 p -69.08 -33.77 74.07 Favored 'General case' 0 C--O 1.245 0.847 0 CA-C-O 121.146 0.498 . . . . 0.0 111.876 -178.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.605 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -71.04 -38.62 72.56 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 175.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -61.51 -43.13 99.41 Favored 'General case' 0 CA--C 1.513 -0.467 0 C-N-CA 124.917 1.287 . . . . 0.0 111.509 -176.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.527 ' O ' HG22 ' A' ' 66' ' ' VAL . 5.0 p -64.28 -41.47 96.88 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.951 177.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.517 ' HG3' ' O ' ' A' ' 59' ' ' SER . 57.7 mttp -57.11 -39.12 74.47 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 123.541 0.526 . . . . 0.0 111.096 177.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.605 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 82.1 mttt -59.51 -54.27 48.52 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -179.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -67.35 -39.56 85.77 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -177.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.527 HG22 ' O ' ' A' ' 62' ' ' THR . 34.5 m -82.32 -39.02 15.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 113.634 0.975 . . . . 0.0 113.634 -176.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -75.55 -22.85 56.68 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -177.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -83.94 -9.44 58.69 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.766 0.793 . . . . 0.0 109.766 178.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.45 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -86.17 140.35 30.25 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.476 0.655 . . . . 0.0 112.436 -177.113 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -87.04 -38.52 16.48 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.042 -0.981 . . . . 0.0 108.977 175.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -119.11 119.78 35.21 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.522 -176.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 74.6 mt -118.23 121.37 67.04 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.475 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 22.8 mt-10 -115.9 137.95 51.63 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.199 -173.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.8 m -110.7 118.67 57.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 174.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.453 ' HA ' ' HA ' ' A' ' 9' ' ' LYS . 39.6 tt0 -111.71 133.76 53.73 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.484 ' CE1' ' HG3' ' A' ' 81' ' ' ARG . 60.8 m-85 -108.65 147.3 32.09 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -175.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.548 ' HA ' HD13 ' A' ' 7' ' ' LEU . 1.3 t70 -97.33 -174.54 2.96 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 120.939 0.4 . . . . 0.0 110.816 -176.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.0 mtpm? -76.82 -8.41 57.26 Favored 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 123.787 0.835 . . . . 0.0 110.79 -178.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -69.13 -93.65 0.05 OUTLIER Glycine 0 C--N 1.335 0.508 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -145.97 158.74 43.86 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 176.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.484 ' HG3' ' CE1' ' A' ' 76' ' ' PHE . 37.0 ttm180 -88.52 -35.37 17.0 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 173.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 8.4 p -131.71 145.32 51.57 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.285 -0.87 . . . . 0.0 112.119 -175.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -109.07 157.63 18.53 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.258 177.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -56.7 -24.95 52.72 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -176.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -77.04 -1.38 28.66 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 121.458 -0.776 . . . . 0.0 111.099 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 83.34 24.2 51.95 Favored Glycine 0 CA--C 1.486 -1.737 0 N-CA-C 110.891 -0.884 . . . . 0.0 110.891 177.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -116.89 141.15 48.6 Favored 'General case' 0 N--CA 1.412 -2.339 0 CA-C-N 114.531 -0.835 . . . . 0.0 109.383 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -87.9 157.47 28.49 Favored Glycine 0 N--CA 1.427 -1.966 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.412 -175.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.485 ' HB3' HD21 ' A' ' 37' ' ' LEU . 72.7 mt -122.39 108.55 13.34 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 -178.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.436 ' O ' ' HA ' ' A' ' 36' ' ' LEU . . . -150.66 167.61 26.82 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 119.992 -0.683 . . . . 0.0 112.543 -175.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.415 ' HE2' ' HB2' ' A' ' 77' ' ' ASP . 78.8 m-85 -106.22 127.93 53.58 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 171.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 65.5 mt -103.14 126.7 57.42 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.978 0 C-N-CA 119.503 -0.879 . . . . 0.0 111.608 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.475 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 35.4 m-85 -112.45 133.94 54.26 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.278 178.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.45 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -105.34 105.83 16.04 Favored 'General case' 0 C--N 1.283 -2.306 0 N-CA-C 105.905 -1.887 . . . . 0.0 105.905 174.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.2 p30 46.96 26.53 0.61 Allowed 'General case' 0 N--CA 1.502 2.127 0 C-N-CA 125.201 1.4 . . . . 0.0 113.866 -172.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.46 -6.94 36.46 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.694 -0.765 . . . . 0.0 113.396 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -89.07 115.38 26.57 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 175.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 51.8 ttp -76.11 112.55 12.68 Favored 'General case' 0 C--N 1.294 -1.846 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 -178.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 57.5 t -62.41 -32.77 56.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.245 0.545 . . . . 0.0 110.138 -177.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.467 ' ND2' ' HB3' ' A' ' 36' ' ' LEU . 1.3 m-20 -57.79 -37.95 74.63 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.073 178.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -66.3 -46.01 78.4 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.758 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.36 -39.77 88.38 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.662 -178.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 97.2 mt -62.19 -53.46 54.94 Favored 'General case' 0 C--O 1.244 0.795 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 19.3 m -69.54 -37.88 75.6 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 116.222 -0.444 . . . . 0.0 112.156 -177.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 53.2 ttp180 -68.26 -24.64 64.91 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 123.405 0.682 . . . . 0.0 111.16 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 50.7 tp60 -92.01 -5.74 52.43 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.547 0.689 . . . . 0.0 109.375 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.497 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 73.23 27.19 68.69 Favored Glycine 0 N--CA 1.441 -0.976 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.766 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.441 ' O ' HG23 ' A' ' 41' ' ' THR . 83.3 mt -97.63 -7.04 31.93 Favored 'General case' 0 CA--C 1.495 -1.138 0 O-C-N 122.864 -0.198 . . . . 0.0 111.186 -179.104 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -150.61 164.67 35.47 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 -177.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -112.66 156.92 21.91 Favored 'General case' 0 CA--C 1.488 -1.421 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 174.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 75.2 t -73.77 136.13 26.04 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.755 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 174.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -86.36 121.73 29.34 Favored 'General case' 0 N--CA 1.424 -1.766 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -177.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 18.6 t80 -73.7 102.33 3.93 Favored 'General case' 0 N--CA 1.417 -2.125 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.513 -171.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.558 HG11 ' HB3' ' B' ' 131' ' ' ASN . 48.1 t -87.39 127.01 41.07 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.702 0 N-CA-C 104.214 -2.513 . . . . 0.0 104.214 171.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.694 ' HH ' ' N ' ' B' ' 122' ' ' GLY . 67.2 t80 -92.35 124.86 36.72 Favored 'General case' 0 C--N 1.274 -2.709 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -162.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.402 ' HG3' ' HA ' ' B' ' 130' ' ' PRO . 3.6 mppt? -116.97 109.58 42.7 Favored Pre-proline 0 N--CA 1.428 -1.527 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 169.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -59.74 -58.75 0.52 Allowed 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.524 2.149 . . . . 0.0 111.024 -177.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . 0.529 ' HB3' ' OXT' ' A' ' 121' ' ' HIS . 25.5 t-20 -165.22 -61.15 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 105.691 -1.966 . . . . 0.0 105.691 176.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -137.6 -90.42 0.24 Allowed 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.015 173.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 26.9 m -88.96 -25.78 21.87 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 176.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . 0.529 ' OXT' ' HB3' ' A' ' 118' ' ' ASN . 20.8 t-80 . . . . . 0 N--CA 1.409 -2.499 0 N-CA-C 101.925 -3.361 . . . . 0.0 101.925 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 122' ' ' GLY . . . . . 0.694 ' N ' ' HH ' ' A' ' 115' ' ' TYR . . . . . . . . 0 CA--C 1.503 -0.66 0 N-CA-C 111.34 -0.704 . . . . 0.0 111.34 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 23.8 m 66.85 -13.62 0.19 Allowed 'General case' 0 CA--C 1.554 1.104 0 N-CA-C 114.71 1.374 . . . . 0.0 114.71 175.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . 0.402 ' O ' HG12 ' B' ' 124' ' ' VAL . 47.7 t 65.31 27.1 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.216 0 CA-C-O 123.445 1.593 . . . . 0.0 108.67 -176.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -127.7 157.37 40.49 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-N 114.386 -1.279 . . . . 0.0 107.574 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . 0.437 ' HA ' ' CD2' ' A' ' 115' ' ' TYR . 79.3 t80 -151.04 130.66 13.06 Favored 'General case' 0 C--N 1.314 -0.968 0 C-N-CA 120.277 -0.569 . . . . 0.0 111.411 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 86.1 t -145.68 151.7 14.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 N-CA-C 103.978 -2.601 . . . . 0.0 103.978 175.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -102.32 -34.58 9.15 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 118.347 0.522 . . . . 0.0 111.241 -179.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.482 ' HA ' ' HD3' ' B' ' 130' ' ' PRO . 88.6 mttt -73.48 132.5 81.33 Favored Pre-proline 0 C--N 1.319 -0.757 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -175.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' B' ' 129' ' ' LYS . 1.1 Cg_endo -76.71 79.72 2.98 Favored 'Trans proline' 0 N--CA 1.436 -1.891 0 C-N-CA 122.301 2.001 . . . . 0.0 111.95 177.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 131' ' ' ASN . . . . . 0.558 ' HB3' HG11 ' A' ' 114' ' ' VAL . 0.2 OUTLIER -90.37 100.16 13.05 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 176.631 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -119.02 -20.4 8.1 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -178.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -59.6 118.15 5.76 Favored 'General case' 0 N--CA 1.382 -3.869 0 CA-C-N 114.636 -1.166 . . . . 0.0 108.569 176.234 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . 0.428 ' CE1' HD12 ' A' ' 7' ' ' LEU . 65.8 m80 85.93 -14.2 0.55 Allowed 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 113.655 -1.612 . . . . 0.0 112.377 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.4 ' HA ' HD13 ' A' ' 38' ' ' LEU . 33.9 tt0 -60.98 -41.75 97.05 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 118.889 0.768 . . . . 0.0 110.628 -176.021 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -65.9 -33.6 76.21 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-N 115.138 -0.937 . . . . 0.0 111.319 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 95.0 mt -68.52 -49.73 57.41 Favored 'General case' 0 C--O 1.246 0.871 0 CA-C-O 121.657 0.741 . . . . 0.0 109.136 178.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -63.55 -44.56 93.81 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.288 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 139' ' ' ARG . . . . . 0.433 ' HA ' ' HB3' ' B' ' 142' ' ' GLU 0.436 48.6 mtt180 -75.13 -18.39 60.24 Favored 'General case' 0 N--CA 1.436 -1.159 0 N-CA-C 117.62 2.452 . . . . 0.0 117.62 -175.767 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -72.68 -42.78 63.91 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 169.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 15.0 m -66.4 -37.12 84.51 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 114.651 -1.159 . . . . 0.0 110.275 179.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.606 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 39.0 tt0 -63.39 -51.17 66.92 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.694 175.143 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.61 -39.21 70.47 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.65 0.78 . . . . 0.0 111.65 -176.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -60.17 -47.54 85.53 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.432 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -74.45 -34.29 63.13 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.423 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 146' ' ' LYS . . . . . 0.606 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 39.6 mtpt -59.82 -47.71 84.63 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-O 121.131 0.491 . . . . 0.0 110.208 179.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -67.98 -26.95 66.18 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.541 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -82.85 -8.54 59.57 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . 0.54 ' O ' ' HB2' ' B' ' 154' ' ' SER . 29.8 mmmt 58.35 42.72 21.07 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 36.3 mt -79.13 112.28 16.18 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.19 -176.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 151' ' ' ASN . . . . . 0.497 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 85.6 m-20 54.16 -92.85 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.084 1.354 . . . . 0.0 112.671 174.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 52.1 mt -67.69 -32.73 58.06 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.948 0 CA-C-O 121.206 0.527 . . . . 0.0 110.387 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 52.8 m95 -75.69 -5.43 45.56 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-O 121.765 0.793 . . . . 0.0 111.473 -177.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . 0.54 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 23.2 t -93.72 12.66 24.81 Favored 'General case' 0 N--CA 1.423 -1.787 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.604 173.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -70.79 -24.3 62.55 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.615 0.722 . . . . 0.0 109.08 175.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 30.2 t70 . . . . . 0 N--CA 1.429 -1.488 0 CA-C-N 114.356 -1.293 . . . . 0.0 109.295 -178.351 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.303 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 56.2 m 70.96 109.02 0.06 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.084 0.953 . . . . 0.0 113.127 177.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 46.9 t -94.44 104.18 16.15 Favored 'General case' 0 N--CA 1.433 -1.282 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 175.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 33.3 p -81.65 91.53 6.44 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.945 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.411 ' NZ ' ' HB3' ' A' ' 5' ' ' LYS . 6.3 mtpm? -71.05 121.51 18.36 Favored 'General case' 0 N--CA 1.434 -1.272 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -67.34 -37.39 83.19 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 178.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 74.9 mt -82.32 103.94 12.26 Favored 'General case' 0 C--O 1.257 1.447 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 173.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 14.9 p-80 -74.87 141.67 44.18 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.549 -175.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.485 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 21.4 pttp -111.46 145.9 38.17 Favored 'General case' 0 C--N 1.291 -1.951 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 173.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -138.85 147.6 54.81 Favored Pre-proline 0 C--N 1.259 -3.34 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -74.96 149.76 37.39 Favored 'Trans proline' 0 C--O 1.244 0.804 0 C-N-CA 122.212 1.941 . . . . 0.0 113.193 -177.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -138.12 155.05 49.13 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 115.542 -0.753 . . . . 0.0 109.448 178.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.474 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 21.6 m -100.59 137.02 39.55 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.442 ' HB2' HD12 ' A' ' 72' ' ' ILE . 62.2 tp -83.36 132.97 34.97 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.979 -0.451 . . . . 0.0 111.594 -176.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 51.0 mm -95.92 -59.47 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.481 0 N-CA-C 106.848 -1.538 . . . . 0.0 106.848 172.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.24 142.3 0.8 Allowed 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 -178.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.428 ' HA ' HG23 ' A' ' 23' ' ' VAL . . . -92.04 122.53 34.63 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 106.604 -1.628 . . . . 0.0 106.604 171.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.4 mt -90.15 -64.8 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -175.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -134.83 -178.82 5.25 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.643 -178.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.7 56.01 4.9 Favored Glycine 0 C--O 1.238 0.379 0 C-N-CA 121.732 -0.27 . . . . 0.0 112.95 -176.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.572 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 3.2 p-10 177.71 -34.06 0.01 OUTLIER 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 124.546 1.139 . . . . 0.0 108.259 179.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -110.12 109.89 20.58 Favored 'General case' 0 N--CA 1.419 -2.002 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.953 -177.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.428 HG23 ' HA ' ' A' ' 17' ' ' ALA . 7.3 p -129.33 139.2 52.39 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.881 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 178.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -106.0 119.48 39.31 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -175.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 31' ' ' PRO . 4.7 mp -127.24 156.28 42.13 Favored 'General case' 0 CA--C 1.496 -1.119 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.958 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.474 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 49.3 ttm -110.83 99.94 8.77 Favored 'General case' 0 C--N 1.29 -2.019 0 N-CA-C 106.896 -1.52 . . . . 0.0 106.896 175.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -98.29 113.26 25.14 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.329 -0.949 . . . . 0.0 108.717 -177.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 96.8 mttt 56.71 31.62 19.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.878 0.847 . . . . 0.0 111.563 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 95.52 4.2 60.86 Favored Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 114.815 -1.084 . . . . 0.0 113.938 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 33.5 mm-40 -105.97 103.46 44.64 Favored Pre-proline 0 C--N 1.309 -1.173 0 CA-C-N 117.403 0.601 . . . . 0.0 111.163 175.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.48 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 1.9 Cg_endo -82.69 107.69 1.6 Allowed 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 122.798 2.332 . . . . 0.0 111.124 177.328 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 92.0 mtp -131.52 156.49 45.62 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-O 121.081 0.467 . . . . 0.0 111.463 -177.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.8 m -78.31 108.95 12.02 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 175.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -95.1 142.7 27.25 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-O 121.291 0.567 . . . . 0.0 111.572 -178.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.572 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 8.2 tpt180 -110.88 112.25 23.96 Favored 'General case' 0 N--CA 1.417 -2.105 0 N-CA-C 105.443 -2.058 . . . . 0.0 105.443 172.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.569 HD12 ' H ' ' A' ' 36' ' ' LEU . 3.9 mp -62.93 122.08 15.11 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -177.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 78.9 mt -69.09 146.58 52.46 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.306 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.487 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 70.3 mt 75.47 4.27 4.02 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 124.935 1.294 . . . . 0.0 112.265 177.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 94.1 t -120.3 125.79 74.57 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.223 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.599 -178.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.472 ' HA ' ' NH2' ' A' ' 35' ' ' ARG . 31.9 t70 -121.89 134.9 54.87 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 173.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.561 ' OG1' ' HB3' ' A' ' 21' ' ' ASP . 1.7 m -73.21 152.48 90.35 Favored Pre-proline 0 C--N 1.307 -1.242 0 C-N-CA 123.741 0.816 . . . . 0.0 109.547 -177.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -44.94 123.72 5.23 Favored 'Trans proline' 0 C--N 1.379 2.164 0 C-N-CA 122.744 2.296 . . . . 0.0 110.093 172.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.408 ' H ' ' CD ' ' A' ' 43' ' ' GLU . 0.6 OUTLIER -57.54 136.41 56.73 Favored 'General case' 0 C--O 1.248 1.008 0 O-C-N 124.183 0.927 . . . . 0.0 113.279 -171.446 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 8.7 t -103.9 108.42 19.74 Favored 'General case' 0 N--CA 1.403 -2.825 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -65.52 -23.71 66.95 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 121.908 0.861 . . . . 0.0 110.472 -176.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 35.6 t-80 -157.72 144.04 12.9 Favored Pre-proline 0 C--N 1.293 -1.865 0 N-CA-C 102.345 -3.206 . . . . 0.0 102.345 173.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_exo -40.72 136.91 1.83 Allowed 'Trans proline' 0 C--O 1.247 0.967 0 C-N-CA 123.416 2.744 . . . . 0.0 113.942 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.514 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 8.0 mmpt? 78.87 2.13 2.48 Favored 'General case' 0 C--N 1.351 0.653 0 C-N-CA 125.119 1.367 . . . . 0.0 112.901 178.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -99.24 -20.0 16.81 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 121.847 -0.533 . . . . 0.0 111.647 -179.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -77.34 -31.96 49.49 Favored Glycine 0 CA--C 1.499 -0.955 0 C-N-CA 120.05 -1.072 . . . . 0.0 110.658 178.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.552 ' HA ' ' HA3' ' A' ' 55' ' ' GLY . 14.6 p -71.14 -21.0 21.79 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.909 0 CA-C-N 114.777 -0.712 . . . . 0.0 109.472 177.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -69.89 -28.08 65.33 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.033 178.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -79.03 -68.81 0.62 Allowed 'General case' 0 N--CA 1.436 -1.175 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.773 -177.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -149.48 23.8 0.9 Allowed 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.045 0.45 . . . . 0.0 110.01 -174.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.552 ' HA3' ' HA ' ' A' ' 51' ' ' VAL . . . -58.93 -58.65 13.42 Favored Glycine 0 CA--C 1.524 0.598 0 CA-C-O 118.836 -0.98 . . . . 0.0 114.395 -176.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.477 ' HA ' ' OG ' ' A' ' 59' ' ' SER . 32.4 Cg_exo -64.12 -21.48 67.85 Favored 'Trans proline' 0 C--N 1.364 1.381 0 C-N-CA 122.842 2.362 . . . . 0.0 112.357 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -68.8 -47.38 66.25 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 177.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.88 -46.47 68.34 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.078 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.501 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 12.9 p -65.88 -45.16 83.07 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -177.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.38 -39.46 90.73 Favored 'General case' 0 CA--C 1.51 -0.58 0 C-N-CA 121.255 -0.178 . . . . 0.0 110.864 179.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -63.92 -45.19 90.38 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.496 ' O ' HG22 ' A' ' 66' ' ' VAL . 44.8 m -56.84 -49.86 74.17 Favored 'General case' 0 N--CA 1.445 -0.708 0 O-C-N 124.181 0.926 . . . . 0.0 109.425 177.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.501 ' HG3' ' O ' ' A' ' 59' ' ' SER . 59.7 mtpt -56.83 -54.59 44.66 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.821 179.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -57.48 -42.01 81.8 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 123.69 0.618 . . . . 0.0 111.89 -177.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.8 ttt -72.35 -44.87 61.99 Favored 'General case' 0 N--CA 1.441 -0.911 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.854 -177.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.496 HG22 ' O ' ' A' ' 62' ' ' THR . 33.2 m -74.88 -30.91 24.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -177.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -70.8 -31.56 68.36 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.338 0.589 . . . . 0.0 109.774 176.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -84.23 -13.44 52.64 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.384 -178.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.57 132.43 46.91 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.025 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -79.51 -38.27 34.75 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-O 122.004 0.906 . . . . 0.0 109.226 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.458 ' H ' ' HB3' ' A' ' 95' ' ' ASP . 44.5 mtmt -133.18 150.44 52.0 Favored 'General case' 0 C--N 1.296 -1.749 0 N-CA-C 106.02 -1.845 . . . . 0.0 106.02 178.01 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.442 HD12 ' HB2' ' A' ' 14' ' ' LEU . 53.3 mt -119.1 130.69 73.53 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.744 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 171.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.585 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 14.2 mm-40 -111.49 133.11 54.01 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 106.222 -1.77 . . . . 0.0 106.222 -178.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 m -112.64 122.81 67.54 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.916 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 174.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.485 ' HA ' ' HA ' ' A' ' 9' ' ' LYS . 33.7 tt0 -106.51 135.16 48.51 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 120.902 0.382 . . . . 0.0 110.526 -177.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -79.13 116.6 19.51 Favored 'General case' 0 N--CA 1.415 -2.215 0 CA-C-N 114.919 -1.037 . . . . 0.0 108.882 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.451 ' CG ' ' H ' ' A' ' 78' ' ' LYS . 25.9 t70 -96.8 -175.2 3.21 Favored 'General case' 0 C--N 1.305 -1.346 0 O-C-N 123.926 0.766 . . . . 0.0 109.924 -177.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.451 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 43.1 tptt -73.05 -9.4 58.69 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 124.443 1.097 . . . . 0.0 112.353 -173.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -81.05 -113.54 0.33 Allowed Glycine 0 C--N 1.314 -0.675 0 C-N-CA 120.337 -0.935 . . . . 0.0 110.927 174.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -130.21 175.01 9.27 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 176.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 40.4 ttt180 -96.15 -32.75 12.34 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 43.0 p -137.11 142.36 42.3 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.834 177.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.434 ' HB2' HD11 ' A' ' 89' ' ' LEU . 16.4 t70 -100.76 140.58 34.85 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.212 0.53 . . . . 0.0 110.58 176.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.7 pttp -44.36 -26.07 0.3 Allowed 'General case' 0 C--N 1.301 -1.508 0 C-N-CA 127.909 2.483 . . . . 0.0 115.773 176.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 69.4 t80 -79.71 -15.4 57.6 Favored 'General case' 0 C--O 1.237 0.445 0 O-C-N 121.34 -0.85 . . . . 0.0 110.274 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 105.13 45.81 1.32 Allowed Glycine 0 N--CA 1.439 -1.15 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 -178.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 27.8 mmt85 -129.04 144.26 51.13 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -89.19 141.58 16.34 Favored Glycine 0 C--N 1.291 -1.919 0 N-CA-C 109.105 -1.598 . . . . 0.0 109.105 175.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.434 HD11 ' HB2' ' A' ' 83' ' ' ASP . 90.6 mt -124.4 105.84 9.75 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -178.34 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.54 164.18 38.51 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-O 120.631 0.253 . . . . 0.0 110.434 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.413 ' CZ ' ' HB2' ' A' ' 100' ' ' ASN . 13.1 t80 -89.21 130.77 35.57 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 173.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 45.2 mm -99.99 123.94 53.13 Favored 'Isoleucine or valine' 0 C--O 1.251 1.14 0 CA-C-O 120.954 0.407 . . . . 0.0 111.623 -175.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.585 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 50.1 m-85 -113.94 145.65 41.21 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 173.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.19 100.4 9.99 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 175.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.458 ' HB3' ' H ' ' A' ' 71' ' ' LYS 0.338 4.2 p-10 43.83 42.5 4.51 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 125.46 1.504 . . . . 0.0 114.256 -176.864 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.25 -17.84 39.99 Favored Glycine 0 N--CA 1.444 -0.812 0 CA-C-N 114.687 -1.142 . . . . 0.0 113.52 177.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.2 mtmt -97.97 132.29 43.66 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 120.937 0.398 . . . . 0.0 110.908 -177.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . 0.446 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 1.9 mpt? -70.39 109.99 5.06 Favored 'General case' 0 C--N 1.305 -1.334 0 C-N-CA 123.999 0.92 . . . . 0.0 112.95 -173.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 58.7 t -73.41 -43.78 55.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 121.441 0.639 . . . . 0.0 109.941 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.506 HD21 ' HB3' ' A' ' 36' ' ' LEU . 14.3 m120 -60.65 -45.16 95.15 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.247 -176.467 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -61.91 -38.0 86.76 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.05 178.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.557 ' O ' ' HG2' ' A' ' 106' ' ' GLN . . . -65.33 -46.69 79.25 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.265 179.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 97.2 mt -53.57 -48.66 68.95 Favored 'General case' 0 C--O 1.244 0.777 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -179.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 12.7 m -70.81 -36.97 66.76 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.514 ' HB2' ' HB3' ' B' ' 141' ' ' SER . 29.2 ttp180 -72.26 -21.81 61.32 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 179.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.557 ' HG2' ' O ' ' A' ' 102' ' ' ALA . 82.0 mm-40 -87.54 -2.67 58.78 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.32 0.581 . . . . 0.0 109.508 176.326 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.436 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 69.75 28.7 71.76 Favored Glycine 0 N--CA 1.444 -0.833 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.993 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.4 mt -94.98 -13.98 24.79 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-O 121.189 0.518 . . . . 0.0 110.577 -177.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -151.22 167.41 27.9 Favored 'General case' 0 N--CA 1.428 -1.569 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.231 -176.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -112.57 153.11 28.04 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 175.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.508 HG11 ' HG2' ' B' ' 139' ' ' ARG . 11.7 p -76.9 125.55 36.8 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-O 121.516 0.674 . . . . 0.0 110.475 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.455 ' CB ' ' HB2' ' A' ' 40' ' ' ASP . . . -134.74 120.81 19.9 Favored 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.867 176.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.475 ' HB2' ' HB2' ' B' ' 131' ' ' ASN . 1.6 p90 -118.34 98.61 6.37 Favored 'General case' 0 C--N 1.292 -1.892 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.123 176.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 21.7 t -126.71 105.05 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.923 0 CA-C-O 121.902 0.858 . . . . 0.0 111.946 -176.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.426 ' O ' ' HD3' ' A' ' 117' ' ' PRO . 65.0 t80 -165.27 65.37 0.12 Allowed 'General case' 0 C--N 1.286 -2.157 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 166.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.449 ' HD2' ' HD2' ' A' ' 117' ' ' PRO . 46.1 tptt -89.19 113.26 55.59 Favored Pre-proline 0 N--CA 1.393 -3.294 0 CA-C-N 113.123 -1.853 . . . . 0.0 110.015 -175.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.449 ' HD2' ' HD2' ' A' ' 116' ' ' LYS . 91.1 Cg_endo -88.53 20.36 1.15 Allowed 'Trans proline' 0 C--N 1.314 -1.239 0 C-N-CA 123.96 3.107 . . . . 0.0 110.664 178.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 49.8 t30 65.33 -85.49 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 126.19 1.796 . . . . 0.0 112.039 177.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -98.45 -2.55 38.72 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-O 121.226 0.536 . . . . 0.0 109.91 -177.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.406 ' HA ' ' HG2' ' A' ' 117' ' ' PRO . 21.5 m 76.16 -65.65 0.3 Allowed 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.347 1.059 . . . . 0.0 109.538 -178.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 49.5 t60 . . . . . 0 N--CA 1.425 -1.7 0 N-CA-C 106.884 -1.525 . . . . 0.0 106.884 175.109 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.58 0 N-CA-C 110.509 -1.036 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 15.1 m -108.05 -44.46 4.17 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.893 0.347 . . . . 0.0 110.189 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 61.7 t -72.13 -44.89 64.41 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 178.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -115.49 93.71 4.4 Favored 'General case' 0 N--CA 1.427 -1.598 0 CA-C-N 114.72 -1.127 . . . . 0.0 108.082 173.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -88.53 110.42 20.87 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 179.239 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 45.4 t -110.3 126.96 67.57 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.576 0 CA-C-O 121.266 0.555 . . . . 0.0 112.285 -172.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 128' ' ' TYR . . . . . 0.494 ' C ' ' HD3' ' B' ' 130' ' ' PRO . 56.2 m-85 -117.29 101.21 8.24 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.985 171.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -124.63 68.12 51.35 Favored Pre-proline 0 C--N 1.311 -1.093 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 172.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . 0.494 ' HD3' ' C ' ' B' ' 128' ' ' TYR . 6.0 Cg_endo -94.32 -74.9 0.0 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.117 0 C-N-CA 122.949 2.432 . . . . 0.0 110.964 178.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 131' ' ' ASN . . . . . 0.475 ' HB2' ' HB2' ' A' ' 113' ' ' TYR . 15.8 m120 -88.73 47.63 1.53 Allowed 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 176.289 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.461 ' HA ' ' HB2' ' B' ' 135' ' ' GLU . 28.2 p-10 -83.0 4.2 26.98 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.36 -175.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.64 -33.52 66.41 Favored 'General case' 0 C--N 1.311 -1.089 0 C-N-CA 125.011 1.324 . . . . 0.0 113.281 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -127.32 21.74 6.63 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.994 0.426 . . . . 0.0 110.49 178.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.461 ' HB2' ' HA ' ' B' ' 132' ' ' ASN . 37.2 tt0 -54.82 -55.35 31.22 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.926 -1.033 . . . . 0.0 112.892 -175.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 56.9 mm-40 -56.74 -45.92 81.69 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.043 -171.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.0 mt -62.9 -51.1 68.25 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 123.78 0.675 . . . . 0.0 111.019 -176.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 7.6 mp -70.04 -32.95 71.33 Favored 'General case' 0 N--CA 1.436 -1.138 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 139' ' ' ARG . . . . . 0.508 ' HG2' HG11 ' A' ' 111' ' ' VAL . 34.1 mtp180 -68.25 -34.26 75.89 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.378 176.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 19.4 mmmt -70.46 -32.04 69.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.875 0.369 . . . . 0.0 110.941 173.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 141' ' ' SER . . . . . 0.514 ' HB3' ' HB2' ' A' ' 105' ' ' ARG . 43.3 m -65.82 -41.96 91.2 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.807 177.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.552 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 48.0 mt-10 -63.65 -46.96 83.27 Favored 'General case' 0 C--O 1.198 -1.612 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.455 172.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . 0.548 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -51.04 -44.41 61.08 Favored 'General case' 0 CA--C 1.509 -0.617 0 O-C-N 123.899 0.749 . . . . 0.0 111.608 -176.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -61.31 -47.41 86.09 Favored 'General case' 0 N--CA 1.441 -0.876 0 O-C-N 123.864 0.728 . . . . 0.0 109.503 178.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.1 -40.79 91.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.588 -0.733 . . . . 0.0 112.055 -178.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 146' ' ' LYS . . . . . 0.552 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 56.0 mttm -54.55 -45.09 73.4 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.102 0.477 . . . . 0.0 110.52 177.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 31.1 mmtp -79.9 -24.01 41.43 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.772 -174.161 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -87.23 -9.86 54.01 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.584 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . 0.552 ' O ' ' HB2' ' B' ' 154' ' ' SER . 27.4 mmmt 61.97 55.91 2.45 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.387 1.075 . . . . 0.0 108.428 -178.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 88.7 mt -95.06 123.25 38.44 Favored 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.038 -177.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 151' ' ' ASN . . . . . 0.436 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 54.2 m-80 46.26 -97.11 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.766 1.626 . . . . 0.0 113.574 -179.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 152' ' ' ILE . . . . . 0.563 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 64.4 mt -60.98 -36.01 69.22 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.632 0 CA-C-O 121.767 0.794 . . . . 0.0 110.401 -178.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -80.61 1.0 31.63 Favored 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.6 -175.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . 0.552 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 25.0 t -99.72 -6.73 26.59 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.49 177.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . 0.563 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 12.5 pt-20 -79.94 -19.67 47.46 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 119.939 -0.704 . . . . 0.0 109.24 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 18.4 t70 . . . . . 0 CA--C 1.487 -1.473 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -178.027 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.37 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.4 p -80.56 98.54 7.66 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 121.475 0.655 . . . . 0.0 112.121 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.4 m -75.06 -46.93 31.48 Favored 'General case' 0 N--CA 1.428 -1.562 0 N-CA-C 106.46 -1.681 . . . . 0.0 106.46 174.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.6 m -89.57 78.09 7.1 Favored 'General case' 0 N--CA 1.413 -2.288 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.154 178.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -80.42 -29.37 37.67 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 178.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -136.7 -73.37 0.44 Allowed 'General case' 0 N--CA 1.413 -2.289 0 CA-C-N 113.552 -1.658 . . . . 0.0 108.656 -175.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 87.2 mt -153.85 -173.5 4.6 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 124.643 1.177 . . . . 0.0 108.178 -177.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 28.9 t-80 -95.09 105.81 17.76 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -96.33 125.02 40.54 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 115.32 -0.854 . . . . 0.0 108.926 179.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.473 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 7.5 pt-20 -135.38 143.4 45.2 Favored Pre-proline 0 C--N 1.303 -1.454 0 CA-C-N 116.78 -0.191 . . . . 0.0 110.489 -179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 6.0 Cg_exo -79.97 147.36 18.91 Favored 'Trans proline' 0 C--O 1.249 1.046 0 C-N-CA 122.472 2.115 . . . . 0.0 113.903 -176.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -129.86 171.26 12.91 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.208 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.423 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 28.1 m -117.13 145.6 43.7 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 107.081 -1.452 . . . . 0.0 107.081 178.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.1 tp -88.28 127.93 35.47 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 118.721 0.691 . . . . 0.0 110.381 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.483 HD11 ' HB2' ' A' ' 26' ' ' MET . 46.6 mm -93.13 -51.47 11.2 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 176.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -169.48 134.12 1.41 Allowed 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.347 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -84.79 131.51 34.53 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 172.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.436 ' HB ' ' O ' ' A' ' 22' ' ' THR . 59.7 mt -105.89 -64.45 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 C-N-CA 120.544 -0.463 . . . . 0.0 111.016 -175.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.457 ' HB2' ' OG1' ' A' ' 22' ' ' THR . 36.9 m-20 -122.71 -152.71 0.52 Allowed 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -101.69 44.43 1.54 Allowed Glycine 0 CA--C 1.498 -0.971 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 -178.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.455 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 33.0 t0 -179.73 -56.12 0.01 OUTLIER 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 -178.177 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.457 ' OG1' ' HB2' ' A' ' 19' ' ' ASP . 1.0 OUTLIER -76.4 106.34 7.98 Favored 'General case' 0 N--CA 1.411 -2.377 0 CA-C-N 114.627 -1.169 . . . . 0.0 110.059 -178.296 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.5 m -130.68 151.04 35.27 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.451 -178.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 45.7 tttp -108.49 114.48 28.35 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 -176.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.7 mp -121.5 159.69 25.77 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 121.382 0.611 . . . . 0.0 111.416 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.513 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 64.0 ttp -119.46 116.24 25.71 Favored 'General case' 0 C--N 1.294 -1.83 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 177.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.2 p90 -119.66 119.53 33.98 Favored 'General case' 0 C--N 1.286 -2.154 0 C-N-CA 119.368 -0.933 . . . . 0.0 109.272 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 98.0 mttt 60.85 27.52 17.33 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.266 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.434 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 94.31 3.67 63.11 Favored Glycine 0 N--CA 1.444 -0.823 0 CA-C-N 115.232 -0.895 . . . . 0.0 113.034 -179.589 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.513 ' O ' ' HA ' ' A' ' 26' ' ' MET . 1.7 mp0 -100.47 102.39 18.59 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.95 0.375 . . . . 0.0 110.446 177.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.434 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 1.5 Cg_endo -83.34 101.96 1.01 Allowed 'Trans proline' 0 N--CA 1.443 -1.45 0 C-N-CA 122.31 2.007 . . . . 0.0 109.856 176.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 66.7 mtt -124.98 147.47 48.91 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.492 -176.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.54 ' O ' ' HD3' ' A' ' 87' ' ' ARG . 23.7 m -85.91 121.37 28.45 Favored 'General case' 0 N--CA 1.422 -1.839 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 177.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -99.57 161.58 13.53 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-O 122.256 1.026 . . . . 0.0 113.532 -174.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.455 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 9.0 tpt180 -134.51 131.02 37.52 Favored 'General case' 0 N--CA 1.412 -2.327 0 N-CA-C 105.037 -2.208 . . . . 0.0 105.037 173.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 7.1 mp -69.94 129.3 39.13 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 119.658 -0.817 . . . . 0.0 111.859 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.453 HD21 ' HB3' ' A' ' 89' ' ' LEU . 50.2 mt -57.42 126.07 25.67 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-N 115.047 -0.979 . . . . 0.0 112.629 177.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.436 HD22 HG22 ' A' ' 114' ' ' VAL . 40.2 mt 72.03 23.4 3.47 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-N 113.485 -1.688 . . . . 0.0 112.562 173.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 51.1 t -111.41 135.57 50.2 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.033 0 CA-C-O 121.113 0.482 . . . . 0.0 110.596 177.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.539 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 35.8 t70 -122.36 106.79 11.39 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 174.364 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.455 HG21 ' HB2' ' A' ' 21' ' ' ASP . 1.8 p -97.35 160.66 28.34 Favored Pre-proline 0 N--CA 1.421 -1.925 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.774 177.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -68.96 67.22 1.29 Allowed 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 122.639 2.226 . . . . 0.0 114.063 -178.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -77.95 170.76 16.05 Favored 'General case' 0 N--CA 1.436 -1.143 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 173.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 28.2 m 74.58 -42.57 0.5 Allowed 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 -173.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -68.26 -35.62 78.18 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 170.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 73.9 m80 73.41 97.99 0.04 OUTLIER Pre-proline 0 C--O 1.251 1.152 0 CA-C-N 114.042 -1.436 . . . . 0.0 111.123 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.93 133.33 57.3 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 123.293 2.662 . . . . 0.0 111.27 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.4 mtpt 72.29 -42.34 0.53 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.826 1.25 . . . . 0.0 113.854 -178.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.9 mmtt -61.45 -37.71 84.56 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 123.256 0.622 . . . . 0.0 109.674 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -153.23 28.02 0.79 Allowed Glycine 0 N--CA 1.44 -1.081 0 C-N-CA 119.991 -1.1 . . . . 0.0 112.254 178.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 47.6 t -137.6 98.33 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -91.91 -29.45 16.67 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.497 ' HE2' ' HA ' ' A' ' 53' ' ' LYS . 11.2 mmpt? -69.01 -42.26 76.65 Favored 'General case' 0 C--N 1.313 -1.019 0 C-N-CA 120.429 -0.508 . . . . 0.0 112.325 -174.258 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -124.16 -9.34 7.62 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 120.122 -0.631 . . . . 0.0 111.22 -176.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -69.04 -59.19 6.06 Favored Glycine 0 CA--C 1.524 0.616 0 CA-C-O 118.803 -0.998 . . . . 0.0 114.758 -173.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.47 -25.2 70.46 Favored 'Trans proline' 0 C--N 1.366 1.47 0 C-N-CA 122.409 2.073 . . . . 0.0 112.899 -178.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -70.3 -50.46 39.07 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 178.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.3 -43.06 98.91 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.296 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.7 p -64.91 -49.41 70.54 Favored 'General case' 0 N--CA 1.438 -1.053 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.444 -178.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.33 -39.12 93.27 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 120.52 0.2 . . . . 0.0 110.853 -178.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -59.74 -52.73 64.21 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 123.435 0.694 . . . . 0.0 109.562 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 25.6 m -61.72 -47.15 86.56 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.313 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -58.36 -48.05 81.85 Favored 'General case' 0 CA--C 1.503 -0.839 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.191 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -60.7 -39.86 90.11 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 121.125 -0.23 . . . . 0.0 111.426 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 84.9 mtp -66.8 -47.71 71.22 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 120.141 -0.624 . . . . 0.0 111.633 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.9 m -75.09 -29.9 22.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -176.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -85.62 -29.52 24.01 Favored 'General case' 0 C--N 1.315 -0.933 0 O-C-N 121.83 -0.543 . . . . 0.0 112.182 -179.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -84.99 -11.71 54.87 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.296 0.57 . . . . 0.0 109.92 178.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.31 123.26 11.41 Favored 'General case' 0 C--O 1.244 0.791 0 C-N-CA 123.7 0.8 . . . . 0.0 112.069 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -74.54 -40.82 61.48 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 177.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -126.57 122.59 35.52 Favored 'General case' 0 N--CA 1.416 -2.169 0 CA-C-N 113.513 -1.676 . . . . 0.0 107.915 -179.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 63.5 mt -97.44 112.5 29.62 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.251 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 177.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.546 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 30.2 mt-10 -113.07 133.8 54.83 Favored 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 120.525 -0.47 . . . . 0.0 109.925 -175.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.0 m -110.93 127.01 68.33 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.693 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 171.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -115.33 128.85 56.37 Favored 'General case' 0 C--N 1.279 -2.495 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -175.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.455 ' CE1' ' HB2' ' A' ' 81' ' ' ARG . 32.2 t80 -97.41 131.86 43.67 Favored 'General case' 0 N--CA 1.414 -2.228 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.458 -175.149 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -85.66 -174.95 5.42 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.426 ' HB2' ' O ' ' B' ' 130' ' ' PRO . 72.6 mmtt -75.79 -14.95 60.32 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -175.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.464 ' HA3' ' OD1' ' B' ' 131' ' ' ASN . . . -97.93 -116.52 3.57 Favored Glycine 0 C--N 1.313 -0.742 0 C-N-CA 120.19 -1.005 . . . . 0.0 115.586 -172.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -96.07 141.22 29.72 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -175.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.455 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . 19.3 ttm180 -96.82 -22.4 16.95 Favored 'General case' 0 C--N 1.316 -0.882 0 O-C-N 124.145 0.903 . . . . 0.0 108.859 176.668 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.4 p -142.22 143.43 32.9 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.985 -177.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -93.96 148.22 22.36 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 172.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -58.8 -16.77 18.58 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 -177.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -68.93 -20.09 64.21 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.311 0.577 . . . . 0.0 109.732 175.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 103.03 24.76 7.84 Favored Glycine 0 C--O 1.219 -0.828 0 N-CA-C 110.594 -1.002 . . . . 0.0 110.594 -178.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.54 ' HD3' ' O ' ' A' ' 33' ' ' THR . 10.8 tpp85 -110.52 126.93 54.91 Favored 'General case' 0 C--N 1.299 -1.587 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -176.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -76.62 141.17 26.18 Favored Glycine 0 N--CA 1.441 -0.967 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.453 ' HB3' HD21 ' A' ' 37' ' ' LEU . 88.2 mt -122.95 102.04 7.78 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -178.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -153.13 167.75 28.24 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 -178.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -88.28 141.99 28.11 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 174.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 46.5 mm -111.62 123.42 67.42 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.546 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 13.4 m-85 -118.91 139.0 52.37 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 176.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.63 98.85 8.49 Favored 'General case' 0 C--N 1.293 -1.87 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 174.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.276 4.3 p-10 42.91 43.34 3.48 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.749 1.22 . . . . 0.0 113.714 -175.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.3 -19.48 37.08 Favored Glycine 0 N--CA 1.443 -0.878 0 C-N-CA 120.858 -0.686 . . . . 0.0 113.412 178.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.3 mttp -82.85 113.15 20.28 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 179.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . 0.483 ' CE ' ' HB2' ' A' ' 101' ' ' GLU . 44.7 ttp -77.48 106.85 9.52 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 45.4 t -59.73 -44.32 93.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.424 -173.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -65.62 -30.05 70.72 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.483 ' HB2' ' CE ' ' A' ' 98' ' ' MET . 7.9 tp10 -62.24 -53.82 49.76 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 173.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.76 -44.5 96.65 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.047 -0.979 . . . . 0.0 112.061 -177.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 90.3 mt -56.64 -51.7 67.7 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.1 t -73.17 -38.02 53.81 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.204 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.586 -177.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 101' ' ' GLU . 3.9 tpt180 -69.46 -25.95 64.34 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.164 0.586 . . . . 0.0 111.415 -176.287 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.2 tp60 -95.67 -1.84 49.29 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.265 0.555 . . . . 0.0 109.565 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.451 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 73.23 39.71 51.63 Favored Glycine 0 N--CA 1.442 -0.953 0 CA-C-N 115.316 -0.856 . . . . 0.0 113.597 177.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 78.8 mt -104.24 -10.09 18.14 Favored 'General case' 0 C--N 1.296 -1.756 0 O-C-N 122.431 -0.452 . . . . 0.0 110.337 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -153.17 168.21 26.72 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.824 -177.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.561 ' HG3' ' CZ3' ' B' ' 153' ' ' TRP . 0.9 OUTLIER -99.87 168.07 10.12 Favored 'General case' 0 CA--C 1.492 -1.268 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 176.024 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 12.7 p -93.08 138.12 20.89 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.475 0 N-CA-C 106.576 -1.638 . . . . 0.0 106.576 173.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.9 122.48 32.32 Favored 'General case' 0 C--N 1.282 -2.353 0 N-CA-C 104.458 -2.423 . . . . 0.0 104.458 174.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -70.24 145.02 51.65 Favored 'General case' 0 N--CA 1.419 -2.017 0 CA-C-O 121.686 0.755 . . . . 0.0 111.474 -170.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.436 HG22 HD22 ' A' ' 38' ' ' LEU . 23.5 t -86.96 137.16 21.42 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.902 0 CA-C-N 114.277 -1.329 . . . . 0.0 109.052 -172.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -73.52 -47.81 38.08 Favored 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 114.649 -1.16 . . . . 0.0 111.794 -172.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.417 ' HE2' ' HB3' ' A' ' 121' ' ' HIS . 3.4 mppt? 69.97 146.09 0.11 Allowed Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 123.713 0.805 . . . . 0.0 110.526 -172.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_endo -46.02 -36.94 16.8 Favored 'Trans proline' 0 N--CA 1.493 1.457 0 C-N-CA 124.376 3.384 . . . . 0.0 115.937 -170.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 20.9 p-10 -133.7 32.58 3.56 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-O 120.775 0.321 . . . . 0.0 111.442 -177.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 16.2 m120 68.51 21.49 8.1 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 175.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 25.0 m -75.84 98.41 4.17 Favored 'General case' 0 C--N 1.304 -1.372 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.261 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . 0.417 ' HB3' ' HE2' ' A' ' 116' ' ' LYS . 6.5 p80 . . . . . 0 C--N 1.309 -1.195 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.196 175.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.338 0 N-CA-C 110.363 -1.095 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 7.3 p -77.41 79.47 3.92 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-O 121.575 0.702 . . . . 0.0 112.766 -177.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 46.3 t -119.07 87.58 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.323 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 176.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -120.11 126.63 51.21 Favored 'General case' 0 N--CA 1.427 -1.625 0 CA-C-N 115.127 -0.942 . . . . 0.0 108.995 -177.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 6.1 p90 -162.58 -179.38 6.86 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 178.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 127' ' ' VAL . . . . . 0.491 ' C ' ' H ' ' B' ' 129' ' ' LYS . 59.2 t -67.02 122.18 17.55 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 177.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -82.02 36.01 0.44 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 122.557 1.17 . . . . 0.0 110.776 -173.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.491 ' H ' ' C ' ' B' ' 127' ' ' VAL . 64.4 mttm 71.4 130.38 0.04 OUTLIER Pre-proline 0 C--N 1.291 -1.972 0 C-N-CA 128.128 2.571 . . . . 0.0 115.307 179.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . 0.426 ' O ' ' HB2' ' A' ' 78' ' ' LYS . 2.8 Cg_exo -76.84 -151.91 0.04 OUTLIER 'Trans proline' 0 CA--C 1.558 1.681 0 C-N-CA 123.506 2.804 . . . . 0.0 109.583 167.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 131' ' ' ASN . . . . . 0.464 ' OD1' ' HA3' ' A' ' 79' ' ' GLY . 1.4 m120 -85.44 98.46 10.6 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -175.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -142.73 10.24 1.8 Allowed 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -172.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 75.0 m -69.17 -46.2 68.1 Favored 'General case' 0 N--CA 1.427 -1.58 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -174.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -99.01 23.9 8.43 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.487 -0.758 . . . . 0.0 111.277 179.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -51.07 -65.72 0.51 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.789 1.236 . . . . 0.0 109.523 -178.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . 0.56 ' O ' ' HG3' ' B' ' 140' ' ' LYS . 14.6 mm100 -60.86 -47.55 85.88 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.038 179.488 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 84.4 mt -58.65 -49.4 77.65 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 113.191 0.811 . . . . 0.0 113.191 -175.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 138' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' B' ' 138' ' ' LEU . 28.6 mt -70.03 -26.61 64.13 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 178.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -71.48 -25.39 62.26 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 119.831 -0.747 . . . . 0.0 110.532 173.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . 0.56 ' HG3' ' O ' ' B' ' 136' ' ' GLN . 29.5 mtpp -72.89 -38.07 67.09 Favored 'General case' 0 C--O 1.243 0.745 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 175.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 15.7 m -60.88 -45.53 94.19 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.322 -0.854 . . . . 0.0 108.805 175.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.454 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 5.0 tt0 -57.9 -58.54 7.92 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.828 176.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -51.58 -50.73 59.57 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.614 0.766 . . . . 0.0 112.537 -176.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 144' ' ' GLN . . . . . 0.438 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 50.5 tt0 -61.37 -47.11 87.35 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.945 -178.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -71.69 -33.04 68.47 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.713 -176.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 146' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 77.3 mttt -64.0 -43.33 96.0 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 175.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -60.11 -38.46 83.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.146 178.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . 0.459 ' HB2' ' HG ' ' B' ' 150' ' ' LEU . 13.3 mm-40 -81.58 -17.93 46.61 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.592 -179.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 31.2 mtpt 54.48 60.99 3.21 Favored 'General case' 0 C--O 1.244 0.78 0 C-N-CA 124.987 1.315 . . . . 0.0 109.342 -174.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . 0.459 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 53.4 mt -82.78 116.86 22.31 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 113.591 -1.64 . . . . 0.0 110.841 -176.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 151' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 93.6 m-20 47.44 -89.97 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 125.371 1.469 . . . . 0.0 114.616 174.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 152' ' ' ILE . . . . . 0.452 HG12 ' HE3' ' A' ' 110' ' ' LYS . 6.8 tt -70.46 -27.24 30.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -175.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 153' ' ' TRP . . . . . 0.561 ' CZ3' ' HG3' ' A' ' 110' ' ' LYS . 56.2 m95 -74.18 -18.41 60.77 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-O 121.646 0.736 . . . . 0.0 110.612 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 8.4 t -87.19 61.66 6.84 Favored 'General case' 0 N--CA 1.426 -1.646 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 176.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -97.3 -4.64 38.33 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 114.795 -1.093 . . . . 0.0 111.688 -179.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 . . . . . 0 C--N 1.295 -1.774 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 179.935 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.243 0 N-CA-C 111.431 0.16 . . . . 0.0 111.431 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 18.3 m -75.71 -4.38 40.03 Favored 'General case' 0 CA--C 1.558 1.278 0 CA-C-O 121.623 0.725 . . . . 0.0 111.644 -178.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.3 m -77.77 -13.81 59.78 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 172.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 22.7 p 49.01 87.18 0.02 OUTLIER 'General case' 0 C--N 1.352 0.684 0 C-N-CA 125.422 1.489 . . . . 0.0 113.359 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -89.57 59.07 4.59 Favored 'General case' 0 N--CA 1.422 -1.862 0 CA-C-O 123.565 1.65 . . . . 0.0 110.915 -178.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -159.95 119.16 2.81 Favored 'General case' 0 N--CA 1.424 -1.767 0 N-CA-C 100.776 -3.787 . . . . 0.0 100.776 178.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . 0.289 5.5 mp -107.63 -105.08 0.34 Allowed 'General case' 0 C--N 1.287 -2.121 0 C-N-CA 117.879 -1.528 . . . . 0.0 114.988 -173.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.569 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 17.2 m-70 -112.53 103.75 11.83 Favored 'General case' 0 CA--C 1.493 -1.24 0 C-N-CA 120.278 -0.569 . . . . 0.0 111.936 -173.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.439 ' HG3' ' OE1' ' A' ' 75' ' ' GLU . 18.2 mtmm -93.9 117.92 30.76 Favored 'General case' 0 CA--C 1.497 -1.084 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 172.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.505 ' CD ' HH22 ' A' ' 81' ' ' ARG . 9.3 pt-20 -127.85 139.14 34.5 Favored Pre-proline 0 C--N 1.28 -2.44 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.479 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 17.0 Cg_exo -67.76 142.98 59.8 Favored 'Trans proline' 0 C--O 1.25 1.096 0 C-N-CA 122.443 2.095 . . . . 0.0 113.309 -178.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -134.43 159.27 41.61 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.439 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 7.0 m -96.91 138.62 34.17 Favored 'General case' 0 N--CA 1.423 -1.818 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 179.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 49.8 tp -84.97 124.01 31.19 Favored 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 120.164 -0.614 . . . . 0.0 109.5 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 75.1 mt -84.72 -52.69 12.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.532 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 174.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -179.02 163.6 1.35 Allowed 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 115.177 -0.919 . . . . 0.0 108.993 175.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.559 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -107.28 126.08 51.98 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 174.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.443 ' HB ' ' HB ' ' A' ' 22' ' ' THR . 44.8 mm -78.44 -64.13 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -175.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 37.2 m-20 -113.25 -161.62 0.77 Allowed 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 178.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -97.47 27.27 19.44 Favored Glycine 0 C--N 1.296 -1.649 0 N-CA-C 108.863 -1.695 . . . . 0.0 108.863 169.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.709 ' OD2' ' HD2' ' A' ' 35' ' ' ARG . 4.9 t70 -143.78 -62.19 0.39 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 -171.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.443 ' HB ' ' HB ' ' A' ' 18' ' ' ILE . 1.8 m -83.77 128.22 34.38 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-N 114.631 -1.168 . . . . 0.0 108.75 178.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.4 m -133.23 155.65 41.07 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 C-N-CA 122.78 0.432 . . . . 0.0 110.656 -177.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -119.61 112.11 18.91 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 -176.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.1 mp -126.0 159.5 32.54 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.519 0.676 . . . . 0.0 112.532 -176.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.439 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 25.3 ttt -127.62 102.78 6.99 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.464 -1.244 . . . . 0.0 108.741 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -105.1 119.1 38.21 Favored 'General case' 0 C--N 1.287 -2.127 0 C-N-CA 118.931 -1.108 . . . . 0.0 109.867 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 88.2 mttt 59.43 27.92 17.17 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 122.092 0.948 . . . . 0.0 110.754 175.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.444 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 93.07 7.04 62.75 Favored Glycine 0 N--CA 1.439 -1.114 0 CA-C-N 114.619 -1.173 . . . . 0.0 113.245 179.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -105.57 101.42 32.02 Favored Pre-proline 0 C--N 1.31 -1.127 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 5.5 Cg_exo -79.67 118.3 3.82 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 122.628 2.219 . . . . 0.0 110.47 177.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 63.7 mtt -136.1 149.0 48.52 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 121.092 0.472 . . . . 0.0 110.819 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.6 m -83.87 107.48 16.28 Favored 'General case' 0 N--CA 1.427 -1.579 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 176.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -101.99 163.78 12.06 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-O 121.602 0.715 . . . . 0.0 110.246 -177.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.709 ' HD2' ' OD2' ' A' ' 21' ' ' ASP . 25.3 ttp85 -137.46 141.79 41.58 Favored 'General case' 0 C--N 1.27 -2.88 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 169.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.542 ' HB2' ' HB ' ' A' ' 39' ' ' VAL . 28.6 mt -60.94 109.43 1.07 Allowed 'General case' 0 C--N 1.307 -1.261 0 O-C-N 124.115 0.884 . . . . 0.0 109.213 -177.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.4 tt -63.71 126.29 27.1 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 -179.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.45 ' C ' ' H ' ' A' ' 112' ' ' ALA . 91.0 mt 85.99 8.48 0.31 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 126.16 1.784 . . . . 0.0 113.85 -178.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.542 ' HB ' ' HB2' ' A' ' 36' ' ' LEU . 99.7 t -118.33 130.93 72.48 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.15 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 176.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -133.53 107.86 8.27 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 177.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.423 ' HB ' ' HD3' ' A' ' 42' ' ' PRO . 3.8 m -106.87 -56.3 0.06 OUTLIER Pre-proline 0 CA--C 1.569 1.68 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -177.002 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.423 ' HD3' ' HB ' ' A' ' 41' ' ' THR . 9.8 Cg_endo -92.29 13.11 1.95 Allowed 'Trans proline' 0 C--N 1.382 2.292 0 C-N-CA 122.273 1.982 . . . . 0.0 111.788 -175.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -138.26 152.27 48.41 Favored 'General case' 0 N--CA 1.419 -1.975 0 N-CA-C 103.799 -2.667 . . . . 0.0 103.799 178.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.8 m 63.81 20.98 12.48 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-O 121.975 0.893 . . . . 0.0 108.961 -175.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.686 ' O ' ' HD2' ' A' ' 47' ' ' PRO . 22.5 tptp -69.63 -37.91 77.0 Favored 'General case' 0 N--CA 1.436 -1.161 0 O-C-N 121.721 -0.612 . . . . 0.0 111.693 -174.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . 0.38 86.3 t60 87.84 -77.65 0.0 OUTLIER Pre-proline 0 N--CA 1.485 1.308 0 C-N-CA 124.702 1.201 . . . . 0.0 113.221 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.686 ' HD2' ' O ' ' A' ' 45' ' ' LYS . 37.0 Cg_endo -72.07 119.18 6.01 Favored 'Trans proline' 0 C--N 1.375 1.933 0 CA-C-N 122.731 2.011 . . . . 0.0 109.448 169.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -20.35 61.49 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-O 120.92 0.391 . . . . 0.0 111.704 -175.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.556 ' NZ ' ' HA ' ' A' ' 49' ' ' LYS . 1.3 mmpm? -90.96 3.73 53.86 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 121.503 0.668 . . . . 0.0 110.585 175.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -95.93 1.06 62.95 Favored Glycine 0 N--CA 1.425 -2.048 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.876 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 12.7 p -84.78 -35.58 10.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 117.485 0.642 . . . . 0.0 110.526 -178.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -77.87 -26.82 49.49 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 178.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -78.38 -48.36 15.69 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 114.873 -1.058 . . . . 0.0 112.149 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.587 ' OH ' ' HA ' ' A' ' 108' ' ' LEU . 3.0 t80 -88.78 -28.79 20.24 Favored 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.886 -174.008 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -43.77 -58.0 4.38 Favored Glycine 0 CA--C 1.536 1.365 0 N-CA-C 115.186 0.834 . . . . 0.0 115.186 -175.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -56.49 -32.08 88.24 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 123.035 2.49 . . . . 0.0 113.984 179.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -68.21 -57.1 6.55 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.918 0.39 . . . . 0.0 111.616 -176.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.3 -41.41 98.95 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.559 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 37.0 m -63.96 -35.69 81.5 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.137 -178.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.94 -37.86 88.71 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-O 121.023 0.44 . . . . 0.0 110.333 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -68.91 -53.09 22.98 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.774 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 28.5 m -57.11 -48.11 79.45 Favored 'General case' 0 C--N 1.318 -0.79 0 O-C-N 124.101 0.876 . . . . 0.0 112.306 -178.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.559 ' HG2' ' HB3' ' A' ' 17' ' ' ALA . 51.8 mttp -60.61 -54.54 44.16 Favored 'General case' 0 C--N 1.344 0.359 0 C-N-CA 120.962 -0.295 . . . . 0.0 110.963 -178.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.6 mtmp? -67.5 -23.24 65.45 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 15.5 tpt -67.05 -45.11 78.4 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.21 0.529 . . . . 0.0 109.629 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.0 m -86.93 -26.13 6.06 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.438 -178.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 63' ' ' LYS . 51.0 mt-10 -73.9 -34.15 64.29 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.368 177.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -83.96 -16.34 44.47 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 121.01 0.433 . . . . 0.0 110.415 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.74 143.12 48.03 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.018 -178.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 44.2 mttp -74.44 -44.31 52.34 Favored 'General case' 0 CA--C 1.493 -1.236 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.408 ' HB2' ' HE3' ' A' ' 71' ' ' LYS . 42.2 mtmt -133.78 147.35 51.26 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-N 113.846 -1.524 . . . . 0.0 107.047 -179.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.448 ' O ' ' HA ' ' A' ' 11' ' ' PRO . 4.0 mp -105.9 120.99 57.67 Favored 'Isoleucine or valine' 0 C--N 1.273 -2.719 0 N-CA-C 105.106 -2.183 . . . . 0.0 105.106 173.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.627 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 23.9 mm-40 -111.83 132.95 54.36 Favored 'General case' 0 C--N 1.292 -1.908 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 -175.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.6 m -112.3 129.72 67.32 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.989 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 175.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.569 ' HA ' ' O ' ' A' ' 8' ' ' HIS . 28.4 tt0 -106.52 118.97 38.04 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 119.525 -0.87 . . . . 0.0 111.229 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -87.24 124.24 33.1 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-N 113.395 -1.729 . . . . 0.0 109.232 177.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -88.31 -175.58 5.06 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 106.987 -1.486 . . . . 0.0 106.987 177.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.55 -3.81 56.08 Favored 'General case' 0 C--N 1.296 -1.718 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -173.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -93.2 -87.67 1.59 Allowed Glycine 0 N--CA 1.435 -1.421 0 C-N-CA 119.913 -1.137 . . . . 0.0 112.473 -177.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -125.59 139.24 53.75 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -175.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.505 HH22 ' CD ' ' A' ' 10' ' ' GLU . 25.6 ttt180 -98.96 -13.35 19.99 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.648 0.737 . . . . 0.0 109.129 178.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 13.6 p -141.93 159.1 42.92 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.333 177.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.29 -168.9 1.94 Allowed 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -71.77 -31.42 66.62 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-O 120.632 0.253 . . . . 0.0 111.561 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -79.86 -22.23 43.14 Favored 'General case' 0 C--O 1.244 0.785 0 CA-C-O 121.227 0.537 . . . . 0.0 110.814 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 105.55 28.5 5.39 Favored Glycine 0 N--CA 1.437 -1.25 0 C-N-CA 120.808 -0.711 . . . . 0.0 111.895 176.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 12.2 mmt85 -94.74 139.19 31.58 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 174.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -74.78 121.22 6.62 Favored Glycine 0 N--CA 1.425 -2.033 0 O-C-N 123.712 0.632 . . . . 0.0 111.575 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.3 mt -103.58 93.05 4.72 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 178.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -145.13 155.08 43.1 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 -179.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -85.25 132.04 34.33 Favored 'General case' 0 C--N 1.29 -2.02 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 48.3 mm -99.5 126.38 52.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 C-N-CA 119.247 -0.981 . . . . 0.0 110.073 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.627 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 27.0 m-85 -120.3 144.07 48.01 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 114.682 -1.145 . . . . 0.0 109.125 179.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -106.67 99.54 9.11 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 176.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.5 p30 42.79 38.31 1.32 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 125.146 1.378 . . . . 0.0 113.907 -176.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.78 -11.4 38.35 Favored Glycine 0 N--CA 1.444 -0.785 0 CA-C-N 115.449 -0.796 . . . . 0.0 114.131 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -87.63 135.27 33.43 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 176.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . 0.602 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 3.6 mpp? -80.4 111.69 17.04 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 177.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 82.8 t -70.14 -45.63 75.28 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 19.1 m-20 -55.35 -50.13 70.46 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.421 -179.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' A' ' 105' ' ' ARG . 9.3 tp10 -55.8 -51.01 68.94 Favored 'General case' 0 C--O 1.211 -0.96 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.226 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.93 -43.29 95.04 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.829 -176.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 79.0 mt -60.29 -48.98 79.42 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 179.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 52.1 t -73.06 -31.5 35.47 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.47 -178.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.454 ' HB2' ' O ' ' A' ' 101' ' ' GLU . 1.8 tpt180 -72.57 -28.02 62.55 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.997 -178.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -87.51 -8.7 56.06 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.239 0.543 . . . . 0.0 109.76 175.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.97 41.52 87.48 Favored Glycine 0 N--CA 1.431 -1.695 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.186 -176.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.587 ' HA ' ' OH ' ' A' ' 54' ' ' TYR . 90.7 mt -96.89 -18.21 19.66 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.063 0.459 . . . . 0.0 110.768 179.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -149.7 171.32 16.88 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -176.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -110.2 171.55 7.38 Favored 'General case' 0 N--CA 1.425 -1.678 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.415 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 8.0 p -84.01 133.35 29.39 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.782 0 CA-C-O 121.066 0.46 . . . . 0.0 110.359 -179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.45 ' H ' ' C ' ' A' ' 38' ' ' LEU . . . -88.46 121.63 31.06 Favored 'General case' 0 CA--C 1.486 -1.503 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 176.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -77.66 133.8 38.3 Favored 'General case' 0 C--N 1.28 -2.431 0 CA-C-N 114.841 -1.072 . . . . 0.0 111.769 -171.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 44.5 t -88.3 127.75 41.08 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.876 0 N-CA-C 103.857 -2.646 . . . . 0.0 103.857 169.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -81.46 -17.89 47.18 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -165.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 9.6 mptt 69.45 121.99 0.03 OUTLIER Pre-proline 0 N--CA 1.474 0.761 0 C-N-CA 123.998 0.919 . . . . 0.0 111.958 -175.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.433 ' HD2' ' HG3' ' B' ' 130' ' ' PRO . 30.5 Cg_endo -97.45 -166.43 0.1 OUTLIER 'Trans proline' 0 N--CA 1.435 -1.935 0 C-N-CA 122.249 1.966 . . . . 0.0 109.151 173.15 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . 0.463 HD22 ' C ' ' A' ' 118' ' ' ASN . 0.2 OUTLIER -102.75 -65.3 1.0 Allowed 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 176.044 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . 0.457 HD22 HG13 ' B' ' 127' ' ' VAL . 26.4 t-20 -164.18 99.17 0.84 Allowed 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -178.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 13.0 p -79.0 -34.39 44.08 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-O 120.826 0.346 . . . . 0.0 110.75 -179.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 . . . . . 0 N--CA 1.435 -1.185 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 178.737 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.442 0 N-CA-C 110.901 -0.88 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 50.6 m -89.78 18.05 5.99 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.91 0.355 . . . . 0.0 111.083 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 7.7 p -63.91 111.57 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.83 0 CA-C-O 121.243 0.544 . . . . 0.0 110.936 177.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . 54.78 -100.65 0.11 Allowed 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 124.668 1.187 . . . . 0.0 112.884 -178.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -170.26 99.81 0.27 Allowed 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 106.19 -1.782 . . . . 0.0 106.19 -177.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 127' ' ' VAL . . . . . 0.457 HG13 HD22 ' A' ' 119' ' ' ASN . 60.6 t -97.82 121.49 48.41 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.862 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.667 -177.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -72.2 101.76 2.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.629 0.728 . . . . 0.0 110.391 172.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.422 ' HB3' ' CD ' ' B' ' 130' ' ' PRO . 59.1 mtpt -91.13 174.16 4.73 Favored Pre-proline 0 C--N 1.304 -1.382 0 CA-C-N 114.363 -1.289 . . . . 0.0 110.035 -179.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . 0.433 ' HG3' ' HD2' ' A' ' 117' ' ' PRO . 2.0 Cg_endo -74.58 172.59 15.88 Favored 'Trans proline' 0 C--N 1.37 1.675 0 C-N-CA 121.719 1.613 . . . . 0.0 112.456 -179.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -89.15 41.97 1.06 Allowed 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.403 ' HA ' ' HB2' ' B' ' 135' ' ' GLU . 26.9 p-10 -97.69 9.14 43.32 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.995 -174.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.57 -37.61 73.44 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-O 122.036 0.922 . . . . 0.0 110.88 -179.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 63.0 m80 -103.83 -0.45 29.19 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.498 -0.773 . . . . 0.0 109.852 -177.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.403 ' HB2' ' HA ' ' B' ' 132' ' ' ASN . 25.1 tt0 -66.66 -38.03 86.01 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.902 -176.112 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -58.52 -37.93 76.65 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.153 -178.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.1 mt -64.83 -51.09 64.01 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.811 -178.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 8.2 mp -70.25 -23.26 62.87 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 178.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 84.9 mtt-85 -66.03 -31.24 72.02 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.278 -0.569 . . . . 0.0 110.537 174.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . 0.561 ' HE2' ' HA ' ' B' ' 140' ' ' LYS . 10.8 mmpt? -71.35 -39.7 71.15 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 176.022 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 3.5 m -59.99 -49.73 76.52 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.672 177.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.498 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 0.8 OUTLIER -64.22 -43.17 95.79 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.671 -0.695 . . . . 0.0 112.838 179.04 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . 0.403 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -61.66 -40.93 96.68 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.995 0.426 . . . . 0.0 110.888 179.125 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -69.21 -48.02 63.19 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.453 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -66.55 -32.49 73.87 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.564 -0.743 . . . . 0.0 112.081 -175.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 146' ' ' LYS . . . . . 0.498 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 84.0 mttt -65.33 -40.38 93.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.498 0.19 . . . . 0.0 110.648 174.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 48.4 mmtm -64.79 -37.88 89.11 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.501 0.667 . . . . 0.0 109.582 178.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . 0.407 ' HB2' ' HG ' ' B' ' 150' ' ' LEU . 49.3 mm-40 -79.24 -13.87 59.41 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 114.709 -1.132 . . . . 0.0 113.043 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm 54.32 47.49 22.86 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.54 0.736 . . . . 0.0 109.834 -178.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . 0.407 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 96.3 mt -74.98 95.59 3.02 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 114.943 -1.026 . . . . 0.0 112.0 -174.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 51.9 t30 53.92 -69.84 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 127.775 2.43 . . . . 0.0 114.154 173.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 12.0 tt -75.84 -28.74 19.48 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.075 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 72.2 m95 -78.13 -15.58 58.73 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.365 0.602 . . . . 0.0 111.407 -178.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 22.9 t -88.8 11.09 18.77 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.548 177.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -66.79 -28.73 68.62 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.147 0.579 . . . . 0.0 112.41 -178.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.1 t70 . . . . . 0 C--N 1.299 -1.592 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 -170.577 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.514 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 86.0 m -77.08 100.44 5.7 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 121.597 0.713 . . . . 0.0 110.179 177.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.5 p -90.53 -15.19 31.14 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.669 -177.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.413 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 10.5 m -66.15 -39.34 89.74 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 176.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 4' ' ' THR . 92.0 mttt 73.1 -178.19 0.19 Allowed 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 114.515 -1.221 . . . . 0.0 111.456 -173.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -135.68 -150.99 0.4 Allowed 'General case' 0 C--N 1.291 -1.943 0 N-CA-C 105.69 -1.967 . . . . 0.0 105.69 175.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.431 ' HB3' ' O ' ' A' ' 76' ' ' PHE . 64.0 mt 64.75 -158.86 0.29 Allowed 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 179.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.426 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 7.7 m-70 -117.11 102.91 9.71 Favored 'General case' 0 C--N 1.292 -1.914 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 174.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -115.52 107.48 15.21 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 105.022 -2.214 . . . . 0.0 105.022 175.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -138.99 159.0 68.73 Favored Pre-proline 0 C--N 1.3 -1.582 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.454 -173.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -78.94 147.17 21.06 Favored 'Trans proline' 0 C--O 1.25 1.075 0 C-N-CA 122.729 2.286 . . . . 0.0 114.123 -174.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -144.14 155.59 43.99 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.343 177.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.437 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 9.1 m -104.35 142.67 34.16 Favored 'General case' 0 C--N 1.296 -1.74 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 179.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -84.22 142.9 29.95 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 118.109 -1.437 . . . . 0.0 109.538 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 70.4 mt -103.0 -57.59 4.4 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.055 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 171.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 51.1 mttm -152.57 154.14 34.81 Favored 'General case' 0 N--CA 1.428 -1.536 0 C-N-CA 124.013 0.925 . . . . 0.0 110.552 -178.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.516 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -108.8 95.97 6.01 Favored 'General case' 0 C--N 1.288 -2.098 0 N-CA-C 105.824 -1.917 . . . . 0.0 105.824 169.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 60.5 mt -68.4 -37.67 78.21 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.923 -171.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -152.44 -165.03 2.09 Favored 'General case' 0 C--N 1.291 -1.97 0 N-CA-C 106.366 -1.716 . . . . 0.0 106.366 -176.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -90.96 -25.76 23.82 Favored Glycine 0 C--N 1.286 -2.206 0 N-CA-C 109.029 -1.628 . . . . 0.0 109.029 176.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.698 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 10.5 t70 -92.87 -36.32 12.88 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 122.035 0.922 . . . . 0.0 109.504 -177.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.8 m -114.13 127.29 55.85 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 114.902 -1.045 . . . . 0.0 111.294 -173.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.9 p -132.79 153.75 38.54 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.629 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -178.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -112.85 112.96 24.82 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 -175.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -115.75 159.1 21.86 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.764 0.792 . . . . 0.0 111.737 -178.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.437 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 46.7 ttm -123.01 104.85 9.49 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 175.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -109.87 118.13 35.67 Favored 'General case' 0 C--N 1.286 -2.158 0 C-N-CA 118.147 -1.421 . . . . 0.0 109.626 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 78.9 mttt 62.41 27.69 16.46 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.222 1.009 . . . . 0.0 110.199 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.08 1.86 64.74 Favored Glycine 0 CA--C 1.524 0.598 0 CA-C-N 115.365 -0.834 . . . . 0.0 113.164 -179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.411 ' HA ' ' HD3' ' A' ' 31' ' ' PRO . 53.7 tt0 -104.11 107.55 57.5 Favored Pre-proline 0 C--N 1.32 -0.68 0 O-C-N 122.462 -0.434 . . . . 0.0 110.48 -179.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 30' ' ' GLN . 2.7 Cg_endo -83.23 120.31 2.9 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 123.119 2.546 . . . . 0.0 111.992 178.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . 0.49 ' HB2' ' CE2' ' A' ' 34' ' ' PHE . 90.4 mtp -134.82 156.35 49.04 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 120.892 0.377 . . . . 0.0 110.273 178.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.2 m -92.98 119.5 32.31 Favored 'General case' 0 C--N 1.295 -1.786 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.49 ' CE2' ' HB2' ' A' ' 32' ' ' MET . 86.0 m-85 -116.78 142.57 46.75 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -176.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.698 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 31.6 mtm105 -106.3 153.89 21.54 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 166.119 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.527 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 73.9 mt -83.82 129.4 34.94 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-O 121.651 0.738 . . . . 0.0 112.464 -175.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.429 HD13 ' HB2' ' A' ' 77' ' ' ASP . 52.5 mt -57.04 130.29 45.45 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.452 176.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.602 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 78.5 mt 73.55 11.27 4.79 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 124.551 1.157 . . . . 0.0 112.481 177.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 86.3 t -110.84 131.05 63.08 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.26 0 CA-C-O 121.252 0.548 . . . . 0.0 110.646 -179.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.404 ' HB2' ' HB2' ' A' ' 112' ' ' ALA . 22.0 t70 -128.31 107.17 9.54 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 174.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.57 ' HB ' ' HB2' ' A' ' 21' ' ' ASP . 1.3 m -114.52 -27.22 0.11 Allowed Pre-proline 0 C--N 1.287 -2.11 0 CA-C-O 118.139 -0.934 . . . . 0.0 112.357 175.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.42 ' CD ' ' H ' ' A' ' 41' ' ' THR . 75.7 Cg_exo -55.32 109.55 0.43 Allowed 'Trans proline' 1 C--N 1.426 4.629 0 CA-C-N 121.873 1.705 . . . . 0.0 110.689 177.167 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.427 ' HB3' ' HE3' ' A' ' 53' ' ' LYS . 2.3 tm-20 -83.2 123.23 29.37 Favored 'General case' 0 N--CA 1.414 -2.269 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 -177.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.1 t -124.8 0.74 8.08 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -174.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.572 ' NZ ' ' HB2' ' B' ' 155' ' ' GLU . 35.5 ttpt -82.78 -44.31 15.7 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 35.2 m170 72.77 104.58 0.03 OUTLIER Pre-proline 0 CA--C 1.505 -0.786 0 CA-C-N 113.574 -1.648 . . . . 0.0 111.403 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -64.56 -35.33 48.7 Favored 'Trans proline' 0 N--CA 1.451 -1.01 0 C-N-CA 123.015 2.477 . . . . 0.0 112.152 -175.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt 72.93 -41.62 0.51 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.172 1.389 . . . . 0.0 111.597 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -36.13 83.02 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 124.867 1.267 . . . . 0.0 113.889 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 172.29 -163.25 35.4 Favored Glycine 0 CA--C 1.502 -0.732 0 C-N-CA 120.361 -0.923 . . . . 0.0 111.417 -177.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.7 p -81.57 79.14 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 CA-C-O 122.877 1.322 . . . . 0.0 112.539 -176.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -90.81 -12.65 35.74 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.235 -1.348 . . . . 0.0 108.289 176.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.427 ' HE3' ' HB3' ' A' ' 43' ' ' GLU . 43.6 mtpt -66.63 -37.41 84.77 Favored 'General case' 0 C--O 1.215 -0.747 0 CA-C-N 114.484 -1.234 . . . . 0.0 112.12 -175.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 75.1 m-85 59.37 27.34 16.42 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.77 0.828 . . . . 0.0 113.101 -178.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -51.14 -55.78 17.43 Favored Glycine 0 CA--C 1.54 1.643 0 CA-C-N 115.287 -0.87 . . . . 0.0 113.451 177.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_exo -56.26 -36.34 96.73 Favored 'Trans proline' 0 C--N 1.373 1.837 0 C-N-CA 122.911 2.407 . . . . 0.0 112.517 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.8 mp0 -62.36 -51.77 66.3 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 122.973 0.509 . . . . 0.0 110.406 178.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.29 -41.64 85.07 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.841 -178.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 19.0 m -67.83 -33.97 75.81 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.395 0.617 . . . . 0.0 111.357 -177.133 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -70.95 -39.07 72.8 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.042 175.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -62.8 -41.95 99.5 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.318 -176.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.537 ' O ' HG22 ' A' ' 66' ' ' VAL . 7.5 p -63.47 -44.61 93.92 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.85 178.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.516 ' HG2' ' HB3' ' A' ' 17' ' ' ALA . 9.1 mtpm? -57.67 -49.03 77.84 Favored 'General case' 0 CA--C 1.513 -0.475 0 O-C-N 123.385 0.428 . . . . 0.0 110.472 176.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 97.1 mttt -57.36 -39.89 76.92 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.139 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.6 mmt -72.19 -51.38 21.44 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 179.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.537 HG22 ' O ' ' A' ' 62' ' ' THR . 34.6 m -74.33 -27.21 21.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 -174.018 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -86.19 -20.15 28.98 Favored 'General case' 0 C--N 1.314 -0.953 0 O-C-N 121.847 -0.533 . . . . 0.0 110.577 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -83.59 -24.66 31.4 Favored 'General case' 0 C--O 1.245 0.856 0 CA-C-O 121.158 0.504 . . . . 0.0 109.822 174.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.57 131.25 38.32 Favored 'General case' 0 C--O 1.248 1.013 0 CA-C-N 114.819 -1.082 . . . . 0.0 112.027 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -82.99 -37.49 23.94 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 115.117 -0.947 . . . . 0.0 108.69 177.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -133.09 119.8 20.46 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.781 -1.1 . . . . 0.0 108.182 -178.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 63.4 mt -99.51 112.56 32.17 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.658 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -114.31 142.14 46.7 Favored 'General case' 0 C--N 1.289 -2.023 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.083 -177.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.6 m -110.34 124.95 67.53 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.756 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.426 ' HA ' ' O ' ' A' ' 8' ' ' HIS . 34.2 tt0 -115.28 125.62 53.51 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.431 ' O ' ' HB3' ' A' ' 7' ' ' LEU . 29.8 t80 -96.55 129.18 43.98 Favored 'General case' 0 N--CA 1.406 -2.627 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.851 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.429 ' HB2' HD13 ' A' ' 37' ' ' LEU . 17.2 t70 -85.51 -174.37 5.14 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 125.117 1.367 . . . . 0.0 110.031 -176.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.655 ' NZ ' ' HA ' ' A' ' 78' ' ' LYS . 1.1 mmpm? -94.78 7.85 44.52 Favored 'General case' 0 C--N 1.313 -0.993 0 O-C-N 121.458 -0.776 . . . . 0.0 112.144 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.578 ' HA3' ' CG1' ' A' ' 114' ' ' VAL . . . -84.15 -137.2 3.43 Favored Glycine 0 N--CA 1.428 -1.867 0 C-N-CA 120.775 -0.726 . . . . 0.0 111.899 175.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -95.23 144.22 26.01 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.6 ttm180 -87.07 -29.18 22.09 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.162 0.506 . . . . 0.0 110.528 178.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.0 p -101.97 142.94 32.47 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-O 121.353 0.597 . . . . 0.0 111.561 -178.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -91.63 149.66 21.54 Favored 'General case' 0 C--N 1.287 -2.14 0 CA-C-N 115.052 -0.976 . . . . 0.0 111.125 179.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -17.3 63.98 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 124.555 1.142 . . . . 0.0 113.531 -178.307 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 34.4 t80 -97.15 -2.36 43.19 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.623 0.725 . . . . 0.0 109.65 179.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 101.87 24.85 8.34 Favored Glycine 0 N--CA 1.438 -1.176 0 C-N-CA 120.553 -0.832 . . . . 0.0 113.037 177.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.504 ' HG2' ' HG3' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -106.71 -178.71 3.73 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 122.048 -0.678 . . . . 0.0 110.176 174.656 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -103.76 152.28 17.79 Favored Glycine 0 N--CA 1.42 -2.374 0 N-CA-C 106.859 -2.496 . . . . 0.0 106.859 168.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 93.6 mt -109.03 122.5 47.39 Favored 'General case' 0 C--N 1.282 -2.333 0 CA-C-N 117.972 0.886 . . . . 0.0 110.442 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -144.16 157.85 44.06 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.116 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.487 ' CZ ' ' HB2' ' A' ' 100' ' ' ASN . 4.3 t80 -103.83 129.73 51.32 Favored 'General case' 0 C--N 1.297 -1.709 0 N-CA-C 105.546 -2.02 . . . . 0.0 105.546 174.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 41.6 mm -99.32 125.73 52.8 Favored 'Isoleucine or valine' 0 C--O 1.249 1.042 0 C-N-CA 119.731 -0.788 . . . . 0.0 111.892 -178.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -110.79 131.6 54.91 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.983 173.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.67 98.26 8.03 Favored 'General case' 0 C--N 1.289 -2.052 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 175.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.251 4.1 p30 44.92 32.12 0.79 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.209 1.404 . . . . 0.0 114.137 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.21 2.16 35.77 Favored Glycine 0 CA--C 1.521 0.442 0 CA-C-N 115.676 -0.693 . . . . 0.0 113.445 179.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.7 mttp -99.78 126.88 45.92 Favored 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 175.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 3.7 mpp? -78.13 105.5 9.39 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 122.815 0.446 . . . . 0.0 110.401 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 57.6 t -71.51 -43.05 72.46 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.332 -178.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.527 ' ND2' ' HB3' ' A' ' 36' ' ' LEU . 1.7 m-20 -58.76 -49.82 76.2 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.957 -178.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -63.84 -37.16 86.34 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.542 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.55 -44.6 93.19 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.898 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.13 -52.75 64.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.747 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 58.1 t -65.05 -41.45 92.02 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.276 -177.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 34.4 ttp85 -64.23 -31.98 73.39 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.922 0.391 . . . . 0.0 111.291 -179.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -87.99 -1.05 57.75 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.954 0.354 . . . . 0.0 111.954 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.433 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 74.44 22.14 77.85 Favored Glycine 0 N--CA 1.441 -0.997 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.428 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.3 mt -91.67 -6.24 52.44 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -151.85 162.95 40.22 Favored 'General case' 0 N--CA 1.427 -1.581 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.005 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 22.3 ttpt -120.34 154.74 34.62 Favored 'General case' 0 C--N 1.292 -1.894 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 178.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.6 p -76.98 127.97 37.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 C-N-CA 118.656 -1.218 . . . . 0.0 112.28 -176.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.602 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . -97.58 121.05 39.03 Favored 'General case' 0 C--N 1.299 -1.603 0 N-CA-C 105.225 -2.139 . . . . 0.0 105.225 171.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.503 ' OH ' ' HA ' ' B' ' 130' ' ' PRO . 31.5 t80 -78.12 129.13 34.81 Favored 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 118.783 -1.167 . . . . 0.0 112.386 -173.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.578 ' CG1' ' HA3' ' A' ' 79' ' ' GLY . 95.4 t -99.56 120.01 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.952 0 CA-C-N 114.649 -1.16 . . . . 0.0 108.905 178.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -97.34 140.29 32.03 Favored 'General case' 0 C--N 1.297 -1.675 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -77.31 115.65 50.97 Favored Pre-proline 0 N--CA 1.42 -1.961 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 173.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -89.0 9.51 3.56 Favored 'Trans proline' 0 C--N 1.309 -1.552 0 C-N-CA 122.505 2.137 . . . . 0.0 113.064 -171.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 76.62 -24.65 0.22 Allowed 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 124.118 0.967 . . . . 0.0 111.909 -178.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 79.12 -36.54 0.17 Allowed 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.49 1.516 . . . . 0.0 112.396 174.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 28.6 m -82.17 -42.97 18.31 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 176.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 16.0 t-80 . . . . . 0 C--N 1.317 -0.83 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.383 178.659 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.477 0 N-CA-C 110.859 -0.897 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 19.0 m -126.86 111.1 13.77 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 7.6 p -165.27 144.25 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -71.3 116.46 11.65 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -176.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . 0.583 ' CE1' ' HB2' ' B' ' 128' ' ' TYR . 0.2 OUTLIER -154.56 172.78 17.27 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.194 173.398 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 27.7 m -88.43 -33.78 6.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 C-N-CA 121.039 -0.264 . . . . 0.0 111.574 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 128' ' ' TYR . . . . . 0.583 ' HB2' ' CE1' ' B' ' 126' ' ' TYR . 24.5 t80 51.11 74.74 0.22 Allowed 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 124.721 1.208 . . . . 0.0 110.983 -175.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -103.54 103.34 35.4 Favored Pre-proline 0 C--N 1.295 -1.764 0 N-CA-C 105.468 -2.049 . . . . 0.0 105.468 173.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . 0.503 ' HA ' ' OH ' ' A' ' 113' ' ' TYR . 9.3 Cg_exo -67.02 116.33 4.1 Favored 'Trans proline' 0 N--CA 1.446 -1.301 0 C-N-CA 122.093 1.862 . . . . 0.0 113.146 -174.215 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 131' ' ' ASN . . . . . 0.402 ' C ' ' H ' ' B' ' 133' ' ' THR . 26.6 p-10 -60.38 -50.44 73.58 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 170.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.512 ' HA ' ' HB3' ' B' ' 135' ' ' GLU . 16.7 t-20 73.15 -10.91 0.95 Allowed 'General case' 0 CA--C 1.508 -0.663 0 C-N-CA 127.982 2.513 . . . . 0.0 112.523 168.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 133' ' ' THR . . . . . 0.402 ' H ' ' C ' ' B' ' 131' ' ' ASN . 0.7 OUTLIER -62.15 -32.29 72.88 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-N 113.87 -1.514 . . . . 0.0 112.263 -176.447 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 69.9 m80 -139.24 10.83 2.56 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 176.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.512 ' HB3' ' HA ' ' B' ' 132' ' ' ASN . 45.0 tt0 -60.64 -59.84 4.75 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.467 -174.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . 0.464 ' O ' ' HG2' ' B' ' 140' ' ' LYS . 13.7 mm100 -54.99 -44.57 74.6 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 123.946 0.779 . . . . 0.0 111.885 -176.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 91.2 mt -60.24 -47.4 86.14 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.652 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.58 -35.5 75.4 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 178.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -60.62 -45.21 94.89 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-O 120.759 0.314 . . . . 0.0 110.296 176.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . 0.464 ' HG2' ' O ' ' B' ' 136' ' ' GLN . 2.8 mmmp? -63.43 -44.91 93.21 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.436 -178.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 8.1 p -70.2 -41.07 74.17 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.327 -178.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.529 ' HG3' ' CZ2' ' B' ' 153' ' ' TRP . 39.3 tt0 -65.94 -44.84 83.86 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.516 177.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -54.29 -43.4 71.03 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 120.999 0.428 . . . . 0.0 110.591 -179.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -64.73 -46.85 80.47 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.526 178.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -67.13 -35.73 80.36 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.915 -178.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 146' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 88.8 mttt -62.33 -38.77 90.76 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.971 0.415 . . . . 0.0 110.334 176.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 9.9 mtpm? -63.99 -40.63 96.79 Favored 'General case' 0 CA--C 1.503 -0.828 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.226 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -86.35 -8.12 57.94 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.337 -175.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . 0.515 ' O ' ' HB2' ' B' ' 154' ' ' SER . 51.0 mtpt 49.7 58.83 5.0 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 124.092 0.957 . . . . 0.0 111.119 -177.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 90.8 mt -88.52 119.51 29.04 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.299 -178.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 151' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 90.9 m-20 52.5 -93.46 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 125.163 1.385 . . . . 0.0 113.885 176.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 35.3 mt -65.64 -31.4 53.61 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.593 0 CA-C-O 121.087 0.47 . . . . 0.0 110.569 178.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 153' ' ' TRP . . . . . 0.529 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 58.8 m95 -77.94 -6.49 54.54 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-O 122.101 0.953 . . . . 0.0 111.117 -178.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . 0.515 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 19.9 t -99.87 18.62 17.87 Favored 'General case' 0 N--CA 1.411 -2.4 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.14 175.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . 0.572 ' HB2' ' NZ ' ' A' ' 45' ' ' LYS . 10.0 pt-20 -71.25 -17.62 62.48 Favored 'General case' 0 C--N 1.356 0.86 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 173.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.1 t70 . . . . . 0 CA--C 1.5 -0.966 0 CA-C-N 113.339 -1.755 . . . . 0.0 112.1 175.08 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.273 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.6 m -63.56 -52.86 59.24 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 177.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.8 m 57.55 76.04 0.34 Allowed 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.271 -1.332 . . . . 0.0 114.504 176.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 15.2 p -122.97 -39.26 2.52 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.624 176.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -91.79 -29.21 16.89 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.22 178.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.01 168.8 16.77 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 90.3 mt -91.4 -175.39 4.22 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -173.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 25.5 p80 -123.61 102.17 7.71 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.579 ' H ' ' HD3' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -94.49 132.23 39.37 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 174.7 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.48 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 3.9 pt-20 -117.38 144.37 33.85 Favored Pre-proline 0 C--N 1.262 -3.217 0 CA-C-N 114.423 -1.262 . . . . 0.0 110.847 -175.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.48 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 23.5 Cg_exo -63.92 138.91 65.34 Favored 'Trans proline' 0 C--N 1.359 1.098 0 C-N-CA 123.07 2.514 . . . . 0.0 114.301 -174.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.587 ' O ' ' HB ' ' A' ' 72' ' ' ILE . . . -136.08 151.68 50.08 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.488 178.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.418 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 86.7 m -98.94 133.2 43.55 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 178.158 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.489 ' H ' HD23 ' A' ' 14' ' ' LEU . 2.2 pt? -80.93 141.31 34.64 Favored 'General case' 0 C--N 1.306 -1.292 0 C-N-CA 118.498 -1.281 . . . . 0.0 109.255 177.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 74.1 mt -101.36 -53.56 7.51 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.855 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 175.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -161.67 156.99 23.82 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.489 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.473 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -112.54 119.11 37.06 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 174.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 59.8 mt -85.71 -64.03 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.275 0 CA-C-O 121.192 0.52 . . . . 0.0 109.747 -175.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -135.93 -168.79 2.28 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.172 -0.922 . . . . 0.0 108.526 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -74.11 -22.54 77.69 Favored Glycine 0 C--N 1.314 -0.661 0 C-N-CA 120.657 -0.783 . . . . 0.0 112.615 -177.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.438 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 9.6 p-10 -100.63 -20.36 15.69 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 122.304 0.242 . . . . 0.0 110.756 -176.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.2 p -127.73 118.8 24.46 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 6.3 m -128.11 157.45 40.33 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.916 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 176.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -119.89 119.22 32.87 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -178.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.9 mp -125.25 159.57 31.33 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.501 0.667 . . . . 0.0 112.2 -175.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.455 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 48.0 ttm -122.8 107.09 11.51 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 124.177 0.991 . . . . 0.0 108.497 177.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -113.18 126.89 55.93 Favored 'General case' 0 C--N 1.292 -1.913 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.9 mttt 59.0 27.66 16.66 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 121.613 0.721 . . . . 0.0 111.0 178.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 88.03 7.05 74.49 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.749 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.455 ' O ' ' HA ' ' A' ' 26' ' ' MET . 17.6 mm-40 -103.88 104.11 41.11 Favored Pre-proline 0 C--N 1.319 -0.74 0 O-C-N 122.422 -0.457 . . . . 0.0 110.511 -179.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -81.07 113.83 2.77 Favored 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.623 2.215 . . . . 0.0 110.685 176.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 65.6 mtt -135.14 149.85 50.07 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.6 m -87.75 129.68 35.09 Favored 'General case' 0 C--N 1.295 -1.804 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 175.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -113.51 138.9 49.47 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 113.54 0.941 . . . . 0.0 113.54 -173.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.438 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 10.6 tpp85 -107.99 129.46 55.12 Favored 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 106.324 -1.732 . . . . 0.0 106.324 168.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.406 HD22 HD12 ' A' ' 103' ' ' LEU . 6.9 mp -64.94 122.02 16.02 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.5 0.667 . . . . 0.0 111.066 178.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.4 tt -66.35 130.18 42.33 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.98 -1.009 . . . . 0.0 108.699 -177.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 70.3 mt 79.5 8.16 1.76 Allowed 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 124.938 1.295 . . . . 0.0 111.611 -177.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 54.2 t -115.41 126.44 72.97 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 CA-C-O 121.175 0.512 . . . . 0.0 110.543 179.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -141.68 108.01 5.27 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.325 175.121 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 28.3 m -82.34 -40.46 0.91 Allowed Pre-proline 0 C--N 1.282 -2.351 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.143 173.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.568 ' HG3' ' O ' ' A' ' 47' ' ' PRO . 87.5 Cg_exo -50.6 110.09 0.36 Allowed 'Trans proline' 0 C--N 1.398 3.169 0 C-N-CA 123.015 2.476 . . . . 0.0 116.155 179.385 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.441 ' O ' ' HB ' ' A' ' 44' ' ' THR . 32.3 tt0 -149.83 147.65 28.22 Favored 'General case' 0 C--N 1.287 -2.151 0 N-CA-C 101.952 -3.351 . . . . 0.0 101.952 167.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.441 ' HB ' ' O ' ' A' ' 43' ' ' GLU . 46.2 m 76.48 161.89 0.23 Allowed 'General case' 0 CA--C 1.563 1.454 0 N-CA-C 106.006 -1.85 . . . . 0.0 106.006 -165.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -69.87 -0.26 6.97 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -176.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -102.6 98.94 11.95 Favored Pre-proline 0 C--N 1.318 -0.797 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.568 ' O ' ' HG3' ' A' ' 42' ' ' PRO . 46.1 Cg_endo -89.16 9.88 3.41 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.781 2.32 . . . . 0.0 115.897 -169.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -109.71 -37.93 5.53 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 118.616 -1.233 . . . . 0.0 111.813 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm -101.9 -23.0 14.21 Favored 'General case' 0 C--N 1.295 -1.762 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.336 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 67.6 -103.62 1.0 Allowed Glycine 0 C--N 1.337 0.618 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 -177.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 29.8 t -87.49 95.26 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.32 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 173.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -52.7 -29.03 24.55 Favored 'General case' 0 C--N 1.31 -1.15 0 C-N-CA 124.907 1.283 . . . . 0.0 114.393 -170.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -69.51 -20.5 63.71 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.791 0.329 . . . . 0.0 111.721 178.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -117.64 4.8 12.34 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.907 0.861 . . . . 0.0 108.931 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -57.94 -49.06 78.18 Favored Glycine 0 N--CA 1.443 -0.863 0 CA-C-N 114.322 -1.308 . . . . 0.0 113.157 178.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -54.44 -38.74 89.66 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 122.776 2.317 . . . . 0.0 111.852 176.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -63.25 -56.82 13.35 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.737 178.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.48 -51.07 69.85 Favored 'General case' 0 CA--C 1.516 -0.351 0 O-C-N 124.018 0.824 . . . . 0.0 111.943 -176.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.515 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 13.9 p -64.8 -44.46 89.87 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 115.846 -0.616 . . . . 0.0 112.661 -177.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -69.98 -34.81 73.84 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -59.66 -49.22 78.58 Favored 'General case' 0 C--O 1.244 0.767 0 C-N-CA 123.116 0.566 . . . . 0.0 110.758 -177.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.9 m -61.6 -42.02 98.27 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.138 178.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.515 ' HG3' ' O ' ' A' ' 59' ' ' SER . 29.7 mtpp -57.28 -46.79 82.79 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.646 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 97.6 mttt -65.89 -42.43 90.29 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.641 -0.708 . . . . 0.0 111.331 -178.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.1 mmt -64.05 -44.71 91.66 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 123.557 0.536 . . . . 0.0 112.373 -179.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.5 m -72.38 -29.23 30.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -176.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -82.65 -26.97 31.66 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 119.915 -0.714 . . . . 0.0 110.979 178.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -73.08 -27.87 61.97 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.533 ' HA ' ' OD1' ' A' ' 95' ' ' ASP . . . -55.09 121.02 7.85 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 114.63 -1.168 . . . . 0.0 112.481 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.47 ' HD2' ' N ' ' A' ' 70' ' ' LYS . 9.3 mptt -82.88 -31.09 28.07 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 174.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.6 mtpp -127.21 126.97 43.71 Favored 'General case' 0 N--CA 1.426 -1.64 0 N-CA-C 106.945 -1.502 . . . . 0.0 106.945 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.587 ' HB ' ' O ' ' A' ' 12' ' ' ALA . 3.7 mp -113.64 113.15 43.1 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.194 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 178.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.521 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 24.8 mt-10 -113.01 137.46 51.37 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 -177.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.1 m -110.29 127.04 67.53 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 177.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -114.11 140.45 48.48 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.717 -175.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -109.92 116.82 32.31 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 124.204 1.002 . . . . 0.0 110.963 -177.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.416 ' OD2' ' HB ' ' B' ' 133' ' ' THR . 9.1 t70 -88.36 -174.28 4.55 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 176.478 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -60.1 -13.08 10.12 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 113.925 1.083 . . . . 0.0 113.925 -175.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.514 ' N ' HD21 ' B' ' 131' ' ' ASN . . . -76.6 -151.08 3.73 Favored Glycine 0 C--N 1.313 -0.706 0 CA-C-O 121.497 0.499 . . . . 0.0 114.155 -173.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -89.81 155.86 18.88 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 42.4 ttt180 -91.75 -3.51 56.12 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-O 122.357 1.075 . . . . 0.0 108.615 178.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.8 p -115.81 142.86 46.2 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.566 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.409 ' HB3' ' CB ' ' A' ' 87' ' ' ARG . 16.7 t70 -102.2 157.71 16.69 Favored 'General case' 0 C--N 1.311 -1.094 0 C-N-CA 123.022 0.529 . . . . 0.0 111.801 -178.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -61.27 -25.6 67.21 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 126.784 2.034 . . . . 0.0 113.591 -176.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.419 ' HE2' ' NH2' ' A' ' 35' ' ' ARG . 46.4 m-85 -84.33 -3.49 58.29 Favored 'General case' 0 N--CA 1.469 0.494 0 O-C-N 121.734 -0.604 . . . . 0.0 110.788 177.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 93.86 24.33 20.6 Favored Glycine 0 N--CA 1.436 -1.328 0 N-CA-C 109.118 -1.593 . . . . 0.0 109.118 -174.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.409 ' CB ' ' HB3' ' A' ' 83' ' ' ASP . 0.0 OUTLIER -99.33 -171.32 2.05 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 114.474 -0.863 . . . . 0.0 109.119 177.867 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -112.79 144.64 18.02 Favored Glycine 0 N--CA 1.42 -2.403 0 N-CA-C 108.789 -1.724 . . . . 0.0 108.789 171.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 59.4 mt -101.64 110.48 22.48 Favored 'General case' 0 CA--C 1.491 -1.307 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 178.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.12 155.47 32.6 Favored 'General case' 0 C--N 1.294 -1.823 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 177.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . 0.302 54.2 p90 -110.06 140.84 43.68 Favored 'General case' 0 N--CA 1.424 -1.746 0 C-N-CA 119.241 -0.983 . . . . 0.0 112.456 176.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 34.4 mm -98.92 131.0 46.96 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 CA-C-N 115.551 -0.749 . . . . 0.0 112.695 -166.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.521 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 82.8 m-85 -107.66 127.67 53.87 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 168.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.426 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -105.15 99.4 9.02 Favored 'General case' 0 C--N 1.289 -2.05 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 176.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.533 ' OD1' ' HA ' ' A' ' 69' ' ' ALA . 6.2 p-10 45.01 41.72 5.68 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.09 1.356 . . . . 0.0 113.191 -178.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.95 -23.39 27.74 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.293 -0.867 . . . . 0.0 113.337 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -87.52 113.65 23.4 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . 0.484 ' HE3' ' HB2' ' A' ' 101' ' ' GLU . 52.2 ttp -74.99 105.42 6.0 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 45.2 t -64.12 -29.82 48.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-O 121.679 0.752 . . . . 0.0 109.665 -175.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -61.08 -40.07 92.32 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.067 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.506 ' OE2' ' HD3' ' A' ' 105' ' ' ARG . 11.4 tp10 -64.94 -54.05 36.75 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 114.883 -1.053 . . . . 0.0 108.338 176.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -53.1 -48.38 67.84 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.112 -0.949 . . . . 0.0 113.129 -176.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.406 HD12 HD22 ' A' ' 36' ' ' LEU . 85.1 mt -59.87 -48.14 82.89 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 78.7 t -73.01 -35.06 47.57 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 CA-C-O 120.981 0.42 . . . . 0.0 110.292 -178.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.506 ' HD3' ' OE2' ' A' ' 101' ' ' GLU . 4.0 tpt180 -65.5 -41.05 93.65 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 123.388 0.675 . . . . 0.0 110.174 -178.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -83.99 -3.1 57.75 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.887 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.98 39.05 85.31 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 121.077 -0.582 . . . . 0.0 112.744 178.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 92.3 mt -102.17 4.4 39.43 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-O 121.938 0.875 . . . . 0.0 109.586 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -165.18 165.36 19.8 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 114.513 -1.221 . . . . 0.0 107.862 178.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.4 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 83.1 mttt -111.53 165.75 11.73 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 174.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.457 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 78.1 t -76.76 136.46 24.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 C-N-CA 120.023 -0.671 . . . . 0.0 109.631 177.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.65 149.47 23.51 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.976 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 55.5 t80 -71.75 146.99 47.77 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.046 -178.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.401 HG11 ' HB2' ' B' ' 131' ' ' ASN . 27.0 m -88.16 128.32 40.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-O 121.556 0.694 . . . . 0.0 110.918 -178.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -97.18 85.65 3.75 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -174.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.494 ' HB2' ' HB3' ' B' ' 130' ' ' PRO . 64.4 mmtt -127.61 109.15 20.74 Favored Pre-proline 0 C--N 1.299 -1.601 0 CA-C-N 113.698 -1.592 . . . . 0.0 109.093 173.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -78.41 -149.07 0.03 OUTLIER 'Trans proline' 0 C--O 1.244 0.822 0 C-N-CA 122.74 2.293 . . . . 0.0 109.364 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -79.68 46.12 0.74 Allowed 'General case' 0 CA--C 1.559 1.318 0 CA-C-O 122.334 1.064 . . . . 0.0 109.73 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -84.56 -17.91 37.33 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 174.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.1 p -83.94 19.52 1.73 Allowed 'General case' 0 N--CA 1.431 -1.409 0 CA-C-N 113.352 -1.749 . . . . 0.0 109.901 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 . . . . . 0 N--CA 1.44 -0.931 0 C-N-CA 124.895 1.278 . . . . 0.0 109.944 -176.371 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.497 -1.05 0 N-CA-C 110.382 -1.087 . . . . 0.0 110.382 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 27.0 m -72.45 -48.74 38.63 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 117.132 0.466 . . . . 0.0 110.648 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 27.4 m -89.92 153.47 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.707 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 177.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -76.44 139.6 40.94 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 176.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 24.1 p90 -70.56 -41.56 72.27 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 119.957 -0.697 . . . . 0.0 109.814 -177.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 46.4 t 61.6 118.17 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.346 0.454 0 C-N-CA 125.077 1.351 . . . . 0.0 111.438 -179.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -85.78 110.81 19.62 Favored 'General case' 0 N--CA 1.422 -1.83 0 C-N-CA 118.652 -1.219 . . . . 0.0 108.459 176.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -100.57 161.47 23.84 Favored Pre-proline 0 C--N 1.287 -2.109 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.356 -178.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . 0.494 ' HB3' ' HB2' ' A' ' 116' ' ' LYS . 79.0 Cg_exo -55.21 -159.65 0.01 OUTLIER 'Trans proline' 0 N--CA 1.494 1.543 0 C-N-CA 124.473 3.449 . . . . 0.0 115.309 178.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 131' ' ' ASN . . . . . 0.514 HD21 ' N ' ' A' ' 79' ' ' GLY . 2.1 m-20 -63.51 99.45 0.21 Allowed 'General case' 0 C--O 1.213 -0.836 0 CA-C-N 115.198 -0.91 . . . . 0.0 108.684 175.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.437 ' HA ' ' HB3' ' B' ' 135' ' ' GLU . 15.4 m120 -110.08 -8.61 14.78 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 173.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 133' ' ' THR . . . . . 0.416 ' HB ' ' OD2' ' A' ' 77' ' ' ASP . 0.2 OUTLIER -43.91 -61.34 1.48 Allowed 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 127.306 2.242 . . . . 0.0 112.092 -173.591 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -116.91 3.74 12.86 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-O 120.973 0.416 . . . . 0.0 111.359 176.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.548 ' OE2' ' HD2' ' B' ' 139' ' ' ARG . 2.4 tm-20 -69.15 -47.92 63.72 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.373 -178.527 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -63.84 -33.32 75.43 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.354 0.597 . . . . 0.0 110.516 176.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 78.8 mt -70.41 -50.57 37.19 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.729 -177.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.21 -33.6 75.71 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.713 0.292 . . . . 0.0 111.586 177.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 139' ' ' ARG . . . . . 0.548 ' HD2' ' OE2' ' B' ' 135' ' ' GLU . 84.2 mtt180 -66.81 -27.92 67.95 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 177.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 28.5 ttpp -71.37 -39.88 70.96 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 177.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 15.2 m -62.39 -45.66 92.15 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-N 114.832 -1.076 . . . . 0.0 109.249 175.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.525 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 40.2 tt0 -59.44 -48.08 83.01 Favored 'General case' 0 C--O 1.204 -1.291 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.652 177.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -56.65 -40.97 76.42 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 122.693 0.397 . . . . 0.0 110.993 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -67.78 -47.37 69.34 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.04 178.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -64.15 -34.06 77.21 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.707 -178.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 146' ' ' LYS . . . . . 0.525 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 89.8 mttt -61.87 -46.88 87.48 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 177.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -69.85 -35.41 74.71 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.222 -177.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 59.7 mm-40 -74.36 -17.25 60.85 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.195 177.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 45.7 mtpt 57.03 56.51 5.25 Favored 'General case' 0 CA--C 1.514 -0.424 0 C-N-CA 124.785 1.234 . . . . 0.0 110.49 -178.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 91.8 mt -91.55 121.37 33.18 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.76 -176.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 51.24 -92.51 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 125.481 1.513 . . . . 0.0 113.898 178.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 24.5 mt -65.2 -33.98 67.37 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.899 0 CA-C-O 121.058 0.456 . . . . 0.0 110.979 179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 153' ' ' TRP . . . . . 0.518 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 63.7 m95 -75.96 -6.09 49.31 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.573 0.701 . . . . 0.0 111.465 -177.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 42.3 t -92.72 16.31 12.57 Favored 'General case' 0 N--CA 1.425 -1.704 0 CA-C-N 115.433 -0.803 . . . . 0.0 108.916 174.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -63.03 -21.79 66.41 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 121.494 0.664 . . . . 0.0 110.11 174.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 . . . . . 0 N--CA 1.427 -1.592 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 176.989 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.295 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 33.2 m -143.51 110.04 5.48 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 29.4 m -147.25 138.17 23.69 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 177.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.1 m -149.58 -84.22 0.09 Allowed 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -145.77 20.61 1.47 Allowed 'General case' 0 CA--C 1.55 0.976 0 CA-C-O 121.662 0.744 . . . . 0.0 110.449 -174.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -150.47 163.34 38.67 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 178.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.458 HD13 ' HA ' ' A' ' 77' ' ' ASP . 4.9 mp -117.59 -160.19 0.77 Allowed 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 177.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 83.8 t60 -91.95 139.53 30.56 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 121.277 0.56 . . . . 0.0 112.035 -176.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.408 ' HB3' ' HB2' ' A' ' 75' ' ' GLU . 62.2 pttt -116.13 159.62 21.5 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.042 176.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -134.71 159.8 70.81 Favored Pre-proline 0 C--N 1.3 -1.551 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 178.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -81.68 140.51 11.75 Favored 'Trans proline' 0 C--O 1.244 0.824 0 C-N-CA 123.007 2.472 . . . . 0.0 111.138 175.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -127.64 162.87 25.51 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.805 178.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.501 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 36.5 m -98.16 131.47 44.51 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 179.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 54.6 tp -84.28 122.19 28.55 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 -179.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 72.4 mt -93.0 -59.74 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.501 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -161.22 143.58 12.24 Favored 'General case' 0 N--CA 1.416 -2.128 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.055 -178.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.478 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -96.25 108.31 20.77 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 105.966 -1.864 . . . . 0.0 105.966 171.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 70.6 mt -81.85 -53.87 11.08 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.417 0 CA-C-O 121.345 0.593 . . . . 0.0 110.795 -173.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.534 ' HB2' ' H ' ' A' ' 22' ' ' THR . 11.8 m-20 -128.55 -175.35 3.5 Favored 'General case' 0 C--N 1.295 -1.803 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 -179.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -94.98 46.43 2.06 Favored Glycine 0 C--N 1.304 -1.218 0 N-CA-C 108.571 -1.812 . . . . 0.0 108.571 173.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.586 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 9.6 t70 -171.48 -52.74 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 105.926 -1.879 . . . . 0.0 105.926 -172.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.534 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 1.3 m -91.54 118.49 30.64 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 113.868 -1.514 . . . . 0.0 110.56 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.4 m -133.16 151.04 33.27 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.931 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 177.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -116.03 116.04 27.18 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 -177.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.9 mp -123.93 159.06 30.55 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.274 0.559 . . . . 0.0 111.028 -177.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.501 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 57.2 ttp -120.67 111.83 18.12 Favored 'General case' 0 C--N 1.293 -1.862 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 175.127 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 44.1 p90 -106.93 110.34 22.46 Favored 'General case' 0 CA--C 1.485 -1.523 0 C-N-CA 119.163 -1.015 . . . . 0.0 110.748 -178.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 97.2 mttt 53.43 38.99 29.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.716 -178.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.497 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 95.26 2.18 62.25 Favored Glycine 0 N--CA 1.448 -0.535 0 CA-C-N 113.796 -1.547 . . . . 0.0 113.766 177.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.438 ' O ' ' HA ' ' A' ' 26' ' ' MET . 2.4 mp0 -100.48 97.56 6.69 Favored Pre-proline 0 C--N 1.32 -0.703 0 CA-C-N 117.0 0.4 . . . . 0.0 110.545 177.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.497 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 1.8 Cg_endo -83.39 105.51 1.27 Allowed 'Trans proline' 0 C--O 1.243 0.743 0 C-N-CA 122.964 2.443 . . . . 0.0 111.192 179.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 66.3 mtt -129.32 153.18 48.1 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.082 0.467 . . . . 0.0 110.385 -177.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.8 m -89.67 119.72 30.32 Favored 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 107.646 -1.242 . . . . 0.0 107.646 178.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -101.52 150.18 23.33 Favored 'General case' 0 C--N 1.282 -2.357 0 CA-C-O 121.654 0.74 . . . . 0.0 111.629 -176.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.615 ' HB2' ' NH1' ' A' ' 87' ' ' ARG . 9.7 mmt85 -127.43 127.07 43.51 Favored 'General case' 0 C--N 1.283 -2.295 0 N-CA-C 103.541 -2.763 . . . . 0.0 103.541 171.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.426 ' HB3' ' HB3' ' A' ' 100' ' ' ASN . 9.3 mt -68.72 133.08 47.89 Favored 'General case' 0 C--N 1.289 -2.038 0 O-C-N 123.709 0.631 . . . . 0.0 109.995 -173.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.4 mt -61.4 137.03 58.23 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.891 176.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.457 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 67.5 mt 73.92 14.35 4.02 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 124.391 1.057 . . . . 0.0 113.056 175.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 85.3 t -110.74 126.46 68.08 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.569 0 CA-C-O 121.109 0.48 . . . . 0.0 110.662 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -125.01 108.24 11.63 Favored 'General case' 0 C--N 1.303 -1.439 0 CA-C-N 115.421 -0.808 . . . . 0.0 109.549 175.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.401 ' HB ' ' O ' ' A' ' 43' ' ' GLU . 1.5 p -88.31 126.54 60.17 Favored Pre-proline 0 C--N 1.29 -1.985 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.935 176.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -78.53 -24.85 7.21 Favored 'Trans proline' 0 C--O 1.236 0.402 0 C-N-CA 121.988 1.792 . . . . 0.0 110.373 178.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.401 ' O ' ' HB ' ' A' ' 41' ' ' THR . 55.1 mt-10 -130.14 151.96 50.1 Favored 'General case' 0 N--CA 1.407 -2.582 0 CA-C-N 114.363 -1.29 . . . . 0.0 107.549 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.456 ' H ' HG11 ' A' ' 51' ' ' VAL . 6.9 t -145.92 164.49 31.84 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 107.214 -1.402 . . . . 0.0 107.214 -174.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.76 -8.68 37.64 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -176.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -59.52 117.84 26.01 Favored Pre-proline 0 C--N 1.315 -0.916 0 C-N-CA 123.618 0.767 . . . . 0.0 110.478 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -62.68 156.33 53.61 Favored 'Trans proline' 0 C--O 1.247 0.954 0 C-N-CA 122.974 2.449 . . . . 0.0 112.467 -179.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.623 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 5.5 mmpt? 82.26 2.16 1.3 Allowed 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 125.41 1.484 . . . . 0.0 113.102 179.155 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.513 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 8.7 mmpt? -95.15 -7.6 38.77 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.207 178.211 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 59.0 47.72 89.41 Favored Glycine 0 N--CA 1.469 0.836 0 CA-C-N 116.101 -0.5 . . . . 0.0 112.287 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.456 HG11 ' H ' ' A' ' 44' ' ' THR . 27.0 m -80.77 65.48 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 CA-C-O 122.933 1.349 . . . . 0.0 112.214 -174.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -92.57 -15.68 26.64 Favored 'General case' 0 C--N 1.29 -2.011 0 CA-C-N 114.462 -1.244 . . . . 0.0 112.528 -176.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.538 ' HE2' ' HA ' ' A' ' 53' ' ' LYS . 7.2 mmpt? -87.72 -66.49 0.91 Allowed 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 113.475 0.916 . . . . 0.0 113.475 -169.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -121.05 -18.03 7.62 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.326 -171.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -48.8 -58.6 7.46 Favored Glycine 0 CA--C 1.538 1.492 0 CA-C-O 119.077 -0.846 . . . . 0.0 114.844 -178.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -60.09 -38.99 73.65 Favored 'Trans proline' 0 C--N 1.366 1.462 0 C-N-CA 122.65 2.233 . . . . 0.0 112.663 -179.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -62.43 -47.9 82.03 Favored 'General case' 0 C--O 1.245 0.868 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.624 -177.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.93 -43.79 87.05 Favored 'General case' 0 C--O 1.242 0.709 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.772 -179.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.407 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 22.7 p -64.8 -46.07 83.6 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -67.86 -36.04 79.6 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 120.589 0.233 . . . . 0.0 111.421 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -61.49 -47.37 85.93 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.076 178.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.443 ' O ' HG22 ' A' ' 66' ' ' VAL . 40.8 m -60.47 -44.93 95.39 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.688 -178.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.478 ' HG2' ' HB3' ' A' ' 17' ' ' ALA . 44.4 mtpt -59.22 -49.79 76.51 Favored 'General case' 0 C--N 1.345 0.402 0 O-C-N 123.23 0.331 . . . . 0.0 110.468 178.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -55.42 -44.48 76.29 Favored 'General case' 0 C--O 1.221 -0.442 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.986 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.9 mmt -71.02 -38.38 72.6 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -177.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.443 HG22 ' O ' ' A' ' 62' ' ' THR . 35.3 m -80.67 -31.83 12.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 -178.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -76.09 -27.71 57.28 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 121.4 0.619 . . . . 0.0 110.36 177.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -67.42 -31.39 71.56 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.905 176.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.539 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -69.89 131.31 44.25 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.737 -177.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -78.95 -41.34 29.56 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 171.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.3 mtmt -113.96 131.42 56.33 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 114.832 -1.076 . . . . 0.0 108.664 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 3.9 mp -111.43 117.92 56.24 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.364 0 N-CA-C 105.221 -2.14 . . . . 0.0 105.221 174.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.536 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 23.2 mt-10 -112.75 140.01 47.89 Favored 'General case' 0 C--N 1.295 -1.776 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.875 -172.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.48 HG12 ' CD1' ' A' ' 92' ' ' ILE . 10.1 m -116.38 117.66 56.23 Favored 'Isoleucine or valine' 0 C--O 1.25 1.092 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.398 178.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.408 ' HB2' ' HB3' ' A' ' 9' ' ' LYS . 23.8 tt0 -109.14 143.5 38.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.842 0.353 . . . . 0.0 111.188 -176.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.413 ' O ' ' HB2' ' A' ' 7' ' ' LEU . 47.0 t80 -94.14 147.81 22.79 Favored 'General case' 0 N--CA 1.436 -1.141 0 C-N-CA 124.7 1.2 . . . . 0.0 110.31 -176.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.74 ' OD1' ' HA ' ' B' ' 131' ' ' ASN . 11.8 t70 -116.29 -175.81 2.82 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 176.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -65.52 -26.73 68.03 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.409 0.684 . . . . 0.0 112.16 -175.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -72.64 -115.43 0.06 OUTLIER Glycine 0 N--CA 1.445 -0.719 0 CA-C-N 115.888 -0.596 . . . . 0.0 113.436 -177.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -124.64 165.09 18.51 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 122.28 -0.541 . . . . 0.0 109.761 -178.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 44.2 ttt85 -104.65 -13.18 16.04 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-O 121.783 0.801 . . . . 0.0 108.987 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.8 p -133.07 133.29 42.8 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.176 178.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 48.4 t0 -87.85 144.87 26.35 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 179.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -68.33 -16.71 64.04 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 121.395 0.617 . . . . 0.0 109.946 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -65.36 -30.31 71.12 Favored 'General case' 0 C--O 1.221 -0.429 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 173.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 105.21 49.65 0.98 Allowed Glycine 0 N--CA 1.437 -1.252 0 CA-C-N 115.718 -0.673 . . . . 0.0 111.506 -178.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.615 ' NH1' ' HB2' ' A' ' 35' ' ' ARG . 0.8 OUTLIER -151.25 160.37 43.86 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 179.521 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -80.82 144.89 25.54 Favored Glycine 0 C--N 1.305 -1.185 0 C-N-CA 121.031 -0.604 . . . . 0.0 113.281 -177.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.0 mt -117.48 97.9 6.12 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 108.172 -1.048 . . . . 0.0 108.172 177.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.63 161.64 39.89 Favored 'General case' 0 C--N 1.313 -0.999 0 C-N-CA 120.223 -0.591 . . . . 0.0 111.414 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -88.86 127.4 35.63 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 105.951 -1.87 . . . . 0.0 105.951 170.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.48 ' CD1' HG12 ' A' ' 74' ' ' VAL . 45.7 mm -99.55 123.75 52.48 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.072 -179.405 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.536 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 77.5 m-85 -109.18 132.51 54.05 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 175.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.539 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -105.35 100.54 10.11 Favored 'General case' 0 C--N 1.285 -2.234 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 176.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.498 ' OD2' ' HA ' ' A' ' 69' ' ' ALA . 3.0 p30 46.32 29.97 0.95 Allowed 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 124.928 1.291 . . . . 0.0 113.472 -174.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.44 -9.8 38.67 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.852 -0.613 . . . . 0.0 113.435 -179.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -83.53 121.87 27.79 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 175.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 34.2 ttp -80.68 99.47 8.2 Favored 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 179.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 48.7 t -58.36 -43.62 86.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-N 114.781 -1.1 . . . . 0.0 112.795 -169.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.426 ' HB3' ' HB3' ' A' ' 36' ' ' LEU . 24.7 p-10 -66.5 -31.4 72.1 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.499 -176.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -77.61 -40.64 41.35 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.94 -39.25 77.58 Favored 'General case' 0 C--O 1.222 -0.351 0 O-C-N 123.741 0.651 . . . . 0.0 110.737 179.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.17 -44.66 94.83 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.915 177.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 95.0 t -70.26 -47.57 66.19 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.302 -178.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 11.5 ttp85 -60.45 -37.82 82.2 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 177.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -82.3 0.93 39.31 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-O 120.678 0.275 . . . . 0.0 111.575 177.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.85 38.06 93.95 Favored Glycine 0 C--O 1.221 -0.712 0 CA-C-N 116.276 -0.42 . . . . 0.0 113.688 177.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 87.4 mt -100.62 -13.66 18.48 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.377 0.608 . . . . 0.0 110.22 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -152.13 160.19 43.47 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -105.56 164.15 12.11 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 106.759 -1.571 . . . . 0.0 106.759 177.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.457 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 82.5 t -71.38 128.39 34.44 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 C-N-CA 120.134 -0.626 . . . . 0.0 109.507 177.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.48 146.38 25.22 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 176.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -80.14 149.37 30.59 Favored 'General case' 0 C--N 1.289 -2.039 0 CA-C-O 121.383 0.611 . . . . 0.0 111.692 -172.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 71.6 t -87.61 119.03 34.55 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.611 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.906 -173.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -80.27 137.74 36.67 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 115.356 -0.838 . . . . 0.0 108.859 176.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -84.07 126.38 70.21 Favored Pre-proline 0 C--N 1.292 -1.899 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -172.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -87.02 -163.76 0.18 Allowed 'Trans proline' 0 N--CA 1.444 -1.403 0 C-N-CA 122.572 2.181 . . . . 0.0 106.903 167.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -108.22 -57.36 2.13 Favored 'General case' 0 C--N 1.288 -2.068 0 C-N-CA 118.839 -1.144 . . . . 0.0 110.201 177.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 61.85 76.95 0.35 Allowed 'General case' 0 C--O 1.25 1.105 0 CA-C-O 122.818 1.294 . . . . 0.0 110.166 -176.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.1 m -69.29 95.64 0.79 Allowed 'General case' 0 N--CA 1.422 -1.871 0 CA-C-N 112.737 -2.029 . . . . 0.0 111.599 -174.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 9.7 t-80 . . . . . 0 C--O 1.246 0.874 0 C-N-CA 125.37 1.468 . . . . 0.0 107.37 174.716 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.686 0 N-CA-C 111.17 -0.772 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 61.8 p 51.88 -89.1 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.136 1.774 . . . . 0.0 114.178 179.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 22.3 m -82.53 -32.24 10.18 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.679 0 CA-C-O 120.777 0.322 . . . . 0.0 111.112 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -106.38 94.87 5.38 Favored 'General case' 0 N--CA 1.428 -1.53 0 CA-C-O 121.205 0.526 . . . . 0.0 109.969 -177.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.6 p90 -143.65 15.54 1.79 Allowed 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 177.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 18.9 m -64.82 122.16 15.2 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.089 0 N-CA-C 115.019 1.488 . . . . 0.0 115.019 -169.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.27 99.07 8.42 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.134 170.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -65.34 -35.62 12.67 Favored Pre-proline 0 C--N 1.296 -1.759 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -58.53 -176.04 0.08 OUTLIER 'Trans proline' 0 C--N 1.384 2.398 0 C-N-CA 122.028 1.819 . . . . 0.0 114.898 176.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 131' ' ' ASN . . . . . 0.74 ' HA ' ' OD1' ' A' ' 77' ' ' ASP . 15.6 m120 -64.45 118.16 8.35 Favored 'General case' 0 CA--C 1.5 -0.979 0 CA-C-N 114.958 -1.019 . . . . 0.0 110.612 -178.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.465 ' HA ' ' CB ' ' B' ' 135' ' ' GLU . 2.3 p-10 -152.01 -2.84 0.28 Allowed 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -179.03 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 133' ' ' THR . . . . . 0.429 HG21 ' CD1' ' A' ' 7' ' ' LEU . 69.3 p -60.63 -48.75 80.38 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -170.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -112.01 5.03 18.49 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.465 ' CB ' ' HA ' ' B' ' 132' ' ' ASN . 0.9 OUTLIER -65.3 -38.7 91.02 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.988 -1.005 . . . . 0.0 109.689 -175.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -61.79 -33.92 74.96 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.981 178.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 88.4 mt -66.12 -46.43 77.57 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.618 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 7.8 mp -65.98 -29.13 69.46 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.367 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -61.85 -41.41 97.79 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.334 0.587 . . . . 0.0 109.866 175.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -70.65 -39.73 73.46 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.32 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 50.3 m -63.88 -46.18 86.05 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.487 177.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.586 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 41.7 tt0 -61.73 -50.75 71.18 Favored 'General case' 0 C--O 1.204 -1.326 0 O-C-N 123.469 0.481 . . . . 0.0 109.825 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.15 -38.15 73.12 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 123.48 0.488 . . . . 0.0 111.243 -179.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 144' ' ' GLN . . . . . 0.499 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 14.6 tt0 -66.47 -48.81 68.72 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -65.34 -33.61 76.39 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.483 -176.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 146' ' ' LYS . . . . . 0.586 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 88.1 mttt -59.33 -51.33 70.38 Favored 'General case' 0 C--N 1.345 0.409 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 176.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -69.7 -34.41 73.88 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.375 -0.83 . . . . 0.0 112.052 -177.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 57.6 mm-40 -74.08 -18.63 60.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.644 177.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 23.4 mtpp 59.28 48.17 10.55 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 125.234 1.414 . . . . 0.0 110.437 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 99.4 mt -84.45 119.99 25.78 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.233 -175.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 53.9 -93.43 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.229 0 O-C-N 124.781 1.3 . . . . 0.0 112.6 176.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 152' ' ' ILE . . . . . 0.509 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 29.5 mt -60.34 -43.8 94.5 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.654 0 C-N-CA 122.121 0.168 . . . . 0.0 111.331 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -71.48 -4.03 24.36 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.987 0.899 . . . . 0.0 112.774 -172.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 27.9 t -80.35 -5.23 56.05 Favored 'General case' 0 C--N 1.291 -1.942 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.45 171.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 21.4 pt-20 -69.93 -25.08 63.49 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 121.543 0.687 . . . . 0.0 109.704 175.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.5 t70 . . . . . 0 C--N 1.309 -1.166 0 CA-C-N 114.843 -1.072 . . . . 0.0 109.654 -178.175 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.453 0 CA-C-O 121.052 0.453 . . . . 0.0 110.235 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.457 HG22 HG22 ' A' ' 4' ' ' THR . 14.2 m -80.63 104.24 11.02 Favored 'General case' 0 N--CA 1.432 -1.338 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.7 m -84.5 76.29 10.18 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-O 121.944 0.878 . . . . 0.0 113.037 -174.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.457 HG22 HG22 ' A' ' 2' ' ' THR . 5.7 t -158.26 71.46 0.58 Allowed 'General case' 0 N--CA 1.415 -2.187 0 CA-C-O 122.785 1.279 . . . . 0.0 110.429 174.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.613 ' HE2' ' HA ' ' A' ' 5' ' ' LYS . 7.0 mmpt? -107.02 19.08 20.95 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 172.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -155.0 159.56 40.42 Favored 'General case' 0 N--CA 1.413 -2.322 0 N-CA-C 102.408 -3.182 . . . . 0.0 102.408 177.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 91.0 mt -95.62 173.48 7.46 Favored 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 119.967 -0.693 . . . . 0.0 112.214 -176.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 45.3 m80 -79.3 104.01 9.63 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.87 -178.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.7 ttmt -105.14 127.1 52.75 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 172.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -114.0 149.35 41.76 Favored Pre-proline 0 C--N 1.296 -1.749 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 173.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -80.16 141.1 14.41 Favored 'Trans proline' 0 C--N 1.311 -1.408 0 C-N-CA 121.928 1.752 . . . . 0.0 110.399 174.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.447 ' HB1' ' HB3' ' A' ' 25' ' ' LEU . . . -136.19 155.98 49.35 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 121.103 0.477 . . . . 0.0 112.156 -178.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.415 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 72.7 m -111.86 140.76 46.25 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 176.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.446 ' HB2' ' CD1' ' A' ' 72' ' ' ILE . 52.3 tp -83.14 125.48 31.56 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 118.312 0.505 . . . . 0.0 110.424 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 44.5 mm -89.18 -53.18 9.84 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 174.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -164.36 145.83 8.44 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -105.99 119.44 39.19 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 49.5 mm -90.56 -55.77 5.88 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -177.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.497 ' HB2' ' H ' ' A' ' 22' ' ' THR . 32.4 m-20 -125.83 -166.56 1.58 Allowed 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -85.2 -13.61 70.88 Favored Glycine 0 C--O 1.21 -1.397 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 173.038 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.579 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 0.4 OUTLIER -101.29 -54.03 2.87 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 122.485 1.136 . . . . 0.0 108.099 -178.864 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.497 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 6.8 m -82.49 105.81 13.85 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 114.268 -1.333 . . . . 0.0 111.334 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.3 m -129.27 137.27 57.46 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.609 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 177.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.505 ' HA ' ' HA ' ' A' ' 33' ' ' THR . 46.6 tttp -101.19 119.1 38.24 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.61 -0.682 . . . . 0.0 110.144 -176.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.447 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 3.3 mm? -116.25 146.73 42.13 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 121.453 0.644 . . . . 0.0 110.765 -177.464 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.484 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 26.5 ttt -107.01 108.59 20.17 Favored 'General case' 0 C--N 1.286 -2.17 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 175.019 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 10.8 p90 -115.55 116.88 28.91 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 -177.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 99.3 mttt 57.51 32.59 22.04 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 124.131 0.895 . . . . 0.0 110.921 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.96 3.76 61.87 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 114.738 -1.119 . . . . 0.0 114.142 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.484 ' O ' ' HA ' ' A' ' 26' ' ' MET . 20.3 mt-30 -107.53 103.86 50.53 Favored Pre-proline 0 C--N 1.311 -1.08 0 O-C-N 122.401 -0.47 . . . . 0.0 111.224 -179.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -80.85 95.26 0.97 Allowed 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 122.757 2.304 . . . . 0.0 111.268 177.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 26.5 mmt -119.78 145.49 46.53 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.745 -176.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.505 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 11.4 m -86.52 118.76 26.15 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -109.21 162.07 14.64 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 123.551 0.74 . . . . 0.0 111.071 -176.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.579 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 20.7 mtp180 -133.23 142.6 48.65 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 169.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.6 mp -61.48 119.55 8.8 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -175.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 18.1 mt -55.36 128.08 32.52 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.767 176.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 87.0 mt 68.17 23.2 8.0 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 124.829 1.331 . . . . 0.0 112.211 174.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.524 ' O ' ' HB ' ' A' ' 44' ' ' THR . 90.6 t -128.75 131.53 68.42 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.155 0 O-C-N 122.101 -0.374 . . . . 0.0 110.301 -179.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -107.33 106.87 17.51 Favored 'General case' 0 N--CA 1.434 -1.24 0 N-CA-C 105.634 -1.987 . . . . 0.0 105.634 168.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.64 ' HB ' ' CD ' ' A' ' 42' ' ' PRO . 11.5 m -83.23 -77.82 0.04 OUTLIER Pre-proline 0 CA--C 1.567 1.612 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 175.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.64 ' CD ' ' HB ' ' A' ' 41' ' ' THR . 38.0 Cg_endo -80.26 -27.65 3.46 Favored 'Trans proline' 0 C--N 1.39 2.711 0 N-CA-C 107.588 -1.735 . . . . 0.0 107.588 164.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.41 ' OE2' ' HG2' ' A' ' 42' ' ' PRO . 0.1 OUTLIER 174.15 173.79 0.18 Allowed 'General case' 0 N--CA 1.423 -1.781 0 C-N-CA 128.262 2.625 . . . . 0.0 104.033 177.486 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.524 ' HB ' ' O ' ' A' ' 39' ' ' VAL . 12.0 t -110.14 -51.97 2.82 Favored 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 119.579 -0.848 . . . . 0.0 108.785 167.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -98.52 -51.82 3.82 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 175.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -148.19 135.38 10.49 Favored Pre-proline 0 C--N 1.314 -0.942 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 -178.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -61.79 119.9 7.25 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.382 2.054 . . . . 0.0 111.543 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 41.0 mtmt -88.53 -50.32 6.36 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.025 -176.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.508 ' NZ ' ' HA ' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -113.81 -28.51 7.39 Favored 'General case' 0 CA--C 1.49 -1.352 0 C-N-CA 120.315 -0.554 . . . . 0.0 111.978 174.804 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 97.21 108.12 2.56 Favored Glycine 0 N--CA 1.414 -2.797 0 N-CA-C 109.921 -1.272 . . . . 0.0 109.921 -175.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.448 ' HB ' ' HA ' ' A' ' 42' ' ' PRO . 27.3 t -97.84 30.53 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.175 0 CA-C-O 123.655 1.693 . . . . 0.0 106.638 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -40.9 -43.62 2.12 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 128.686 2.794 . . . . 0.0 113.296 -178.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 37.5 mtmm -86.88 -22.87 25.47 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -175.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -104.16 -24.66 13.14 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 120.769 -0.372 . . . . 0.0 111.952 -173.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.45 ' N ' ' HD2' ' A' ' 56' ' ' PRO . . . -47.97 -51.78 18.26 Favored Glycine 0 CA--C 1.534 1.254 0 O-C-N 123.9 0.75 . . . . 0.0 113.322 177.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' ' 55' ' ' GLY . 4.7 Cg_endo -49.64 -34.31 34.3 Favored 'Trans proline' 0 CA--C 1.553 1.427 0 C-N-CA 123.44 2.76 . . . . 0.0 114.016 175.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -83.39 -39.4 20.7 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 121.864 -0.523 . . . . 0.0 110.921 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.95 -40.25 94.74 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.929 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.437 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 9.0 p -65.33 -43.53 90.65 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.461 179.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.92 -47.38 85.24 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 123.614 0.571 . . . . 0.0 109.885 177.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -57.26 -49.83 74.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.14 178.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 36.8 m -59.94 -50.83 72.2 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.827 -177.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.518 ' HE3' ' OE1' ' A' ' 67' ' ' GLU 0.339 0.1 OUTLIER -64.38 -38.23 90.3 Favored 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -179.482 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.411 ' HG3' ' HD3' ' A' ' 63' ' ' LYS . 28.9 mtpp -66.45 -40.67 89.55 Favored 'General case' 0 N--CA 1.436 -1.169 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 177.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 14.7 tpt -62.68 -45.85 90.87 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.266 -178.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.8 m -80.71 -31.44 12.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 113.494 0.924 . . . . 0.0 113.494 -176.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.518 ' OE1' ' HE3' ' A' ' 63' ' ' LYS . 45.1 mt-10 -77.66 -33.42 53.41 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.239 -0.585 . . . . 0.0 111.146 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -78.1 -20.81 51.46 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.461 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -64.22 147.74 51.68 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.793 179.143 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -71.12 -61.34 1.8 Allowed 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.853 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.0 mtmm -125.55 150.91 47.04 Favored 'General case' 0 CA--C 1.502 -0.899 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 178.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.446 ' CD1' ' HB2' ' A' ' 14' ' ' LEU . 69.2 mt -105.58 134.26 47.6 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.231 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 175.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.547 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 1.5 mm-40 -111.92 133.24 54.24 Favored 'General case' 0 N--CA 1.424 -1.771 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -178.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 31.4 m -111.52 118.19 56.91 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 174.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -114.22 137.33 51.91 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-O 121.153 0.501 . . . . 0.0 109.756 -178.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -106.86 138.99 41.99 Favored 'General case' 0 C--N 1.282 -2.338 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.176 -178.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.563 ' HB3' ' OD1' ' B' ' 131' ' ' ASN . 6.0 t70 -86.51 -174.27 4.92 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 -179.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -76.31 -2.5 31.9 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -176.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.59 -119.25 1.15 Allowed Glycine 0 N--CA 1.442 -0.927 0 C-N-CA 121.576 -0.345 . . . . 0.0 112.857 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 70.6 mm-40 -99.75 164.04 12.21 Favored 'General case' 0 C--N 1.293 -1.869 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -175.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -108.89 -37.96 5.72 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 14.6 p -141.14 150.18 42.47 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.363 -0.835 . . . . 0.0 108.827 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -100.89 155.88 17.7 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -57.83 -28.51 64.16 Favored 'General case' 0 C--O 1.247 0.946 0 C-N-CA 125.496 1.519 . . . . 0.0 111.722 -178.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -66.5 -19.41 65.78 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.495 -177.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 92.01 64.33 1.14 Allowed Glycine 0 CA--C 1.487 -1.684 0 N-CA-C 108.434 -1.866 . . . . 0.0 108.434 -176.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.416 ' HD3' ' O ' ' A' ' 33' ' ' THR . 3.3 tpp180 -161.46 127.55 3.77 Favored 'General case' 0 N--CA 1.415 -2.176 0 N-CA-C 106.759 -1.571 . . . . 0.0 106.759 -175.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -78.66 151.58 36.11 Favored Glycine 0 N--CA 1.428 -1.867 0 N-CA-C 111.209 -0.757 . . . . 0.0 111.209 -179.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 85.6 mt -119.94 105.04 10.68 Favored 'General case' 0 C--N 1.288 -2.093 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -138.76 152.48 47.98 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-O 121.279 0.561 . . . . 0.0 111.689 -176.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -95.21 123.57 38.79 Favored 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 105.078 -2.193 . . . . 0.0 105.078 175.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 47.4 mm -99.27 129.06 50.29 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 CA-C-O 121.452 0.644 . . . . 0.0 112.131 -171.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.547 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 26.1 m-85 -114.83 142.94 45.87 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 172.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.461 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -105.38 98.85 8.49 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 175.411 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.4 t70 45.71 40.04 5.79 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.179 1.392 . . . . 0.0 110.544 -173.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.69 -22.07 31.02 Favored Glycine 0 N--CA 1.444 -0.811 0 CA-C-N 115.182 -0.917 . . . . 0.0 114.509 178.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -80.83 132.98 35.52 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 117.975 0.888 . . . . 0.0 110.772 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 51.9 mtm -77.78 100.86 6.45 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -175.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 57.9 t -66.83 -48.02 81.02 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.618 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -56.63 -44.75 81.54 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.659 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -68.2 -42.53 79.74 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.3 -179.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.74 -45.13 86.26 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.066 0.546 . . . . 0.0 111.407 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 89.3 mt -57.82 -50.25 73.91 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.95 0.405 . . . . 0.0 111.297 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.6 t -69.89 -36.55 69.77 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.176 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.778 -178.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 14.3 tpp85 -62.69 -37.93 88.4 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.96 0.904 . . . . 0.0 111.18 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -91.07 3.9 53.54 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.976 -177.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.1 36.21 92.69 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 121.278 -0.487 . . . . 0.0 112.16 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 97.8 mt -102.28 -11.36 18.77 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 120.896 0.379 . . . . 0.0 110.031 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -153.19 161.13 42.77 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -107.15 152.4 24.11 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 177.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.3 p -82.88 130.17 36.19 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.439 0 CA-C-O 121.106 0.479 . . . . 0.0 109.932 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -89.78 120.97 31.49 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 179.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.568 ' HB2' ' CE2' ' A' ' 115' ' ' TYR . 35.2 p90 -86.95 127.21 35.08 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.349 0.595 . . . . 0.0 112.178 -177.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 83.2 t -134.67 120.06 30.71 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 N-CA-C 105.596 -2.001 . . . . 0.0 105.596 175.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.568 ' CE2' ' HB2' ' A' ' 113' ' ' TYR . 92.4 m-85 -122.26 -70.87 0.76 Allowed 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 120.162 -0.615 . . . . 0.0 112.398 -177.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.585 ' HD3' ' H ' ' A' ' 118' ' ' ASN . 0.0 OUTLIER -94.72 149.4 36.37 Favored Pre-proline 0 N--CA 1.415 -2.208 0 O-C-N 123.923 0.764 . . . . 0.0 111.812 -173.278 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.434 ' HB3' ' HA ' ' B' ' 129' ' ' LYS . 42.5 Cg_endo -84.77 22.32 0.96 Allowed 'Trans proline' 0 N--CA 1.483 0.907 0 C-N-CA 124.223 3.282 . . . . 0.0 113.294 -171.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . 0.585 ' H ' ' HD3' ' A' ' 116' ' ' LYS . 5.6 t30 66.97 -73.46 0.08 Allowed 'General case' 0 C--N 1.297 -1.694 0 C-N-CA 126.578 1.951 . . . . 0.0 112.125 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -103.95 -20.85 13.74 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -176.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.4 m -78.97 35.55 0.26 Allowed 'General case' 0 CA--C 1.568 1.636 0 CA-C-O 121.624 0.726 . . . . 0.0 112.172 -174.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 . . . . . 0 C--N 1.31 -1.11 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 178.54 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.318 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 18.9 m -68.51 148.76 50.11 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 48.5 t -79.88 101.11 4.78 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.035 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -149.88 150.52 32.04 Favored 'General case' 0 C--N 1.289 -2.059 0 CA-C-N 115.147 -0.933 . . . . 0.0 108.536 -177.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 54.7 t80 -137.43 139.69 40.82 Favored 'General case' 0 C--N 1.293 -1.852 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 18.9 m -76.66 84.15 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.159 0 CA-C-O 121.981 0.896 . . . . 0.0 112.093 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -66.9 -33.37 75.44 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.573 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.434 ' HA ' ' HB3' ' A' ' 117' ' ' PRO . 57.9 mtmt 71.31 156.05 0.16 Allowed Pre-proline 0 N--CA 1.473 0.698 0 C-N-CA 124.712 1.205 . . . . 0.0 110.736 -174.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -55.57 102.9 0.1 OUTLIER 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.159 1.906 . . . . 0.0 111.596 175.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 131' ' ' ASN . . . . . 0.563 ' OD1' ' HB3' ' A' ' 77' ' ' ASP . 5.0 t30 -113.97 80.35 1.37 Allowed 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 106.268 -1.753 . . . . 0.0 106.268 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.524 HD21 ' HA ' ' A' ' 115' ' ' TYR . 6.8 m120 -129.82 0.63 4.85 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 120.126 -0.63 . . . . 0.0 112.045 -169.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 1.5 m -70.34 -9.65 56.77 Favored 'General case' 0 CA--C 1.56 1.361 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -168.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 72.9 m80 -126.84 4.79 6.62 Favored 'General case' 0 C--N 1.315 -0.912 0 O-C-N 121.47 -0.769 . . . . 0.0 110.042 175.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.422 ' O ' ' HG2' ' B' ' 139' ' ' ARG . 13.0 tm-20 -67.27 -47.48 70.54 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.411 -172.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 2.9 tm0? -72.51 -33.6 67.03 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -176.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 72.4 mt -57.6 -49.68 75.61 Favored 'General case' 0 C--O 1.254 1.338 0 CA-C-O 121.824 0.821 . . . . 0.0 109.256 177.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 11.2 mp -69.14 -28.89 66.85 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.591 177.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 139' ' ' ARG . . . . . 0.422 ' HG2' ' O ' ' B' ' 135' ' ' GLU . 31.2 mmt180 -60.8 -42.76 98.27 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.443 0.535 . . . . 0.0 112.443 176.287 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -64.08 -35.29 80.28 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-O 121.639 0.733 . . . . 0.0 110.028 178.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.3 m -70.12 -43.17 71.54 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.149 178.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.605 ' O ' ' HG2' ' B' ' 146' ' ' LYS . 34.5 tt0 -60.47 -45.29 94.26 Favored 'General case' 0 C--O 1.22 -0.467 0 O-C-N 123.862 0.726 . . . . 0.0 109.677 177.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.75 -46.26 77.89 Favored 'General case' 0 CA--C 1.514 -0.419 0 O-C-N 124.007 0.817 . . . . 0.0 111.41 -177.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -70.51 -41.7 72.28 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.454 178.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -62.87 -39.98 96.12 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.709 -179.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 146' ' ' LYS . . . . . 0.605 ' HG2' ' O ' ' B' ' 142' ' ' GLU . 18.4 ptpt -73.28 -35.69 66.2 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 176.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -59.77 -47.58 85.12 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 122.023 0.916 . . . . 0.0 109.599 176.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -89.33 -3.2 58.57 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 113.88 -1.509 . . . . 0.0 112.123 -173.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . 0.446 ' O ' ' HB2' ' B' ' 154' ' ' SER . 34.1 mmtp 54.24 47.54 22.87 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.048 0.939 . . . . 0.0 111.113 178.132 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 90.5 mt -78.96 117.64 20.22 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.201 -176.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 48.7 -89.8 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.303 1.841 . . . . 0.0 113.646 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 41.6 mt -59.38 -49.18 84.49 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.989 0 C-N-CA 122.988 0.515 . . . . 0.0 111.764 -177.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 78.7 m95 -69.33 -10.41 57.75 Favored 'General case' 0 CA--C 1.495 -1.139 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -171.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . 0.446 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 23.0 t -72.52 2.33 6.54 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.037 174.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -60.5 -32.86 71.85 Favored 'General case' 0 C--N 1.355 0.809 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 168.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 26.6 t70 . . . . . 0 C--O 1.24 0.566 0 C-N-CA 125.593 1.557 . . . . 0.0 111.241 178.05 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.409 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.3 m -61.42 -24.41 66.5 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 123.851 0.86 . . . . 0.0 110.55 176.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.2 m -128.18 164.66 22.01 Favored 'General case' 0 N--CA 1.427 -1.615 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 175.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 20.7 m -58.6 -40.95 84.68 Favored 'General case' 0 C--O 1.25 1.118 0 CA-C-O 121.363 0.601 . . . . 0.0 111.005 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.412 ' NZ ' ' HB3' ' A' ' 5' ' ' LYS . 2.0 ttpm? -132.79 91.45 2.9 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -140.31 74.25 1.46 Allowed 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 175.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -126.31 -167.59 1.74 Allowed 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 114.284 -1.326 . . . . 0.0 108.816 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -115.95 113.86 23.86 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -110.24 150.97 27.92 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-O 121.317 0.579 . . . . 0.0 110.481 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.435 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 11.5 pt-20 -138.86 143.97 39.58 Favored Pre-proline 0 C--N 1.277 -2.558 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.823 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 10.8 Cg_exo -73.75 138.81 26.9 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.788 2.326 . . . . 0.0 113.625 -177.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.416 ' O ' ' HB ' ' A' ' 72' ' ' ILE . . . -125.68 153.94 43.13 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.191 -178.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.419 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 42.8 m -105.34 135.5 46.59 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 177.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 53.1 tp -80.35 137.9 36.62 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 118.143 0.429 . . . . 0.0 110.711 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 72.6 mt -107.11 -49.81 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 172.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -161.67 138.01 8.11 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.289 -177.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -101.93 107.46 18.62 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 174.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 56.3 mt -89.5 -52.64 10.52 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-O 120.778 0.323 . . . . 0.0 111.367 -173.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.497 ' HA ' ' HB3' ' A' ' 59' ' ' SER . 28.1 m-20 -138.15 -176.22 4.37 Favored 'General case' 0 CA--C 1.499 -0.997 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -178.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -92.95 54.38 2.58 Favored Glycine 0 CA--C 1.489 -1.543 0 N-CA-C 107.348 -2.301 . . . . 0.0 107.348 178.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -177.59 -54.67 0.01 OUTLIER 'General case' 0 CA--C 1.486 -1.502 0 C-N-CA 125.271 1.428 . . . . 0.0 107.222 -171.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.673 ' HA ' ' O ' ' A' ' 34' ' ' PHE . 1.9 m -101.88 113.06 25.94 Favored 'General case' 0 N--CA 1.407 -2.597 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.465 -173.147 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 35.4 m -124.71 167.05 19.27 Favored 'Isoleucine or valine' 0 C--N 1.272 -2.803 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 173.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -121.47 114.13 20.82 Favored 'General case' 0 C--N 1.27 -2.855 0 N-CA-C 106.736 -1.579 . . . . 0.0 106.736 176.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.493 ' O ' ' HA ' ' A' ' 31' ' ' PRO . 2.4 pp -136.11 159.41 41.8 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -176.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.441 ' HA ' ' HA ' ' A' ' 31' ' ' PRO . 47.4 ttm -117.51 114.98 24.25 Favored 'General case' 0 C--N 1.295 -1.775 0 CA-C-N 114.864 -1.062 . . . . 0.0 109.536 -176.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -119.14 126.71 52.25 Favored 'General case' 0 C--N 1.281 -2.392 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 176.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt 59.97 27.21 16.56 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 123.804 0.69 . . . . 0.0 110.67 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.46 9.11 82.24 Favored Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.9 -178.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -111.7 102.2 52.91 Favored Pre-proline 0 C--N 1.312 -1.043 0 O-C-N 122.57 -0.37 . . . . 0.0 110.411 178.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.493 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 4.9 Cg_exo -81.47 134.77 8.99 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.379 2.72 . . . . 0.0 111.834 178.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 48.1 mtt -140.83 156.09 46.21 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 178.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 85.4 m -85.13 118.29 24.6 Favored 'General case' 0 N--CA 1.423 -1.819 0 N-CA-C 103.047 -2.946 . . . . 0.0 103.047 170.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.673 ' O ' ' HA ' ' A' ' 22' ' ' THR . 34.0 t80 -112.22 151.78 29.18 Favored 'General case' 0 C--N 1.271 -2.83 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -162.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.1 mmt180 -117.76 131.57 56.58 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 127.494 2.317 . . . . 0.0 106.186 172.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.621 ' HB2' HG21 ' A' ' 39' ' ' VAL . 32.6 mt -80.75 140.16 35.68 Favored 'General case' 0 C--N 1.289 -2.024 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 177.494 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.461 ' HB3' HD12 ' A' ' 38' ' ' LEU . 41.2 mt -65.68 133.45 51.12 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 178.061 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.52 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 2.9 mp 66.44 48.92 1.46 Allowed 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 125.674 1.59 . . . . 0.0 111.821 177.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.621 HG21 ' HB2' ' A' ' 36' ' ' LEU . 96.4 t -122.73 125.29 72.24 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.063 0 CA-C-O 121.035 0.445 . . . . 0.0 110.461 177.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.652 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 12.2 t70 -102.25 107.13 18.07 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.702 -1.222 . . . . 0.0 107.702 175.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.526 ' H ' ' CD ' ' A' ' 42' ' ' PRO . 30.0 p -121.08 -33.4 0.05 OUTLIER Pre-proline 0 C--N 1.307 -1.249 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.267 172.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.526 ' CD ' ' H ' ' A' ' 41' ' ' THR . 42.8 Cg_exo -62.59 128.02 22.34 Favored 'Trans proline' 0 C--N 1.398 3.136 0 N-CA-C 106.467 -2.167 . . . . 0.0 106.467 166.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.473 ' OE2' ' HB3' ' A' ' 45' ' ' LYS . 0.1 OUTLIER -68.86 131.19 44.72 Favored 'General case' 0 C--N 1.302 -1.484 0 C-N-CA 119.821 -0.751 . . . . 0.0 112.753 -170.572 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.0 p -111.71 -9.32 14.13 Favored 'General case' 0 N--CA 1.422 -1.829 0 CA-C-N 114.978 -1.01 . . . . 0.0 112.37 -178.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.473 ' HB3' ' OE2' ' A' ' 43' ' ' GLU . 82.5 tttt -92.44 -51.88 4.93 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 175.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 18.8 t-80 -142.19 90.32 8.29 Favored Pre-proline 0 C--N 1.305 -1.336 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 176.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -78.03 100.95 1.42 Allowed 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.944 2.429 . . . . 0.0 114.115 -175.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt -138.7 -51.04 0.55 Allowed 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.8 0.333 . . . . 0.0 110.837 172.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -114.16 -7.46 13.02 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.434 0.635 . . . . 0.0 110.554 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.401 ' C ' ' H ' ' A' ' 52' ' ' GLU . . . 88.43 -162.28 31.84 Favored Glycine 0 N--CA 1.442 -0.924 0 N-CA-C 108.069 -2.012 . . . . 0.0 108.069 -173.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 26.9 m -81.39 35.77 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.311 -1.097 0 CA-C-N 118.653 1.227 . . . . 0.0 110.217 174.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.401 ' H ' ' C ' ' A' ' 50' ' ' GLY . 37.0 tt0 -43.51 -45.17 6.4 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.292 1.837 . . . . 0.0 113.617 -174.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.508 ' HE2' ' HA ' ' A' ' 53' ' ' LYS . 8.1 mmpt? -68.58 -23.46 64.49 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.821 -175.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -101.54 -13.89 17.7 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.252 0.548 . . . . 0.0 109.839 -178.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -50.95 -58.48 9.38 Favored Glycine 0 CA--C 1.527 0.843 0 CA-C-N 114.85 -1.068 . . . . 0.0 114.663 -178.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.408 ' HA ' ' OG ' ' A' ' 59' ' ' SER . 34.8 Cg_exo -64.8 -12.77 35.72 Favored 'Trans proline' 0 C--N 1.371 1.737 0 C-N-CA 123.006 2.471 . . . . 0.0 113.164 -178.438 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -89.92 -43.45 10.58 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.86 -43.62 87.89 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.753 176.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.497 ' HB3' ' HA ' ' A' ' 19' ' ' ASP . 35.3 p -66.56 -36.11 81.85 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.824 -179.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.82 -44.51 96.83 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -66.27 -46.89 75.46 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.531 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.496 ' O ' HG23 ' A' ' 66' ' ' VAL . 60.3 m -55.37 -51.68 66.01 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 123.684 0.615 . . . . 0.0 111.394 -178.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 39.4 mttp -53.69 -51.87 61.85 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 120.926 0.393 . . . . 0.0 111.432 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -64.62 -40.9 96.31 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.535 -177.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.92 -47.02 61.38 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.964 -176.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 62' ' ' THR . 36.3 t -66.52 -38.07 80.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 120.965 0.412 . . . . 0.0 110.669 -177.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -75.0 -22.99 58.18 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.374 -0.531 . . . . 0.0 111.571 178.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -83.11 -24.42 32.64 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 121.204 0.526 . . . . 0.0 110.199 177.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.18 151.89 30.17 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.16 179.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -84.49 -65.35 1.02 Allowed 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.158 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -118.15 136.5 53.57 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 -176.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.416 ' HB ' ' O ' ' A' ' 12' ' ' ALA . 69.8 mt -104.84 112.96 40.61 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.508 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 22.1 mt-10 -112.8 133.48 54.78 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -177.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.439 HG12 ' CD1' ' A' ' 92' ' ' ILE . 29.2 m -110.82 123.1 66.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 178.17 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -120.1 122.31 40.76 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -92.99 145.77 24.12 Favored 'General case' 0 N--CA 1.422 -1.868 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 177.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -87.04 -175.35 5.31 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.1 mtpm? -78.13 14.07 1.27 Allowed 'General case' 0 C--N 1.313 -0.99 0 O-C-N 121.935 -0.478 . . . . 0.0 111.915 -176.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -95.69 -130.67 6.34 Favored Glycine 0 N--CA 1.436 -1.331 0 N-CA-C 112.247 -0.341 . . . . 0.0 112.247 -179.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -97.23 145.79 25.73 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 -177.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.451 HH11 ' HG2' ' A' ' 81' ' ' ARG . 11.8 ttt-85 -90.15 -13.71 35.11 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 119.09 -1.044 . . . . 0.0 109.472 -178.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 23.2 p -128.2 140.86 51.68 Favored 'General case' 0 N--CA 1.432 -1.331 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.523 176.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -69.09 153.73 43.25 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 178.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -65.5 -15.88 63.11 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 121.58 0.705 . . . . 0.0 110.332 179.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -76.34 -12.95 60.15 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.838 177.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 83.25 63.11 1.75 Allowed Glycine 0 CA--C 1.505 -0.534 0 N-CA-C 109.314 -1.515 . . . . 0.0 109.314 -176.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 60.8 ttt180 -156.16 147.61 22.63 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 105.755 -1.943 . . . . 0.0 105.755 -169.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -75.72 134.64 16.64 Favored Glycine 0 C--O 1.206 -1.594 0 C-N-CA 120.539 -0.839 . . . . 0.0 113.777 -173.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 62.7 mt -112.22 110.66 21.04 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 123.26 0.624 . . . . 0.0 111.741 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.471 ' HB3' ' HZ ' ' A' ' 34' ' ' PHE . . . -157.58 163.44 38.33 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 171.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.46 ' OH ' ' HB3' ' A' ' 98' ' ' MET . 35.6 t80 -95.14 141.73 28.42 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.439 ' CD1' HG12 ' A' ' 74' ' ' VAL . 49.5 mm -99.69 123.57 52.54 Favored 'Isoleucine or valine' 0 C--O 1.252 1.198 0 CA-C-O 121.206 0.526 . . . . 0.0 111.096 -179.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.508 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 96.2 m-85 -111.05 131.35 55.13 Favored 'General case' 0 C--N 1.29 -1.999 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 172.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.29 100.42 10.01 Favored 'General case' 0 C--N 1.286 -2.177 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 177.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.6 t70 47.57 57.32 6.02 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 122.474 1.131 . . . . 0.0 110.526 -177.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 77.27 -5.15 52.13 Favored Glycine 0 CA--C 1.53 0.989 0 CA-C-N 114.605 -1.18 . . . . 0.0 114.86 179.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 32.7 mtmm -104.37 124.25 48.86 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 117.625 0.712 . . . . 0.0 111.144 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . 0.46 ' HB3' ' OH ' ' A' ' 91' ' ' TYR . 2.1 mpt? -63.23 112.82 2.84 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 123.907 0.883 . . . . 0.0 112.059 -176.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 91.9 t -73.2 -46.16 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.23 -177.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.457 ' O ' HG22 ' A' ' 104' ' ' VAL . 46.2 t30 -63.93 -37.23 86.65 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.121 -178.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -54.94 -44.13 74.0 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.157 176.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.91 -44.22 93.6 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.504 179.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 97.2 mt -58.03 -52.22 66.45 Favored 'General case' 0 C--O 1.244 0.779 0 CA-C-O 121.389 0.614 . . . . 0.0 111.209 178.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.475 HG11 ' CG1' ' A' ' 111' ' ' VAL . 27.2 m -70.78 -38.0 71.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.496 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -176.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.414 ' HG3' ' HB3' ' B' ' 141' ' ' SER . 82.4 mtp180 -65.0 -16.22 63.18 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 175.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -93.62 -5.6 48.38 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.766 174.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.29 25.1 69.27 Favored Glycine 0 CA--C 1.507 -0.438 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.68 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 90.4 mt -88.87 -15.97 33.13 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.744 0.307 . . . . 0.0 111.047 -178.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -157.26 174.3 15.66 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -178.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.652 ' HB2' ' HB3' ' A' ' 40' ' ' ASP . 18.4 mttt -119.28 170.98 8.63 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 176.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.52 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 32.8 m -108.05 107.32 22.53 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -177.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -141.32 118.08 11.05 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 119.599 -0.84 . . . . 0.0 112.92 176.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -122.99 98.0 5.7 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 105.293 -2.114 . . . . 0.0 105.293 164.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 97.9 t -133.2 116.21 25.15 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 N-CA-C 114.522 1.305 . . . . 0.0 114.522 -169.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 65.2 m-85 -135.44 -9.96 2.18 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.984 169.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.412 ' HE3' ' OXT' ' A' ' 121' ' ' HIS . 5.0 mptp? 65.57 161.81 0.13 Allowed Pre-proline 0 N--CA 1.496 1.872 0 C-N-CA 123.74 0.816 . . . . 0.0 111.724 -175.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -70.3 -76.68 0.01 OUTLIER 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 121.159 1.24 . . . . 0.0 110.593 173.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -136.63 88.38 2.37 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 173.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -174.62 -32.19 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.576 -177.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 31.3 m 76.97 -48.38 0.53 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.043 1.337 . . . . 0.0 113.479 177.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . 0.412 ' OXT' ' HE3' ' A' ' 116' ' ' LYS . 66.4 t-80 . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.264 -177.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -0.973 0 N-CA-C 111.365 -0.694 . . . . 0.0 111.365 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 30.6 m -88.04 96.7 10.61 Favored 'General case' 0 N--CA 1.423 -1.822 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 6.1 p -78.4 93.65 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.544 0 CA-C-O 122.605 1.193 . . . . 0.0 111.024 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -133.43 74.17 1.55 Allowed 'General case' 0 C--N 1.292 -1.901 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 178.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -85.52 91.47 8.25 Favored 'General case' 0 N--CA 1.418 -2.046 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.418 -173.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 25.0 t -121.6 84.8 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.286 -2.163 0 N-CA-C 105.423 -2.065 . . . . 0.0 105.423 172.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -126.04 106.52 9.66 Favored 'General case' 0 C--N 1.292 -1.898 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.739 -175.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -87.02 167.66 20.9 Favored Pre-proline 0 C--N 1.294 -1.811 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 172.482 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -55.76 152.19 36.28 Favored 'Trans proline' 0 C--O 1.248 1.016 0 C-N-CA 121.47 1.447 . . . . 0.0 110.3 171.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -89.56 91.79 8.83 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 120.087 -0.645 . . . . 0.0 110.974 -176.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -171.68 61.82 0.03 OUTLIER 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 106.341 -1.725 . . . . 0.0 106.341 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 75.5 p -63.72 -8.66 11.01 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 114.292 1.219 . . . . 0.0 114.292 -173.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -85.68 2.17 46.4 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.824 -0.548 . . . . 0.0 111.289 173.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -37.76 -61.68 0.61 Allowed 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 126.731 2.012 . . . . 0.0 113.087 -178.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -47.58 -54.32 12.13 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.475 1.11 . . . . 0.0 113.883 -173.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.1 mt -60.54 -43.75 96.85 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.815 -177.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 138' ' ' LEU . . . . . 0.437 ' HB3' HG11 ' A' ' 111' ' ' VAL . 4.1 mm? -69.36 -38.03 77.88 Favored 'General case' 0 N--CA 1.432 -1.355 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.477 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -57.16 -45.6 83.48 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-O 120.859 0.361 . . . . 0.0 110.39 176.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -62.48 -43.4 98.92 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.931 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 141' ' ' SER . . . . . 0.414 ' HB3' ' HG3' ' A' ' 105' ' ' ARG . 25.2 m -65.24 -41.24 94.56 Favored 'General case' 0 N--CA 1.438 -1.03 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.539 -178.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.438 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 34.4 tt0 -67.06 -50.77 60.78 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.198 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -57.88 -34.78 70.13 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.819 0.699 . . . . 0.0 111.908 -177.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 144' ' ' GLN . . . . . 0.453 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 57.8 tt0 -61.94 -48.01 82.31 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -70.56 -32.66 70.16 Favored 'General case' 0 C--O 1.245 0.853 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.771 -178.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 146' ' ' LYS . . . . . 0.438 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 81.6 mttt -57.9 -51.21 70.56 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 123.661 0.601 . . . . 0.0 109.645 176.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -71.07 -22.87 62.06 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.548 -176.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 22.8 mm-40 -87.24 -4.35 59.09 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 121.073 -0.251 . . . . 0.0 111.588 178.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . 0.596 ' O ' ' HB3' ' B' ' 154' ' ' SER . 10.0 mmpt? 54.71 57.36 5.78 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.076 0.95 . . . . 0.0 108.855 -176.049 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 98.2 mt -95.49 119.3 33.74 Favored 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 120.084 -0.646 . . . . 0.0 112.539 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 50.9 -84.41 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 127.633 2.373 . . . . 0.0 114.181 175.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 152' ' ' ILE . . . . . 0.568 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 58.5 mt -68.56 -34.06 63.27 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.41 0 CA-C-O 121.764 0.792 . . . . 0.0 109.784 178.118 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 60.0 m95 -81.53 -11.1 59.3 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.767 -172.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . 0.596 ' HB3' ' O ' ' B' ' 149' ' ' LYS . 79.6 p -91.14 0.86 57.45 Favored 'General case' 0 N--CA 1.423 -1.803 0 C-N-CA 119.73 -0.788 . . . . 0.0 112.438 -178.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . 0.568 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 5.6 pt-20 -93.82 -17.76 22.74 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 174.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 13.7 t70 . . . . . 0 N--CA 1.431 -1.409 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.3 -170.984 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.426 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.6 p -90.91 -40.67 11.59 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 121.396 0.617 . . . . 0.0 110.024 177.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.7 m -88.45 78.43 7.89 Favored 'General case' 0 N--CA 1.424 -1.749 0 CA-C-O 121.541 0.686 . . . . 0.0 110.222 178.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.5 p -91.23 -56.9 2.97 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.939 177.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.477 ' HB3' ' H ' ' B' ' 134' ' ' HIS . 61.4 mttp -131.5 22.83 4.73 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 177.031 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -123.77 124.39 42.6 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 105.116 -2.179 . . . . 0.0 105.116 -178.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.438 ' CD1' ' HA ' ' A' ' 77' ' ' ASP . 96.1 mt -104.7 -149.89 0.42 Allowed 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 117.917 0.326 . . . . 0.0 111.244 -177.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.6 m-70 -100.25 116.24 31.77 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 122.173 -0.329 . . . . 0.0 110.957 -177.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 21.2 pttp -110.42 141.92 42.85 Favored 'General case' 0 CA--C 1.508 -0.661 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 176.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -139.34 143.75 37.36 Favored Pre-proline 0 C--N 1.276 -2.607 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.29 177.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -62.04 147.91 94.2 Favored 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.825 2.35 . . . . 0.0 113.487 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.02 166.09 25.41 Favored 'General case' 0 C--N 1.307 -1.266 0 C-N-CA 124.499 1.12 . . . . 0.0 108.965 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.45 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 57.2 m -100.76 132.03 46.36 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 178.658 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.452 ' HA ' HD13 ' A' ' 25' ' ' LEU . 54.2 tp -79.98 126.23 30.77 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 120.995 0.426 . . . . 0.0 110.316 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.3 mm -92.07 -54.62 7.12 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.674 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 175.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -166.42 149.08 6.88 Favored 'General case' 0 N--CA 1.425 -1.702 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.809 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -82.45 128.84 34.66 Favored 'General case' 0 N--CA 1.438 -1.075 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 171.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 47.5 mm -102.79 -51.8 8.71 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.719 0 CA-C-O 121.057 0.456 . . . . 0.0 109.961 -174.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -133.65 -176.8 4.28 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.66 50.54 4.01 Favored Glycine 0 C--O 1.222 -0.643 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 175.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.623 ' OD1' ' HD2' ' A' ' 35' ' ' ARG . 5.6 t70 -178.61 -59.91 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 -170.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.544 ' HA ' ' O ' ' A' ' 34' ' ' PHE . 21.5 m -82.32 120.14 25.03 Favored 'General case' 0 N--CA 1.409 -2.507 0 CA-C-N 113.597 -1.638 . . . . 0.0 111.246 -176.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.6 m -126.9 144.56 36.69 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.353 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 177.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -98.25 119.57 37.14 Favored 'General case' 0 C--N 1.292 -1.893 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -176.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.601 HD11 HG21 ' A' ' 72' ' ' ILE . 3.1 mm? -120.42 158.27 27.54 Favored 'General case' 0 CA--C 1.5 -0.963 0 CA-C-O 121.462 0.648 . . . . 0.0 111.985 -176.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.45 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 27.0 ttt -124.07 105.98 9.99 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 174.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -113.8 116.46 29.38 Favored 'General case' 0 C--N 1.292 -1.909 0 C-N-CA 119.191 -1.004 . . . . 0.0 110.086 -178.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 94.6 mttt 57.73 38.14 27.41 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.482 -179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 91.77 -1.52 75.11 Favored Glycine 0 N--CA 1.443 -0.892 0 CA-C-N 114.354 -1.294 . . . . 0.0 113.83 175.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -107.74 106.22 57.97 Favored Pre-proline 0 C--N 1.314 -0.963 0 CA-C-N 117.183 0.492 . . . . 0.0 110.437 -177.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.558 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 33.9 Cg_endo -90.89 125.22 1.02 Allowed 'Trans proline' 0 N--CA 1.448 -1.149 0 C-N-CA 123.007 2.471 . . . . 0.0 112.908 178.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 63.6 mtt -141.32 156.23 45.87 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.016 178.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.3 m -90.67 103.83 16.48 Favored 'General case' 0 C--N 1.294 -1.844 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 178.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.544 ' O ' ' HA ' ' A' ' 22' ' ' THR . 73.5 m-85 -95.29 125.25 39.79 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 113.927 1.084 . . . . 0.0 113.927 -170.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.623 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 6.7 mmm180 -95.68 146.12 24.75 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 125.417 1.487 . . . . 0.0 108.281 175.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.46 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 93.3 mt -82.65 125.21 30.95 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-O 121.631 0.729 . . . . 0.0 111.484 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 69.3 mt -79.0 139.38 38.21 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.333 174.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.555 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 87.9 mt 73.77 10.99 4.66 Favored 'General case' 0 C--O 1.218 -0.598 0 C-N-CA 125.158 1.383 . . . . 0.0 111.919 178.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.42 ' CG2' HD22 ' A' ' 100' ' ' ASN . 66.6 t -128.85 136.32 60.08 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.242 0 CA-C-O 121.084 0.468 . . . . 0.0 110.093 -179.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -121.68 107.87 12.87 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.0 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.447 ' H ' ' CD ' ' A' ' 42' ' ' PRO . 8.7 m -123.26 -49.66 0.04 OUTLIER Pre-proline 0 C--N 1.31 -1.122 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.778 176.136 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.447 ' CD ' ' H ' ' A' ' 41' ' ' THR . 34.2 Cg_exo -61.61 156.84 45.1 Favored 'Trans proline' 0 C--N 1.391 2.808 0 C-N-CA 121.572 1.514 . . . . 0.0 111.64 -178.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 71.02 175.41 0.29 Allowed 'General case' 0 C--O 1.236 0.359 0 O-C-N 124.16 0.913 . . . . 0.0 111.205 -179.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 23.2 m 70.29 74.4 0.21 Allowed 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 123.855 0.862 . . . . 0.0 111.01 178.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.556 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 0.0 OUTLIER -96.52 -51.8 4.2 Favored 'General case' 0 N--CA 1.435 -1.176 0 C-N-CA 118.43 -1.308 . . . . 0.0 111.01 176.662 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 87.0 m-70 34.21 73.19 0.62 Allowed Pre-proline 0 N--CA 1.498 1.967 0 C-N-CA 125.247 1.419 . . . . 0.0 113.004 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_exo -65.27 97.08 0.29 Allowed 'Trans proline' 0 C--O 1.241 0.641 0 C-N-CA 122.118 1.879 . . . . 0.0 114.167 -176.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.444 ' HB2' ' OE1' ' A' ' 52' ' ' GLU . 10.3 mtmp? -115.35 -45.97 2.9 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 172.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -97.15 -34.53 11.1 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 172.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 132.78 72.73 0.09 OUTLIER Glycine 0 CA--C 1.492 -1.349 0 N-CA-C 108.946 -1.661 . . . . 0.0 108.946 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.556 ' HA ' ' O ' ' A' ' 45' ' ' LYS . 52.6 t 61.56 89.5 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 -171.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.444 ' OE1' ' HB2' ' A' ' 48' ' ' LYS . 4.5 mm-40 -56.09 -32.41 64.12 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 113.938 -1.483 . . . . 0.0 113.264 -169.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.503 ' HE2' HD12 ' B' ' 152' ' ' ILE . 13.9 ptmm? -85.41 -13.1 50.4 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 74.91 91.79 0.08 Allowed 'General case' 0 CA--C 1.509 -0.6 0 C-N-CA 124.659 1.184 . . . . 0.0 112.2 -175.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -71.44 -58.59 5.38 Favored Glycine 0 C--O 1.246 0.857 0 CA-C-N 114.401 -1.272 . . . . 0.0 112.833 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -46.06 -54.84 4.19 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 124.006 3.137 . . . . 0.0 113.125 177.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -60.3 -46.59 89.33 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -177.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.04 -44.57 96.41 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 121.271 0.558 . . . . 0.0 110.853 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.6 m -69.17 -44.61 71.87 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.928 -178.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.503 ' O ' ' HG3' ' A' ' 64' ' ' LYS . . . -65.19 -41.63 94.39 Favored 'General case' 0 C--O 1.209 -1.044 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.924 -178.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -59.96 -43.7 94.89 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 122.588 0.355 . . . . 0.0 110.315 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.2 m -60.7 -50.99 71.25 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.624 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.76 -36.83 85.59 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.837 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.503 ' HG3' ' O ' ' A' ' 60' ' ' ALA . 98.2 mttt -56.96 -46.83 81.89 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 174.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.1 mmt -65.65 -51.5 59.02 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 32.9 m -74.36 -31.61 28.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -174.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -81.12 -28.22 35.23 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 119.536 -0.866 . . . . 0.0 110.944 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -82.01 -25.56 34.59 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.83 177.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.402 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -58.74 145.86 38.82 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 123.209 0.604 . . . . 0.0 111.683 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -79.46 -37.29 37.26 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.401 ' HE3' ' HB2' ' A' ' 71' ' ' LYS . 44.2 mtmt -133.59 145.48 50.09 Favored 'General case' 0 CA--C 1.484 -1.563 0 CA-C-N 114.625 -1.171 . . . . 0.0 108.85 -178.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.601 HG21 HD11 ' A' ' 25' ' ' LEU . 4.2 mp -117.52 118.54 58.84 Favored 'Isoleucine or valine' 0 C--N 1.276 -2.612 0 N-CA-C 105.348 -2.094 . . . . 0.0 105.348 171.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.606 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 31.5 mt-10 -112.84 141.36 46.74 Favored 'General case' 0 C--N 1.28 -2.453 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -173.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.516 HG12 ' CD1' ' A' ' 92' ' ' ILE . 30.6 m -112.71 124.57 69.5 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.277 -178.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 91' ' ' TYR . 35.5 tt0 -109.75 115.56 30.07 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 175.53 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -87.94 127.46 35.37 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-O 121.397 0.617 . . . . 0.0 111.639 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.438 ' HA ' ' CD1' ' A' ' 7' ' ' LEU . 11.4 t70 -95.8 166.44 11.8 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.086 -0.961 . . . . 0.0 111.798 -174.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -62.31 -24.05 67.09 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 125.847 1.659 . . . . 0.0 110.904 -177.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -55.05 -84.07 0.04 OUTLIER Glycine 0 CA--C 1.493 -1.315 0 O-C-N 123.549 0.531 . . . . 0.0 114.309 -175.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.558 ' HB2' HD12 ' A' ' 89' ' ' LEU . 24.8 mt-30 -149.86 149.61 30.72 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 178.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -84.37 -34.64 23.57 Favored 'General case' 0 C--N 1.285 -2.205 0 CA-C-O 121.599 0.714 . . . . 0.0 109.092 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.446 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 6.9 p -144.48 148.27 34.32 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-N 114.922 -1.035 . . . . 0.0 108.809 -179.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.449 ' HB2' HD11 ' A' ' 89' ' ' LEU . 24.4 t70 -110.67 158.28 18.78 Favored 'General case' 0 C--N 1.294 -1.83 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -63.46 -16.9 61.96 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.047 0.939 . . . . 0.0 111.13 -179.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -65.3 -20.51 66.44 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 121.373 0.606 . . . . 0.0 109.37 176.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 102.54 24.69 8.12 Favored Glycine 0 N--CA 1.443 -0.846 0 CA-C-N 115.584 -0.734 . . . . 0.0 112.947 176.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -130.07 159.21 37.44 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.446 ' HA2' ' HA ' ' A' ' 82' ' ' THR . . . -88.55 161.18 30.89 Favored Glycine 0 N--CA 1.427 -1.922 0 N-CA-C 109.118 -1.593 . . . . 0.0 109.118 177.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.558 HD12 ' HB2' ' A' ' 80' ' ' GLN . 91.1 mt -130.24 118.37 21.26 Favored 'General case' 0 C--N 1.286 -2.174 0 CA-C-N 117.38 0.59 . . . . 0.0 110.318 -177.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.17 168.01 28.63 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.239 0.543 . . . . 0.0 110.716 -178.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.459 ' HB3' ' HB3' ' A' ' 75' ' ' GLU . 18.2 t80 -97.79 126.47 43.16 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 105.363 -2.088 . . . . 0.0 105.363 173.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.516 ' CD1' HG12 ' A' ' 74' ' ' VAL . 47.8 mm -99.84 129.97 49.66 Favored 'Isoleucine or valine' 0 C--O 1.246 0.874 0 C-N-CA 119.75 -0.78 . . . . 0.0 112.912 -176.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.606 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 41.1 m-85 -110.62 145.32 38.1 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.434 173.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.402 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -109.41 99.35 8.6 Favored 'General case' 0 C--N 1.29 -1.982 0 N-CA-C 106.417 -1.697 . . . . 0.0 106.417 173.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.317 3.7 p30 42.13 57.42 3.28 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 114.228 1.196 . . . . 0.0 114.228 -176.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.62 -18.49 52.48 Favored Glycine 0 N--CA 1.432 -1.594 0 CA-C-N 114.948 -1.024 . . . . 0.0 113.992 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -90.47 147.35 23.46 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-N 117.114 0.457 . . . . 0.0 110.069 -177.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 57.4 mtt -92.4 108.1 19.71 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-O 121.471 0.653 . . . . 0.0 111.853 -177.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 62.4 t -67.67 -42.32 86.34 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 CA-C-N 114.51 -1.223 . . . . 0.0 109.763 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.46 ' ND2' ' HB3' ' A' ' 36' ' ' LEU . 11.8 m120 -54.13 -49.08 70.01 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.828 177.09 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -54.08 -56.08 21.42 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.377 175.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.83 -41.08 73.71 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 89.6 mt -65.06 -46.58 80.62 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 57.8 t -73.12 -38.26 54.66 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.158 0 CA-C-O 120.588 0.232 . . . . 0.0 110.866 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.513 ' CZ ' ' HA ' ' B' ' 141' ' ' SER . 12.7 tpp180 -65.33 -34.89 79.4 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.556 0.743 . . . . 0.0 110.898 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -84.94 -3.34 58.7 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.205 177.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.543 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 70.69 38.26 67.25 Favored Glycine 0 N--CA 1.432 -1.614 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.661 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 82.8 mt -103.79 -10.9 17.91 Favored 'General case' 0 C--N 1.291 -1.976 0 CA-C-O 121.628 0.728 . . . . 0.0 109.287 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -150.18 169.9 20.23 Favored 'General case' 0 N--CA 1.431 -1.397 0 CA-C-N 114.475 -1.238 . . . . 0.0 108.923 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.432 ' HG3' HD13 ' B' ' 152' ' ' ILE . 93.4 mttt -123.21 159.01 29.57 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 176.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.5 p -83.79 124.24 39.52 Favored 'Isoleucine or valine' 0 C--O 1.246 0.913 0 C-N-CA 120.095 -0.642 . . . . 0.0 109.846 177.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.555 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . -101.33 121.83 42.6 Favored 'General case' 0 C--N 1.305 -1.331 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -95.84 116.19 28.54 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -176.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 72.3 t -124.01 105.67 15.82 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 N-CA-C 107.643 -1.244 . . . . 0.0 107.643 174.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.419 ' HB2' ' ND2' ' A' ' 119' ' ' ASN . 93.8 m-85 -99.56 46.87 0.96 Allowed 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 178.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 55.6 mmtt 68.92 134.86 0.04 OUTLIER Pre-proline 0 C--O 1.212 -0.903 0 C-N-CA 124.821 1.248 . . . . 0.0 110.465 -169.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.75 -17.13 41.23 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 122.824 2.35 . . . . 0.0 113.12 -175.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -83.67 3.98 30.62 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 179.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . 0.443 ' ND2' ' HB3' ' A' ' 121' ' ' HIS . 25.7 p-10 -78.95 -26.07 43.55 Favored 'General case' 0 C--O 1.223 -0.297 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 176.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 7.7 m 66.68 38.09 4.08 Favored 'General case' 0 CA--C 1.557 1.215 0 CA-C-O 122.536 1.16 . . . . 0.0 109.689 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . 0.443 ' HB3' ' ND2' ' A' ' 119' ' ' ASN . 27.9 t60 . . . . . 0 C--O 1.246 0.891 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.497 -1.062 0 N-CA-C 110.664 -0.974 . . . . 0.0 110.664 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 40.1 p -80.59 112.66 18.16 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 51.2 t -78.17 90.19 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.967 0 CA-C-O 121.685 0.755 . . . . 0.0 109.919 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -148.37 126.32 12.0 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.186 -0.915 . . . . 0.0 108.866 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -93.36 96.58 10.03 Favored 'General case' 0 C--N 1.298 -1.671 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 178.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 127' ' ' VAL . . . . . 0.477 ' C ' ' H ' ' B' ' 129' ' ' LYS . 26.3 m -121.49 -52.05 3.22 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.796 0 CA-C-N 116.026 -0.534 . . . . 0.0 112.228 -178.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . 0.27 44.5 m-85 62.79 -27.39 0.07 Allowed 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 125.272 1.429 . . . . 0.0 114.834 -175.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.477 ' H ' ' C ' ' B' ' 127' ' ' VAL . 35.3 mtmm -73.8 115.56 43.28 Favored Pre-proline 0 C--N 1.291 -1.968 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 170.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' B' ' 129' ' ' LYS . 1.6 Cg_endo -75.56 -175.65 2.56 Favored 'Trans proline' 0 N--CA 1.437 -1.823 0 C-N-CA 122.073 1.849 . . . . 0.0 113.838 -173.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -81.32 88.53 6.08 Favored 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 175.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 26.0 p-10 -109.21 10.92 25.71 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 113.75 -1.568 . . . . 0.0 108.474 -175.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 133' ' ' THR . . . . . 0.401 HG22 ' CD2' ' B' ' 134' ' ' HIS . 17.3 m -56.97 97.46 0.02 OUTLIER 'General case' 0 N--CA 1.412 -2.373 0 C-N-CA 125.737 1.615 . . . . 0.0 112.417 -176.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . 0.477 ' H ' ' HB3' ' A' ' 5' ' ' LYS . 79.6 m-70 69.46 18.69 7.79 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 125.833 1.653 . . . . 0.0 111.577 179.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -47.01 -49.68 20.6 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.865 0.866 . . . . 0.0 111.967 -178.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . 0.496 ' O ' ' HG3' ' B' ' 140' ' ' LYS . 9.4 pt20 -51.48 -48.77 62.74 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.738 -179.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 85.0 mt -70.35 -44.88 67.24 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.427 -177.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.65 -34.06 77.4 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.422 -178.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 139' ' ' ARG . . . . . 0.558 ' O ' ' HD3' ' B' ' 139' ' ' ARG . 0.0 OUTLIER -76.31 -36.35 58.35 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.574 -179.905 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . 0.496 ' HG3' ' O ' ' B' ' 136' ' ' GLN . 29.6 mtpp -69.24 -29.69 67.67 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-O 121.066 0.46 . . . . 0.0 110.132 177.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 141' ' ' SER . . . . . 0.513 ' HA ' ' CZ ' ' A' ' 105' ' ' ARG . 22.6 t -61.2 -55.05 36.58 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-N 114.806 -1.088 . . . . 0.0 108.342 175.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.481 ' HG3' ' CH2' ' B' ' 153' ' ' TRP . 33.2 tt0 -59.48 -53.15 61.39 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.63 -1.168 . . . . 0.0 111.087 178.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.6 -42.58 75.06 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 -176.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -71.72 -46.97 56.95 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.052 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -65.0 -31.92 73.39 Favored 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.919 -177.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 146' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 87.7 mttt -59.62 -47.98 83.48 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.247 0.546 . . . . 0.0 110.363 175.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -70.52 -31.8 69.02 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.548 -176.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -76.25 -22.1 55.54 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.6 177.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' B' ' 154' ' ' SER . 51.0 mtpt 56.47 65.13 1.49 Allowed 'General case' 0 N--CA 1.441 -0.902 0 C-N-CA 124.434 1.093 . . . . 0.0 110.477 -174.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 89.5 mt -94.96 122.02 37.18 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.239 -179.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 151' ' ' ASN . . . . . 0.543 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 39.6 m-80 46.4 -89.16 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 126.25 1.82 . . . . 0.0 114.191 179.279 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 152' ' ' ILE . . . . . 0.503 HD12 ' HE2' ' A' ' 53' ' ' LYS . 13.3 tt -70.29 -30.94 45.28 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.751 0 CA-C-O 121.3 0.571 . . . . 0.0 110.027 -177.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 153' ' ' TRP . . . . . 0.481 ' CH2' ' HG3' ' B' ' 142' ' ' GLU . 65.9 m95 -78.26 -7.22 56.92 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 121.683 0.754 . . . . 0.0 110.172 -178.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . 0.423 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 8.2 t -102.85 19.4 19.4 Favored 'General case' 0 N--CA 1.408 -2.542 0 CA-C-N 115.394 -0.821 . . . . 0.0 108.905 179.083 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -71.34 -16.38 62.43 Favored 'General case' 0 C--N 1.351 0.673 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 174.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 15.7 t70 . . . . . 0 N--CA 1.436 -1.139 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.362 176.169 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.412 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 29.6 m -134.89 111.0 9.51 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 121.356 0.598 . . . . 0.0 109.695 179.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 45.6 m -138.9 112.19 8.09 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 176.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.8 m -125.2 -38.41 2.31 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.915 -175.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -86.54 -19.43 29.48 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.444 0.64 . . . . 0.0 109.518 178.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -118.61 122.98 43.87 Favored 'General case' 0 N--CA 1.435 -1.223 0 N-CA-C 106.875 -1.528 . . . . 0.0 106.875 170.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.468 HD13 ' HA ' ' A' ' 77' ' ' ASP . 96.6 mt -106.2 165.11 11.47 Favored 'General case' 0 C--N 1.286 -2.167 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 54.6 m80 -77.55 103.22 7.36 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 121.181 0.515 . . . . 0.0 110.441 -178.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 74' ' ' VAL . 27.7 ttpp -115.32 131.38 56.95 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.012 179.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.59 163.83 46.94 Favored Pre-proline 0 C--N 1.296 -1.749 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -79.72 150.36 21.36 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.192 1.928 . . . . 0.0 112.185 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.25 156.84 46.79 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.109 177.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.468 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 18.0 m -101.32 138.41 38.38 Favored 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 177.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 61.7 tp -76.11 126.52 31.15 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 -179.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 48.2 mm -98.41 -55.11 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 175.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 58.5 pttt -175.12 148.09 0.97 Allowed 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 122.432 0.293 . . . . 0.0 111.198 178.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -104.32 115.64 30.75 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 174.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.6 mp -86.91 -47.31 16.1 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.195 0 CA-C-O 121.416 0.627 . . . . 0.0 109.744 -175.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -138.95 175.71 9.32 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.279 -176.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.03 52.96 4.45 Favored Glycine 0 C--N 1.316 -0.581 0 N-CA-C 108.572 -1.811 . . . . 0.0 108.572 172.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.478 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 7.7 t70 -172.53 -58.97 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 -172.406 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 23.8 m -98.41 117.46 32.88 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 114.438 -1.255 . . . . 0.0 110.89 -176.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.4 m -133.45 156.43 41.66 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.427 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -121.24 125.08 46.21 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.467 -0.77 . . . . 0.0 109.965 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.0 mp -131.16 159.11 38.63 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-O 121.093 0.473 . . . . 0.0 110.436 -178.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.468 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 49.0 ttm -116.09 115.92 26.94 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.105 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.6 p90 -121.92 132.45 54.56 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 59.3 mttp 60.83 26.34 16.19 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.958 0.903 . . . . 0.0 110.586 -176.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 82.62 3.41 90.52 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 121.148 -0.548 . . . . 0.0 112.047 -177.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -105.24 113.03 64.94 Favored Pre-proline 0 C--N 1.315 -0.918 0 O-C-N 122.541 -0.388 . . . . 0.0 110.914 -178.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -85.93 120.22 1.94 Allowed 'Trans proline' 0 N--CA 1.443 -1.472 0 C-N-CA 122.389 2.059 . . . . 0.0 112.047 177.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 49.7 mtt -132.35 156.09 47.25 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.021 176.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.4 m -88.48 115.97 26.38 Favored 'General case' 0 N--CA 1.418 -2.043 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -102.14 166.88 10.36 Favored 'General case' 0 N--CA 1.414 -2.225 0 CA-C-O 122.127 0.965 . . . . 0.0 111.157 -177.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.478 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 18.4 ttp180 -139.2 136.63 35.23 Favored 'General case' 0 N--CA 1.405 -2.714 0 N-CA-C 107.124 -1.435 . . . . 0.0 107.124 172.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 5.0 mp -69.8 119.08 13.49 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 123.997 0.811 . . . . 0.0 110.23 -176.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.0 mt -57.66 131.47 50.36 Favored 'General case' 0 CA--C 1.499 -0.991 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.145 177.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.467 ' HB2' HD22 ' B' ' 138' ' ' LEU . 87.5 mt 73.19 19.92 3.46 Favored 'General case' 0 C--O 1.217 -0.648 0 O-C-N 125.205 1.565 . . . . 0.0 112.696 175.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.7 t -111.15 125.9 68.51 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 177.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -125.47 110.13 13.54 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.9 p -114.41 91.09 22.96 Favored Pre-proline 0 C--N 1.306 -1.297 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 169.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -101.95 -155.0 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.088 0 C-N-CA 123.137 2.558 . . . . 0.0 113.739 -173.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -128.19 153.39 46.95 Favored 'General case' 0 N--CA 1.423 -1.79 0 N-CA-C 103.533 -2.766 . . . . 0.0 103.533 174.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.1 t -150.59 -175.52 5.14 Favored 'General case' 0 C--N 1.29 -1.996 0 C-N-CA 119.179 -1.008 . . . . 0.0 110.156 -174.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.478 ' O ' ' HD3' ' A' ' 45' ' ' LYS . 8.9 tmtt? -64.38 -33.47 75.92 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 42.8 m80 -68.11 127.7 93.28 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 172.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -33.32 130.0 0.13 Allowed 'Trans proline' 0 C--N 1.36 1.144 0 C-N-CA 125.11 3.873 . . . . 0.0 115.702 -174.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.48 ' O ' ' HB2' ' A' ' 52' ' ' GLU . 36.7 ttmt -50.21 -49.4 52.79 Favored 'General case' 0 CA--C 1.491 -1.295 0 C-N-CA 124.76 1.224 . . . . 0.0 110.205 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.1 mtpp -85.76 10.47 13.51 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 122.078 0.942 . . . . 0.0 111.269 -174.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -97.64 -49.38 1.82 Allowed Glycine 0 C--N 1.291 -1.95 0 N-CA-C 109.221 -1.552 . . . . 0.0 109.221 174.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 26.9 m -86.76 -6.28 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.854 0 CA-C-O 121.391 0.615 . . . . 0.0 111.044 178.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.48 ' HB2' ' O ' ' A' ' 48' ' ' LYS . 39.9 tt0 -58.37 -34.55 70.81 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 124.151 0.98 . . . . 0.0 111.753 -178.233 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 57' ' ' GLU . 47.5 pttt -57.8 -19.8 31.09 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -177.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -78.38 -21.58 49.16 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.493 -0.483 . . . . 0.0 111.041 -177.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -64.46 -59.23 8.55 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 120.976 -0.63 . . . . 0.0 112.612 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.453 ' HA ' ' OG ' ' A' ' 59' ' ' SER . 20.2 Cg_exo -69.79 -12.45 32.85 Favored 'Trans proline' 0 C--N 1.369 1.651 0 C-N-CA 122.454 2.103 . . . . 0.0 111.755 176.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 53' ' ' LYS . 6.7 tp10 -78.48 -48.71 14.79 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 177.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.41 -37.68 80.55 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.862 179.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.453 ' OG ' ' HA ' ' A' ' 56' ' ' PRO . 26.1 p -68.17 -36.98 80.47 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.16 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -67.8 -43.63 79.23 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 176.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.29 -48.41 81.73 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.659 -179.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.453 HG23 HD21 ' A' ' 103' ' ' LEU . 12.2 p -62.94 -48.85 77.12 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.907 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -56.77 -46.92 81.16 Favored 'General case' 0 CA--C 1.509 -0.621 0 O-C-N 123.349 0.406 . . . . 0.0 111.8 179.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -56.76 -46.17 81.59 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.423 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 49.1 ttm -68.46 -46.47 69.69 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 123.366 0.416 . . . . 0.0 111.881 -177.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.8 m -70.33 -36.65 67.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -177.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -71.95 -34.88 69.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.733 0.302 . . . . 0.0 110.834 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -71.95 -37.77 69.91 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.152 0.501 . . . . 0.0 110.79 -178.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.68 153.73 40.87 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.304 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -86.22 -18.22 32.72 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-O 121.125 0.488 . . . . 0.0 110.766 179.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -130.46 125.74 35.16 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.382 -175.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 64.0 mt -106.86 112.74 41.13 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.84 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 170.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.6 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 26.8 mt-10 -115.42 137.23 52.27 Favored 'General case' 0 C--N 1.285 -2.229 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.365 -172.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.466 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 18.9 m -110.89 121.23 63.22 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.602 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 175.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.482 ' HB3' ' HB2' ' A' ' 91' ' ' TYR . 40.6 tt0 -110.76 121.09 44.47 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.455 ' O ' ' HB3' ' A' ' 7' ' ' LEU . 88.3 m-85 -95.84 147.0 24.11 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 178.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.53 ' HB3' ' HB2' ' B' ' 131' ' ' ASN . 10.8 t70 -85.0 -179.36 7.04 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 -177.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.529 ' HG2' ' OD1' ' A' ' 77' ' ' ASP . 21.2 pttp -73.05 -16.15 61.49 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 123.115 0.566 . . . . 0.0 112.084 -172.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.498 ' HA3' ' HB3' ' B' ' 131' ' ' ASN . . . -89.99 -107.15 1.25 Allowed Glycine 0 N--CA 1.443 -0.891 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.865 -179.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -110.9 165.06 12.16 Favored 'General case' 0 C--N 1.309 -1.193 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.826 -173.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 63.2 mtp180 -109.57 -21.4 12.47 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.83 -174.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 22.9 p -130.39 155.64 46.06 Favored 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 14.8 p30 -98.91 -167.65 1.52 Allowed 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 178.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -111.21 7.96 21.4 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-O 121.931 0.872 . . . . 0.0 109.305 177.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -86.84 -25.62 24.44 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 114.344 -1.298 . . . . 0.0 107.878 -178.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 105.46 49.12 0.99 Allowed Glycine 0 CA--C 1.487 -1.694 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 177.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.428 ' HG2' ' HB2' ' A' ' 35' ' ' ARG . 10.4 tpp85 -151.74 153.59 34.63 Favored 'General case' 0 N--CA 1.414 -2.268 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 -177.177 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -95.63 133.49 11.51 Favored Glycine 0 N--CA 1.432 -1.591 0 N-CA-C 108.595 -1.802 . . . . 0.0 108.595 173.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.2 pp -112.84 125.66 54.59 Favored 'General case' 0 N--CA 1.411 -2.415 0 CA-C-N 118.138 0.969 . . . . 0.0 112.91 -177.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -152.63 162.29 41.43 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.313 -179.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.482 ' HB2' ' HB3' ' A' ' 75' ' ' GLU . 83.6 m-85 -87.49 128.6 35.23 Favored 'General case' 0 C--N 1.292 -1.916 0 N-CA-C 105.58 -2.007 . . . . 0.0 105.58 174.057 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 48.4 mm -99.32 123.9 52.29 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.663 0 C-N-CA 120.029 -0.668 . . . . 0.0 109.241 -177.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.6 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 6.1 m-85 -116.84 143.56 45.54 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.536 178.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -121.55 100.24 6.91 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 175.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.1 t70 46.77 58.72 4.45 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 124.802 1.241 . . . . 0.0 111.323 -175.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.96 -22.5 11.73 Favored Glycine 0 N--CA 1.444 -0.829 0 CA-C-N 114.818 -1.083 . . . . 0.0 114.475 179.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -80.32 129.55 34.58 Favored 'General case' 0 CA--C 1.501 -0.92 0 CA-C-N 117.475 0.638 . . . . 0.0 111.309 -178.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -75.68 105.84 6.93 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 177.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 52.2 t -73.19 -39.18 56.1 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.09 0 CA-C-O 121.452 0.644 . . . . 0.0 109.554 -178.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -64.61 -44.41 90.68 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.689 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -66.42 -33.78 76.48 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.995 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.42 -37.81 84.82 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.09 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.453 HD21 HG23 ' A' ' 62' ' ' THR . 84.9 mt -63.13 -44.45 95.57 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.042 177.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 44.0 t -69.7 -37.78 74.71 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.156 0 CA-C-O 121.549 0.69 . . . . 0.0 109.591 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -61.72 -44.85 96.12 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 124.953 1.301 . . . . 0.0 111.693 179.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -83.59 2.12 38.83 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.27 -177.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.463 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 66.04 35.87 91.2 Favored Glycine 0 N--CA 1.43 -1.759 0 N-CA-C 111.567 -0.613 . . . . 0.0 111.567 -179.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 94.6 mt -96.69 -18.61 19.56 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -151.19 164.85 35.6 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 115.232 -0.895 . . . . 0.0 108.816 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.415 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 94.5 mttt -104.39 168.79 8.87 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 176.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.443 HG12 ' OE2' ' B' ' 142' ' ' GLU . 7.4 p -79.12 132.54 31.9 Favored 'Isoleucine or valine' 0 C--O 1.251 1.173 0 C-N-CA 118.205 -1.398 . . . . 0.0 107.937 175.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.82 158.16 18.22 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.546 -178.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -88.31 149.73 23.62 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-O 121.595 0.712 . . . . 0.0 112.144 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.713 HG21 ' HB3' ' B' ' 132' ' ' ASN . 18.2 t -88.8 134.36 28.55 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.013 0 CA-C-N 114.512 -1.222 . . . . 0.0 109.799 -174.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.45 ' O ' ' HD3' ' A' ' 117' ' ' PRO . 88.5 t80 -83.6 140.63 32.1 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 175.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -101.38 104.76 35.75 Favored Pre-proline 0 C--N 1.302 -1.49 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.45 ' HD3' ' O ' ' A' ' 115' ' ' TYR . 91.9 Cg_endo -89.65 -157.97 0.07 OUTLIER 'Trans proline' 0 N--CA 1.441 -1.56 0 C-N-CA 122.368 2.046 . . . . 0.0 108.976 175.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -80.72 69.25 7.21 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.597 0.713 . . . . 0.0 111.177 -179.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 55.1 m-20 -127.75 -6.36 5.68 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 176.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.445 ' HA ' ' HB3' ' B' ' 129' ' ' LYS . 9.0 t -71.24 114.99 9.87 Favored 'General case' 0 N--CA 1.425 -1.716 0 CA-C-N 115.264 -0.88 . . . . 0.0 112.303 -172.56 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 . . . . . 0 N--CA 1.43 -1.465 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 176.838 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.529 0 N-CA-C 111.934 -0.466 . . . . 0.0 111.934 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 51.1 m -87.05 179.93 6.59 Favored 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 39.4 t -85.57 88.26 2.63 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.199 0 C-N-CA 120.543 -0.463 . . . . 0.0 111.403 -177.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . 50.97 -91.74 0.02 OUTLIER 'General case' 0 C--O 1.253 1.285 0 C-N-CA 126.129 1.771 . . . . 0.0 114.975 174.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -91.31 101.23 13.93 Favored 'General case' 0 N--CA 1.433 -1.282 0 N-CA-C 107.41 -1.329 . . . . 0.0 107.41 -177.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 22.0 t -86.24 -22.3 7.25 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 CA-C-O 121.913 0.863 . . . . 0.0 110.812 -174.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -85.02 46.63 1.3 Allowed 'General case' 0 C--N 1.292 -1.932 0 CA-C-N 114.893 -1.049 . . . . 0.0 110.221 -175.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.445 ' HB3' ' HA ' ' A' ' 120' ' ' THR . 60.8 mttm -59.71 -46.35 98.51 Favored Pre-proline 0 CA--C 1.564 1.513 0 CA-C-N 114.653 -1.158 . . . . 0.0 113.318 -176.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -78.38 -164.01 0.25 Allowed 'Trans proline' 0 CA--C 1.557 1.644 0 C-N-CA 121.638 1.558 . . . . 0.0 112.629 176.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 131' ' ' ASN . . . . . 0.53 ' HB2' ' HB3' ' A' ' 77' ' ' ASP . 1.7 p-10 -109.3 98.4 7.82 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.147 0.499 . . . . 0.0 110.975 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.713 ' HB3' HG21 ' A' ' 114' ' ' VAL . 3.0 p-10 -171.24 39.57 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.158 -171.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 133' ' ' THR . . . . . 0.407 HG22 ' OD2' ' A' ' 77' ' ' ASP . 12.3 t -66.56 -11.13 51.52 Favored 'General case' 0 CA--C 1.56 1.342 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 -170.141 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 14.0 p80 -134.21 34.05 3.32 Favored 'General case' 0 C--O 1.266 1.925 0 CA-C-O 121.76 0.791 . . . . 0.0 112.005 176.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.466 ' OE1' ' HG2' ' B' ' 136' ' ' GLN . 0.2 OUTLIER -65.44 -33.52 76.13 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.855 179.334 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . 0.566 ' O ' ' HG2' ' B' ' 140' ' ' LYS . 15.2 mm100 -57.8 -34.17 69.35 Favored 'General case' 0 CA--C 1.502 -0.881 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.799 177.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 64.1 mt -66.24 -42.68 88.28 Favored 'General case' 0 C--O 1.242 0.689 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 138' ' ' LEU . . . . . 0.467 HD22 ' HB2' ' A' ' 38' ' ' LEU . 6.8 mp -69.54 -30.94 68.88 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 120.352 -0.539 . . . . 0.0 111.75 175.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -69.85 -28.19 65.47 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 176.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . 0.566 ' HG2' ' O ' ' B' ' 136' ' ' GLN . 3.9 mmmp? -61.63 -42.34 98.76 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 174.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 2.6 p -71.89 -41.17 68.28 Favored 'General case' 0 N--CA 1.426 -1.641 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.904 176.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.578 ' HG3' ' CZ2' ' B' ' 153' ' ' TRP . 39.4 tt0 -61.39 -58.02 9.91 Favored 'General case' 0 C--O 1.211 -0.931 0 O-C-N 123.244 0.34 . . . . 0.0 111.839 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . 0.423 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -56.34 -39.21 72.47 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 123.477 0.485 . . . . 0.0 111.435 -176.239 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 144' ' ' GLN . . . . . 0.415 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 52.0 tt0 -70.21 -45.25 66.96 Favored 'General case' 0 C--O 1.244 0.776 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.179 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -69.48 -28.18 65.85 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.492 -178.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 146' ' ' LYS . . . . . 0.508 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 92.8 mttt -58.9 -44.31 91.18 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 174.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 74.7 mmtt -71.8 -35.27 69.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.898 -178.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . 0.445 ' HB2' ' HG ' ' B' ' 150' ' ' LEU . 20.4 mm-40 -66.61 -29.84 69.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.822 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . 0.438 ' O ' ' HB2' ' B' ' 154' ' ' SER . 46.5 mtpt 59.75 57.42 3.18 Favored 'General case' 0 CA--C 1.505 -0.757 0 C-N-CA 124.737 1.215 . . . . 0.0 109.03 -174.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . 0.445 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 87.9 mt -87.85 117.67 26.86 Favored 'General case' 0 CA--C 1.489 -1.392 0 CA-C-N 114.291 -1.322 . . . . 0.0 110.659 -178.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 151' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 88.3 m-20 52.52 -89.46 0.02 OUTLIER 'General case' 0 C--N 1.315 -0.903 0 O-C-N 124.673 1.233 . . . . 0.0 114.127 172.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 13.0 tt -72.98 -25.8 22.38 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.222 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -178.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 153' ' ' TRP . . . . . 0.578 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 55.2 m95 -79.39 -7.94 58.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.892 0.853 . . . . 0.0 109.459 178.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . 0.438 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 35.2 t -103.79 26.73 8.25 Favored 'General case' 0 N--CA 1.419 -1.988 0 CA-C-N 114.457 -1.247 . . . . 0.0 108.426 174.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -62.23 -34.11 75.87 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 174.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 5.6 t70 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 127.71 2.404 . . . . 0.0 114.17 170.756 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.265 0 CA-C-O 121.017 0.437 . . . . 0.0 109.993 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 89.1 m -155.16 -64.88 0.12 Allowed 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 178.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.4 p -154.08 -75.85 0.11 Allowed 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 39.6 m -154.42 67.32 0.71 Allowed 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 106.552 -1.647 . . . . 0.0 106.552 171.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -142.44 90.2 2.21 Favored 'General case' 0 CA--C 1.497 -1.068 0 CA-C-N 114.416 -1.266 . . . . 0.0 110.265 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -85.3 173.11 10.59 Favored 'General case' 0 N--CA 1.422 -1.838 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 173.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.537 ' HB2' ' CG ' ' A' ' 75' ' ' GLU . 3.0 mm? -91.53 166.18 12.97 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -95.19 114.54 26.34 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 120.389 -0.524 . . . . 0.0 109.871 -178.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.415 ' HB3' ' HB2' ' A' ' 75' ' ' GLU . 21.3 pttp -111.48 153.58 25.96 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 115.26 -0.882 . . . . 0.0 108.869 177.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -138.68 162.18 54.4 Favored Pre-proline 0 C--N 1.278 -2.51 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 176.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.568 ' HA ' ' O ' ' A' ' 72' ' ' ILE . 19.5 Cg_exo -74.51 155.77 45.32 Favored 'Trans proline' 0 N--CA 1.453 -0.894 0 C-N-CA 122.294 1.996 . . . . 0.0 111.629 178.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -138.83 166.64 23.91 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.477 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 30.6 m -104.32 139.79 38.81 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 177.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 55.4 tp -88.69 133.52 34.19 Favored 'General case' 0 C--N 1.306 -1.301 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.234 -177.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 66.6 mt -92.55 -59.22 3.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.549 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 175.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -174.49 161.6 3.34 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.949 -1.023 . . . . 0.0 108.562 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.466 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -97.75 151.23 20.38 Favored 'General case' 0 C--N 1.29 -2.004 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 174.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 51.0 mm -112.89 -56.56 4.21 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 -179.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -135.3 -160.59 1.07 Allowed 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 -176.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -76.45 -38.04 34.27 Favored Glycine 0 C--N 1.303 -1.298 0 C-N-CA 120.644 -0.789 . . . . 0.0 112.134 -179.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.509 ' OD2' HG22 ' A' ' 41' ' ' THR . 4.0 p30 -106.42 -12.33 15.68 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-O 120.788 0.327 . . . . 0.0 111.603 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.43 111.87 24.63 Favored 'General case' 0 N--CA 1.425 -1.676 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.521 -174.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 5.9 m -136.91 147.43 27.18 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 C-N-CA 122.66 0.384 . . . . 0.0 110.48 -177.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -103.14 118.39 36.68 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-O 121.426 0.631 . . . . 0.0 111.188 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.9 mp -127.44 156.29 42.32 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 114.889 -1.05 . . . . 0.0 111.949 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.477 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 26.2 ttt -118.01 98.92 6.57 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 178.447 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.406 ' CD1' ' HZ ' ' A' ' 34' ' ' PHE . 7.6 p90 -98.67 111.76 24.03 Favored 'General case' 0 C--N 1.308 -1.204 0 C-N-CA 119.896 -0.722 . . . . 0.0 111.159 -174.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 37.4 mtpt 57.96 37.75 26.78 Favored 'General case' 0 C--O 1.245 0.862 0 CA-C-N 114.106 -1.406 . . . . 0.0 109.871 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 90.83 6.63 67.18 Favored Glycine 0 N--CA 1.436 -1.36 0 CA-C-N 114.001 -1.454 . . . . 0.0 113.703 177.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -112.59 106.17 55.7 Favored Pre-proline 0 C--N 1.311 -1.077 0 O-C-N 122.112 -0.64 . . . . 0.0 110.772 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -77.38 124.86 7.35 Favored 'Trans proline' 0 CA--C 1.534 0.504 0 C-N-CA 123.243 2.629 . . . . 0.0 112.648 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 53.7 mtt -145.57 156.54 43.75 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 122.948 0.499 . . . . 0.0 110.734 176.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.6 m -89.53 117.5 28.48 Favored 'General case' 0 N--CA 1.422 -1.866 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 172.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.406 ' HZ ' ' CD1' ' A' ' 27' ' ' TYR . 39.2 m-85 -95.96 145.64 25.26 Favored 'General case' 0 C--N 1.281 -2.379 0 CA-C-O 121.645 0.736 . . . . 0.0 112.488 -175.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.451 HH11 ' HD2' ' A' ' 35' ' ' ARG . 3.1 tpp85 -115.13 125.11 53.08 Favored 'General case' 0 C--N 1.289 -2.035 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 170.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.449 ' HA ' ' O ' ' A' ' 90' ' ' ALA . 71.3 mt -71.98 119.2 15.83 Favored 'General case' 0 C--N 1.288 -2.078 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.192 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.489 HD21 ' HB3' ' A' ' 89' ' ' LEU . 74.1 mt -60.42 139.57 57.63 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.756 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.522 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 88.2 mt 74.0 -0.38 3.37 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.924 1.29 . . . . 0.0 112.684 -178.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.5 t -115.21 133.8 60.32 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.266 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 -179.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.448 ' HB2' ' HB2' ' A' ' 112' ' ' ALA . 16.4 t70 -142.28 108.39 5.22 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.118 -1.068 . . . . 0.0 108.118 175.385 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.509 HG22 ' OD2' ' A' ' 21' ' ' ASP . 14.1 t -112.63 4.27 0.09 OUTLIER Pre-proline 0 CA--C 1.6 2.868 0 N-CA-C 115.009 1.485 . . . . 0.0 115.009 -178.029 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.469 ' HD3' ' N ' ' A' ' 41' ' ' THR . 48.5 Cg_endo -106.55 13.56 0.16 Allowed 'Trans proline' 0 C--N 1.384 2.437 0 CA-C-N 123.52 2.293 . . . . 0.0 113.409 177.172 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -125.39 122.45 36.81 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 119.866 -0.733 . . . . 0.0 111.841 -174.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.415 ' OG1' HG22 ' A' ' 51' ' ' VAL . 26.4 m -161.23 135.07 6.78 Favored 'General case' 0 C--N 1.31 -1.132 0 N-CA-C 105.886 -1.894 . . . . 0.0 105.886 174.058 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -87.12 -38.08 16.79 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -175.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.443 ' HB3' ' HD3' ' A' ' 47' ' ' PRO 0.269 26.9 t-80 -62.26 -60.93 8.68 Favored Pre-proline 0 CA--C 1.56 1.335 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -173.91 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.443 ' HD3' ' HB3' ' A' ' 46' ' ' HIS . 16.9 Cg_exo -69.86 138.34 37.26 Favored 'Trans proline' 0 C--N 1.357 1.014 0 CA-C-N 121.412 1.54 . . . . 0.0 110.217 173.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -64.22 -23.42 67.3 Favored 'General case' 0 C--N 1.308 -1.234 0 C-N-CA 123.94 0.896 . . . . 0.0 113.023 -173.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.489 ' HB2' ' HB2' ' A' ' 52' ' ' GLU . 30.1 mmmt -97.85 4.74 49.62 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 120.912 0.387 . . . . 0.0 110.386 -178.596 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 90.44 -112.47 4.08 Favored Glycine 0 N--CA 1.433 -1.549 0 N-CA-C 108.602 -1.799 . . . . 0.0 108.602 -174.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.415 HG22 ' OG1' ' A' ' 44' ' ' THR . 21.6 t -95.24 77.08 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 177.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.489 ' HB2' ' HB2' ' A' ' 49' ' ' LYS . 44.2 tt0 -75.28 -57.28 3.99 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.918 -176.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.3 mtpp -69.23 -35.53 76.25 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 113.758 1.022 . . . . 0.0 113.758 -170.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -117.48 9.57 13.28 Favored 'General case' 0 C--N 1.311 -1.083 0 C-N-CA 120.327 -0.549 . . . . 0.0 112.243 -172.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -63.78 -56.31 19.72 Favored Glycine 0 CA--C 1.526 0.732 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.566 179.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -52.26 -36.57 68.24 Favored 'Trans proline' 0 C--N 1.37 1.694 0 C-N-CA 122.805 2.336 . . . . 0.0 112.506 176.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -61.48 -50.54 72.32 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 178.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.84 -50.96 66.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.71 -177.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 44.5 m -59.89 -38.79 83.23 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 120.919 0.39 . . . . 0.0 111.463 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.42 -36.18 76.45 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.113 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -61.92 -50.03 73.81 Favored 'General case' 0 C--O 1.241 0.605 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.46 ' O ' HG22 ' A' ' 66' ' ' VAL . 27.9 m -57.49 -49.72 75.37 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 123.972 0.795 . . . . 0.0 110.03 177.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.466 ' HG2' ' HB3' ' A' ' 17' ' ' ALA . 25.1 mtpp -54.98 -52.99 61.37 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 178.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -59.23 -40.18 85.08 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 120.676 0.274 . . . . 0.0 111.601 -179.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.6 mmt -72.45 -50.96 22.4 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 62' ' ' THR . 22.2 m -77.08 -28.89 16.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -174.289 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -77.86 -35.51 50.92 Favored 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 119.848 -0.741 . . . . 0.0 111.28 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -79.26 -14.7 58.87 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 121.267 0.556 . . . . 0.0 110.737 177.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.59 133.82 56.45 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.112 -178.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -80.25 -62.93 1.53 Allowed 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 176.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -106.42 118.86 37.76 Favored 'General case' 0 N--CA 1.425 -1.724 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.568 ' O ' ' HA ' ' A' ' 11' ' ' PRO . 64.9 mt -99.62 118.72 46.64 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.497 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 178.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.503 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 3.5 mm-40 -111.24 133.64 53.43 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -175.55 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 13.6 m -110.92 118.5 57.45 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.725 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 174.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.537 ' CG ' ' HB2' ' A' ' 7' ' ' LEU . 34.2 tt0 -107.76 121.24 44.31 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 120.638 0.256 . . . . 0.0 110.408 -177.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -98.59 129.7 45.12 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 -177.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.474 ' OD2' HD13 ' A' ' 37' ' ' LEU . 2.2 p30 -94.8 -173.86 3.11 Favored 'General case' 0 N--CA 1.426 -1.631 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 -176.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -75.76 -8.02 55.84 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.573 0.749 . . . . 0.0 112.288 -174.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -79.88 -70.88 1.3 Allowed Glycine 0 N--CA 1.428 -1.885 0 N-CA-C 111.696 -0.562 . . . . 0.0 111.696 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -145.61 150.57 36.6 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 -176.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -102.36 -39.07 7.34 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 122.033 0.921 . . . . 0.0 109.048 176.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 15.2 p -143.55 142.63 31.18 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.407 -178.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.505 ' HB3' ' HB3' ' A' ' 87' ' ' ARG . 11.5 t70 -76.87 141.42 40.61 Favored 'General case' 0 C--N 1.284 -2.257 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -51.26 -36.99 44.69 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 124.319 1.047 . . . . 0.0 112.605 -177.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -89.4 10.46 22.48 Favored 'General case' 0 CA--C 1.559 1.294 0 CA-C-O 121.598 0.713 . . . . 0.0 111.209 -171.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 94.93 41.5 4.05 Favored Glycine 0 CA--C 1.507 -0.41 0 C-N-CA 120.568 -0.825 . . . . 0.0 114.206 172.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.505 ' HB3' ' HB3' ' A' ' 83' ' ' ASP . 48.4 ttp180 -125.88 138.84 53.82 Favored 'General case' 0 C--N 1.292 -1.893 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 177.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -82.17 143.66 23.12 Favored Glycine 0 C--N 1.305 -1.191 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.489 ' HB3' HD21 ' A' ' 37' ' ' LEU . 91.5 mt -127.36 108.46 10.86 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -179.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.449 ' O ' ' HA ' ' A' ' 36' ' ' LEU . . . -156.63 166.19 34.11 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.851 -177.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -91.61 142.38 27.69 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 170.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 14.0 tt -113.3 135.7 51.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.453 0 C-N-CA 118.316 -1.354 . . . . 0.0 111.559 -178.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.503 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 8.5 m-85 -116.46 139.03 50.9 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.675 176.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -109.0 100.17 9.4 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.7 t70 46.35 57.88 5.0 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 124.725 1.21 . . . . 0.0 111.431 -177.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.63 -23.55 12.68 Favored Glycine 0 CA--C 1.52 0.393 0 CA-C-N 114.846 -1.07 . . . . 0.0 114.02 177.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.2 mtmm -90.57 119.39 30.78 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -177.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . 0.45 ' HA ' ' HA ' ' A' ' 93' ' ' TYR . 41.7 ttp -83.98 103.68 13.43 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 121.951 0.881 . . . . 0.0 112.991 -175.108 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 43.7 t -67.02 -29.18 45.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.653 -179.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.443 HD22 ' HB3' ' A' ' 36' ' ' LEU . 24.1 t-20 -53.54 -52.17 60.54 Favored 'General case' 0 C--O 1.258 1.517 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.106 -178.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.664 ' O ' ' HG2' ' A' ' 105' ' ' ARG . 6.9 pt-20 -77.31 -30.29 54.06 Favored 'General case' 0 N--CA 1.412 -2.365 0 C-N-CA 118.216 -1.394 . . . . 0.0 110.123 -179.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -56.83 -38.98 73.4 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 122.779 0.432 . . . . 0.0 110.904 -179.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 99.1 mt -60.84 -46.7 89.52 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.172 175.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.404 HG21 HD23 ' B' ' 138' ' ' LEU . 66.1 t -70.15 -37.35 71.51 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.186 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.492 178.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.664 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 33.9 mmm-85 -58.22 -41.62 84.46 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.23 0.612 . . . . 0.0 110.481 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -83.49 -4.68 58.74 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.719 -177.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.88 33.89 80.96 Favored Glycine 0 N--CA 1.439 -1.152 0 C-N-CA 120.156 -1.021 . . . . 0.0 111.092 -176.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.3 mt -91.05 -6.24 54.11 Favored 'General case' 0 CA--C 1.5 -0.977 0 CA-C-O 122.16 0.981 . . . . 0.0 108.667 178.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -152.13 165.69 34.0 Favored 'General case' 0 N--CA 1.405 -2.701 0 CA-C-N 114.295 -1.321 . . . . 0.0 107.775 -179.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -103.82 152.09 22.31 Favored 'General case' 0 N--CA 1.409 -2.5 0 N-CA-C 105.136 -2.172 . . . . 0.0 105.136 176.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.7 p -77.28 128.99 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.269 0 C-N-CA 118.384 -1.326 . . . . 0.0 109.601 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.522 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . -91.44 120.26 32.13 Favored 'General case' 0 C--N 1.293 -1.882 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 173.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 28.3 p90 -89.18 146.76 24.57 Favored 'General case' 0 C--N 1.29 -2.009 0 C-N-CA 119.892 -0.723 . . . . 0.0 109.388 -178.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.463 HG21 HD22 ' B' ' 131' ' ' ASN . 41.0 t -89.0 152.87 3.27 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.85 0 N-CA-C 106.827 -1.546 . . . . 0.0 106.827 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.452 ' O ' ' HB2' ' A' ' 116' ' ' LYS . 81.8 m-85 -96.92 -54.35 3.22 Favored 'General case' 0 C--N 1.291 -1.944 0 C-N-CA 120.257 -0.577 . . . . 0.0 112.514 -178.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 115' ' ' TYR . 50.2 mmtt 74.8 125.52 0.03 OUTLIER Pre-proline 0 C--O 1.24 0.588 0 O-C-N 124.359 1.037 . . . . 0.0 109.557 -165.038 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.404 ' HD2' ' HD3' ' A' ' 116' ' ' LYS . 5.9 Cg_endo -46.07 -25.61 3.03 Favored 'Trans proline' 0 N--CA 1.488 1.19 0 C-N-CA 124.984 3.789 . . . . 0.0 117.24 -169.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . 0.543 ' HA ' ' OXT' ' A' ' 121' ' ' HIS . 2.9 t-20 -140.02 32.62 1.96 Allowed 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.469 0.652 . . . . 0.0 110.69 -177.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -61.13 -60.44 3.76 Favored 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 121.499 0.666 . . . . 0.0 110.383 176.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 14.6 t -140.42 19.69 2.39 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 175.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . 0.543 ' OXT' ' HA ' ' A' ' 118' ' ' ASN . 46.1 t-80 . . . . . 0 N--CA 1.428 -1.564 0 CA-C-N 113.525 -1.671 . . . . 0.0 108.014 -177.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.698 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 18.1 m 64.54 19.75 11.92 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.216 1.006 . . . . 0.0 113.067 175.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 7.1 p -80.4 -35.01 15.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-O 121.539 0.685 . . . . 0.0 109.311 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -132.96 66.43 1.56 Allowed 'General case' 0 N--CA 1.428 -1.565 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 177.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -107.65 -45.0 4.13 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 114.588 -1.187 . . . . 0.0 110.47 178.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 58.4 t -75.01 102.86 2.52 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 -178.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -92.53 86.57 5.66 Favored 'General case' 0 N--CA 1.421 -1.888 0 CA-C-O 121.926 0.869 . . . . 0.0 109.758 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -102.12 -177.11 0.51 Allowed Pre-proline 0 C--N 1.292 -1.907 0 N-CA-C 105.61 -1.996 . . . . 0.0 105.61 177.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -55.1 164.48 3.54 Favored 'Trans proline' 0 CA--C 1.556 1.596 0 C-N-CA 121.508 1.472 . . . . 0.0 111.805 174.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 131' ' ' ASN . . . . . 0.474 HD21 ' CG ' ' A' ' 77' ' ' ASP . 62.0 t30 -59.26 -56.94 15.71 Favored 'General case' 0 C--N 1.307 -1.269 0 O-C-N 122.119 -0.363 . . . . 0.0 110.044 176.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 17.3 m120 81.9 -22.59 0.25 Allowed 'General case' 0 N--CA 1.501 2.102 0 C-N-CA 126.002 1.721 . . . . 0.0 113.531 169.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 133' ' ' THR . . . . . 0.464 HG21 ' HB2' ' A' ' 77' ' ' ASP . 21.1 p -36.5 -74.23 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 125.389 1.476 . . . . 0.0 114.187 -169.16 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -116.06 2.39 13.41 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 170.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -62.37 -45.43 93.21 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 114.23 -1.35 . . . . 0.0 113.005 -168.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -60.05 -42.94 95.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.033 0.444 . . . . 0.0 110.082 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.85 -50.17 73.32 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.623 -177.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 138' ' ' LEU . . . . . 0.404 HD23 HG21 ' A' ' 104' ' ' VAL . 9.1 mp -68.86 -38.49 79.76 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 -179.042 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -61.77 -41.73 98.08 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.977 0.417 . . . . 0.0 109.948 176.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . 0.482 ' HA ' ' HE3' ' B' ' 140' ' ' LYS . 1.4 tpmt? -71.2 -37.77 72.09 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.704 -179.137 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.4 m -65.78 -37.17 85.6 Favored 'General case' 0 C--O 1.244 0.811 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.488 178.238 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.658 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 29.8 tt0 -65.52 -41.86 92.65 Favored 'General case' 0 C--O 1.211 -0.956 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.445 175.558 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -54.24 -46.01 72.47 Favored 'General case' 0 CA--C 1.518 -0.281 0 O-C-N 123.555 0.534 . . . . 0.0 110.399 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 144' ' ' GLN . . . . . 0.475 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 2.6 mp0 -64.78 -46.19 83.14 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.172 175.236 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -58.31 -36.22 73.02 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 123.038 0.535 . . . . 0.0 112.369 -179.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 146' ' ' LYS . . . . . 0.658 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 50.8 mttm -59.76 -47.67 84.73 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 176.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -65.32 -41.91 93.5 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.636 -178.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 20.8 mm-40 -71.89 -18.27 62.05 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.914 -178.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . 0.581 ' O ' ' HB2' ' B' ' 154' ' ' SER . 29.6 mtpp 56.77 65.57 1.37 Allowed 'General case' 0 N--CA 1.437 -1.079 0 C-N-CA 124.098 0.959 . . . . 0.0 110.698 -176.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 94.4 mt -99.76 126.81 45.89 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.146 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 46.67 -93.96 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 125.549 1.54 . . . . 0.0 114.563 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 65.1 mt -63.88 -31.33 52.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 CA-C-O 121.586 0.708 . . . . 0.0 110.708 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 153' ' ' TRP . . . . . 0.443 ' CG ' ' HA ' ' B' ' 146' ' ' LYS . 49.1 m95 -83.98 -3.68 58.17 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.778 0.799 . . . . 0.0 110.247 -179.032 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . 0.581 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 11.8 t -115.0 28.75 8.5 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 177.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -75.06 -25.48 58.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.043 178.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 9.8 t70 . . . . . 0 C--N 1.298 -1.656 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 -176.836 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.773 0 CA-C-O 120.54 0.21 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 90.3 m 63.83 -81.42 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.806 0.842 . . . . 0.0 109.861 -173.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.452 ' C ' ' H ' ' A' ' 5' ' ' LYS . 16.4 m -145.39 -4.58 0.69 Allowed 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 178.281 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 87.2 m 68.69 -41.76 0.47 Allowed 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 124.343 1.057 . . . . 0.0 111.774 -173.166 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.452 ' H ' ' C ' ' A' ' 3' ' ' SER . 23.1 ttmt 81.75 105.79 0.06 Allowed 'General case' 0 CA--C 1.503 -0.84 0 C-N-CA 127.896 2.478 . . . . 0.0 111.001 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.679 ' HE2' ' O ' ' A' ' 7' ' ' LEU . 13.9 ptmt -89.5 174.14 7.95 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 106.965 -1.495 . . . . 0.0 106.965 172.001 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.679 ' O ' ' HE2' ' A' ' 6' ' ' LYS . 73.7 mt -67.71 147.62 52.4 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.2 m170 -91.47 118.37 30.51 Favored 'General case' 0 C--N 1.294 -1.843 0 C-N-CA 119.805 -0.758 . . . . 0.0 112.279 -172.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.494 ' HG2' ' HB2' ' A' ' 75' ' ' GLU . 46.4 mtmt -89.64 109.68 20.63 Favored 'General case' 0 N--CA 1.432 -1.362 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 170.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.476 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 7.2 pt-20 -112.73 138.24 22.02 Favored Pre-proline 0 C--N 1.273 -2.759 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.651 178.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 17.3 Cg_exo -67.37 136.65 40.73 Favored 'Trans proline' 0 C--O 1.24 0.605 0 C-N-CA 122.575 2.183 . . . . 0.0 113.199 -176.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -128.31 159.46 35.21 Favored 'General case' 0 N--CA 1.425 -1.676 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.753 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.415 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 72.9 m -110.93 128.7 55.91 Favored 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 177.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 57.4 tp -69.38 128.13 35.49 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 120.631 0.253 . . . . 0.0 110.638 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.4 mm -95.05 -55.1 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 173.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -171.54 137.91 1.1 Allowed 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.437 179.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.513 ' HA ' HG13 ' A' ' 23' ' ' VAL . . . -86.67 105.75 17.13 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 175.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.4 mm -74.41 -49.16 32.85 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.594 -175.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.479 ' HB3' ' H ' ' A' ' 22' ' ' THR . 5.3 t70 -142.91 -163.71 1.69 Allowed 'General case' 0 C--N 1.303 -1.439 0 N-CA-C 106.851 -1.537 . . . . 0.0 106.851 -173.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -110.8 44.69 1.45 Allowed Glycine 0 C--N 1.293 -1.818 0 N-CA-C 107.555 -2.218 . . . . 0.0 107.555 176.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -167.21 -52.23 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 113.144 -1.528 . . . . 0.0 107.905 -170.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.479 ' H ' ' HB3' ' A' ' 19' ' ' ASP . 31.1 m -105.88 122.34 45.91 Favored 'General case' 0 N--CA 1.428 -1.567 0 CA-C-N 114.281 -1.327 . . . . 0.0 108.931 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.513 HG13 ' HA ' ' A' ' 17' ' ' ALA . 22.9 t -133.89 145.08 33.9 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.678 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 -178.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -107.19 125.21 50.81 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 119.589 1.086 . . . . 0.0 109.804 -179.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.431 ' O ' ' HA ' ' A' ' 31' ' ' PRO . 4.7 mp -136.12 158.41 44.47 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-O 121.076 0.465 . . . . 0.0 110.74 -178.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.416 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 59.4 ttp -110.31 106.05 15.29 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 11.1 p90 -111.94 121.33 44.73 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 178.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp 58.29 27.71 15.63 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 123.627 0.771 . . . . 0.0 111.002 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.439 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 94.1 3.25 63.75 Favored Glycine 0 N--CA 1.444 -0.772 0 CA-C-N 115.796 -0.638 . . . . 0.0 113.167 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.416 ' O ' ' HA ' ' A' ' 26' ' ' MET . 14.1 mm100 -103.67 101.39 23.93 Favored Pre-proline 0 C--N 1.313 -1.007 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 179.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.439 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 2.0 Cg_endo -81.85 85.08 1.76 Allowed 'Trans proline' 0 N--CA 1.448 -1.196 0 C-N-CA 122.532 2.155 . . . . 0.0 109.783 175.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 29.5 mmt -100.29 156.27 17.32 Favored 'General case' 0 C--N 1.302 -1.498 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.757 -175.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.401 ' O ' ' HB3' ' A' ' 87' ' ' ARG . 9.1 m -84.27 113.23 20.97 Favored 'General case' 0 N--CA 1.409 -2.493 0 N-CA-C 105.916 -1.883 . . . . 0.0 105.916 174.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -95.61 148.16 22.81 Favored 'General case' 0 C--N 1.288 -2.096 0 CA-C-O 121.78 0.8 . . . . 0.0 111.842 -176.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.2 tpp85 -122.2 129.77 52.57 Favored 'General case' 0 C--N 1.278 -2.541 0 N-CA-C 105.758 -1.941 . . . . 0.0 105.758 173.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.422 ' HB3' HD22 ' A' ' 100' ' ' ASN . 86.0 mt -72.37 119.2 16.24 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 175.428 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.435 HD21 ' HB3' ' A' ' 89' ' ' LEU . 17.9 mt -55.89 129.03 37.93 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 -177.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 11.1 mt 69.77 33.45 2.92 Favored 'General case' 0 C--N 1.356 0.873 0 O-C-N 124.787 1.304 . . . . 0.0 112.424 164.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.417 HG13 ' HB1' ' A' ' 109' ' ' ALA . 69.2 t -110.56 128.93 66.52 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.185 0 CA-C-N 114.678 -1.146 . . . . 0.0 108.09 178.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.45 ' HB2' ' HB2' ' A' ' 112' ' ' ALA . 16.8 t70 -103.84 108.27 19.51 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -179.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.456 ' OG1' ' HD3' ' A' ' 42' ' ' PRO . 36.7 p -120.31 -43.25 0.04 OUTLIER Pre-proline 0 CA--C 1.561 1.385 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 176.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.456 ' HD3' ' OG1' ' A' ' 41' ' ' THR . 23.7 Cg_exo -67.26 95.43 0.38 Allowed 'Trans proline' 0 C--N 1.398 3.14 0 C-N-CA 121.672 1.582 . . . . 0.0 111.666 179.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -128.42 143.88 51.06 Favored 'General case' 0 N--CA 1.409 -2.483 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.113 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.3 p -104.93 94.7 5.4 Favored 'General case' 0 N--CA 1.415 -2.203 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 170.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.467 ' O ' ' HB2' ' A' ' 46' ' ' HIS . 19.6 ttmm -90.52 -54.48 3.98 Favored 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 120.389 -0.525 . . . . 0.0 109.796 -171.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.467 ' HB2' ' O ' ' A' ' 45' ' ' LYS . 36.3 t-80 159.95 -55.4 0.0 OUTLIER Pre-proline 0 N--CA 1.486 1.331 0 C-N-CA 125.517 1.527 . . . . 0.0 110.49 178.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.43 ' HD3' ' HB3' ' A' ' 46' ' ' HIS . 1.5 Cg_endo -82.13 94.79 0.89 Allowed 'Trans proline' 0 C--N 1.38 2.223 0 C-N-CA 121.63 1.553 . . . . 0.0 110.701 -178.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.554 ' HA ' ' HG2' ' A' ' 52' ' ' GLU . 58.3 mtmt -70.25 -26.66 63.93 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.159 -0.928 . . . . 0.0 113.479 -174.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.402 ' HD3' ' HA ' ' A' ' 49' ' ' LYS . 74.2 mmtt -99.5 3.83 45.77 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 122.094 0.95 . . . . 0.0 109.571 175.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -88.68 -2.14 79.37 Favored Glycine 0 N--CA 1.435 -1.398 0 N-CA-C 108.404 -1.878 . . . . 0.0 108.404 171.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.588 HG12 ' H ' ' A' ' 54' ' ' TYR . 57.9 t 73.34 89.64 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.212 0 C-N-CA 126.329 1.852 . . . . 0.0 111.242 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.554 ' HG2' ' HA ' ' A' ' 48' ' ' LYS . 4.8 mm-40 -61.75 -45.64 93.05 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.626 1.571 . . . . 0.0 111.378 -178.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 2.2 mmmm -76.63 -27.7 55.79 Favored 'General case' 0 CA--C 1.497 -1.062 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 -175.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.588 ' H ' HG12 ' A' ' 51' ' ' VAL . 77.5 m-85 63.06 14.08 7.32 Favored 'General case' 0 N--CA 1.484 1.227 0 O-C-N 124.043 0.839 . . . . 0.0 110.23 -170.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -50.84 -58.22 9.7 Favored Glycine 0 C--O 1.211 -1.302 0 CA-C-N 114.676 -1.147 . . . . 0.0 113.813 -178.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -51.07 -45.45 36.62 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 122.755 2.304 . . . . 0.0 112.406 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -63.75 -48.1 78.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.854 -179.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.33 -41.65 66.26 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.276 -177.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 31.3 p -63.23 -43.6 97.62 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -178.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.99 -41.05 95.76 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-O 120.937 0.398 . . . . 0.0 110.519 179.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -64.98 -50.92 64.47 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.458 177.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.539 ' O ' HG22 ' A' ' 66' ' ' VAL . 61.5 m -55.87 -46.97 78.13 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 123.9 0.75 . . . . 0.0 110.975 -179.085 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -56.54 -53.97 51.29 Favored 'General case' 0 C--O 1.214 -0.775 0 O-C-N 123.395 0.435 . . . . 0.0 111.608 178.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -64.2 -32.31 73.84 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 120.91 0.386 . . . . 0.0 111.52 -178.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 11.4 tpt -67.74 -45.83 73.87 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.706 -178.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.539 HG22 ' O ' ' A' ' 62' ' ' THR . 28.8 m -89.61 -31.77 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 -175.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -75.96 -20.42 57.93 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.987 0.423 . . . . 0.0 111.552 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -90.38 -15.21 31.46 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.327 0.584 . . . . 0.0 110.504 175.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.437 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -77.58 149.16 34.87 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.747 -176.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -76.66 -65.62 0.91 Allowed 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.626 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.4 mtmm -109.52 135.43 50.53 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 -178.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 69.6 mt -104.74 119.93 54.44 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.091 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 175.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.452 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 32.9 mt-10 -113.32 136.56 52.62 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -177.261 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.47 HG12 HG12 ' A' ' 92' ' ' ILE . 33.1 m -110.41 126.15 67.68 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.873 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 176.011 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.494 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 40.8 tt0 -115.62 115.55 26.61 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -92.2 148.98 21.73 Favored 'General case' 0 C--N 1.287 -2.126 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.574 ' HA ' HD13 ' A' ' 7' ' ' LEU . 6.3 t70 -84.63 -178.78 6.98 Favored 'General case' 0 C--O 1.245 0.817 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 -176.494 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -8.07 54.94 Favored 'General case' 0 N--CA 1.44 -0.946 0 N-CA-C 113.612 0.967 . . . . 0.0 113.612 -172.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.406 ' CA ' ' HB3' ' A' ' 117' ' ' PRO . . . -93.32 -98.75 1.49 Allowed Glycine 0 N--CA 1.421 -2.364 0 C-N-CA 120.213 -0.994 . . . . 0.0 112.148 178.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.524 ' NE2' ' HA ' ' A' ' 117' ' ' PRO . 21.9 mp0 -98.71 127.11 44.53 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.295 0.569 . . . . 0.0 112.378 -176.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -89.2 -27.9 20.34 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 174.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.43 ' O ' ' HB3' ' A' ' 80' ' ' GLN . 11.0 p -120.92 148.09 44.55 Favored 'General case' 0 N--CA 1.422 -1.825 0 CA-C-N 114.618 -1.174 . . . . 0.0 109.952 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.498 ' CB ' ' HB2' ' A' ' 87' ' ' ARG . 9.9 t0 -84.37 151.95 24.38 Favored 'General case' 0 C--N 1.297 -1.714 0 N-CA-C 106.803 -1.555 . . . . 0.0 106.803 178.053 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 20.9 pttp -62.38 -20.46 64.46 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 179.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -83.39 -3.68 57.77 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.893 0.378 . . . . 0.0 111.656 175.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 90.71 28.76 15.13 Favored Glycine 0 C--N 1.313 -0.722 0 C-N-CA 120.543 -0.837 . . . . 0.0 111.642 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.498 ' HB2' ' CB ' ' A' ' 83' ' ' ASP . 69.8 mtt180 -100.89 176.98 5.1 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 178.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -104.21 128.96 9.67 Favored Glycine 0 N--CA 1.431 -1.65 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 174.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.435 ' HB3' HD21 ' A' ' 37' ' ' LEU . 76.6 mt -110.01 108.35 18.55 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 117.154 0.477 . . . . 0.0 109.754 -179.493 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.11 167.33 30.76 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-O 121.654 0.74 . . . . 0.0 111.913 -178.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -96.94 127.48 42.95 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 104.332 -2.47 . . . . 0.0 104.332 170.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.47 HG12 HG12 ' A' ' 74' ' ' VAL . 55.3 mt -98.55 126.83 51.58 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.108 0 C-N-CA 117.684 -1.607 . . . . 0.0 111.578 -178.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.452 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 6.2 m-85 -105.77 127.1 52.89 Favored 'General case' 0 N--CA 1.428 -1.555 0 N-CA-C 107.478 -1.305 . . . . 0.0 107.478 176.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.437 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -104.34 99.93 9.64 Favored 'General case' 0 C--N 1.28 -2.451 0 N-CA-C 106.676 -1.601 . . . . 0.0 106.676 179.119 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 12.5 t70 45.39 57.73 4.67 Favored 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 125.797 1.639 . . . . 0.0 110.725 -172.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.87 -25.73 7.29 Favored Glycine 0 CA--C 1.526 0.722 0 CA-C-N 114.475 -1.239 . . . . 0.0 113.952 179.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 88.4 mttt -81.33 114.38 20.07 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -178.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 33.3 ttm -73.99 108.88 7.07 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 120.519 -0.472 . . . . 0.0 110.163 -176.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 44.0 t -66.12 -34.85 72.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 -178.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.422 HD22 ' HB3' ' A' ' 36' ' ' LEU . 26.8 t-20 -57.76 -50.59 72.72 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.938 178.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.437 ' HG3' ' OG ' ' B' ' 141' ' ' SER . 22.4 tt0 -65.86 -42.74 90.03 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.647 175.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.74 -44.11 77.26 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 122.92 0.488 . . . . 0.0 112.286 -178.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 90.0 mt -62.93 -44.09 97.01 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.844 0.354 . . . . 0.0 110.865 178.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.449 ' HA ' ' O ' ' A' ' 109' ' ' ALA . 58.6 t -70.43 -37.4 70.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.25 -179.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 10.3 tpp180 -67.16 -25.78 66.33 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.803 0.841 . . . . 0.0 110.2 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.457 ' O ' ' HB3' ' B' ' 150' ' ' LEU . 25.5 mm-40 -95.42 0.1 53.04 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.501 178.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.467 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 65.09 22.99 69.35 Favored Glycine 0 C--O 1.218 -0.848 0 C-N-CA 121.245 -0.502 . . . . 0.0 112.523 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 82.2 mt -81.67 -21.07 38.35 Favored 'General case' 0 CA--C 1.495 -1.139 0 CA-C-O 121.743 0.782 . . . . 0.0 108.981 179.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.449 ' O ' ' HA ' ' A' ' 104' ' ' VAL . . . -154.86 159.15 40.32 Favored 'General case' 0 N--CA 1.409 -2.524 0 N-CA-C 106.673 -1.603 . . . . 0.0 106.673 -179.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.411 ' HG3' ' HB3' ' A' ' 40' ' ' ASP . 15.4 pttp -121.23 157.86 29.36 Favored 'General case' 0 N--CA 1.416 -2.126 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.7 p -92.77 120.81 42.74 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 119.725 -0.79 . . . . 0.0 112.099 -172.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.45 ' HB2' ' HB2' ' A' ' 40' ' ' ASP . . . -119.0 119.25 33.73 Favored 'General case' 0 N--CA 1.436 -1.148 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.495 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.58 ' HB3' HD22 ' B' ' 132' ' ' ASN . 8.9 p90 -120.11 95.47 4.76 Favored 'General case' 0 N--CA 1.434 -1.228 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 78.0 t -141.5 105.18 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 169.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -174.03 126.11 0.36 Allowed 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.7 mppt? -106.66 144.9 29.96 Favored Pre-proline 0 C--N 1.31 -1.142 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 177.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.524 ' HA ' ' NE2' ' A' ' 80' ' ' GLN . 21.2 Cg_endo -81.68 -85.45 0.0 OUTLIER 'Trans proline' 0 N--CA 1.44 -1.644 0 C-N-CA 121.746 1.63 . . . . 0.0 112.741 177.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -130.22 -46.15 1.11 Allowed 'General case' 0 C--N 1.307 -1.253 0 N-CA-C 107.626 -1.249 . . . . 0.0 107.626 175.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -145.96 -75.82 0.21 Allowed 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.471 177.32 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 44.3 m -108.7 -40.48 5.06 Favored 'General case' 0 C--O 1.249 1.035 0 N-CA-C 105.425 -2.065 . . . . 0.0 105.425 171.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 4.6 p-80 . . . . . 0 N--CA 1.416 -2.132 0 N-CA-C 105.562 -2.014 . . . . 0.0 105.562 164.317 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -0.97 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . 0.426 ' HA ' ' HB3' ' B' ' 126' ' ' TYR . 49.1 m -87.72 86.16 7.14 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-O 121.416 0.627 . . . . 0.0 111.033 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 56.6 t -109.7 -64.58 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 177.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -87.36 -26.01 23.56 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 175.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . 0.426 ' HB3' ' HA ' ' B' ' 123' ' ' SER . 62.1 t80 -75.43 98.71 3.97 Favored 'General case' 0 N--CA 1.427 -1.578 0 CA-C-N 114.364 -1.289 . . . . 0.0 108.325 176.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 16.6 m -109.15 26.64 2.32 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 CA-C-O 121.416 0.627 . . . . 0.0 110.695 -178.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -71.69 93.93 1.31 Allowed 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 114.943 -1.026 . . . . 0.0 111.856 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.458 ' HA ' ' HD3' ' B' ' 130' ' ' PRO . 20.6 pttp -135.56 122.15 14.43 Favored Pre-proline 0 C--N 1.274 -2.703 0 CA-C-N 113.901 -1.5 . . . . 0.0 107.073 167.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' B' ' 129' ' ' LYS . 1.4 Cg_endo -80.66 -148.85 0.04 OUTLIER 'Trans proline' 0 C--O 1.245 0.867 0 C-N-CA 123.088 2.525 . . . . 0.0 112.225 -173.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -80.07 94.65 6.0 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 171.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.58 HD22 ' HB3' ' A' ' 113' ' ' TYR . 40.8 t-20 173.65 76.54 0.0 OUTLIER 'General case' 0 CA--C 1.495 -1.138 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 -179.426 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 9.2 m -83.34 30.12 0.48 Allowed 'General case' 0 C--N 1.275 -2.669 0 CA-C-O 122.668 1.223 . . . . 0.0 108.569 177.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . 0.429 ' H ' ' C ' ' B' ' 132' ' ' ASN . 72.7 m80 -143.49 13.74 1.77 Allowed 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.554 ' O ' ' HG2' ' B' ' 139' ' ' ARG . 12.3 pt-20 -51.7 -46.33 63.87 Favored 'General case' 0 C--N 1.358 0.946 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -171.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -66.37 -38.52 87.75 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 123.091 0.244 . . . . 0.0 111.236 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 79.4 mt -60.93 -48.43 81.86 Favored 'General case' 0 C--O 1.246 0.871 0 CA-C-O 121.913 0.863 . . . . 0.0 109.616 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 44.7 mt -69.69 -37.28 76.55 Favored 'General case' 0 N--CA 1.42 -1.93 0 N-CA-C 113.888 1.069 . . . . 0.0 113.888 -178.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 139' ' ' ARG . . . . . 0.554 ' HG2' ' O ' ' B' ' 135' ' ' GLU . 16.7 ptt-85 -70.7 -28.01 64.43 Favored 'General case' 0 N--CA 1.435 -1.205 0 C-N-CA 119.333 -0.947 . . . . 0.0 112.392 177.05 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -67.57 -41.24 84.46 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 173.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 141' ' ' SER . . . . . 0.437 ' OG ' ' HG3' ' A' ' 101' ' ' GLU . 43.3 m -59.11 -44.78 92.0 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.418 177.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.668 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 40.8 tt0 -66.13 -45.43 81.1 Favored 'General case' 0 N--CA 1.434 -1.249 0 CA-C-N 115.043 -0.981 . . . . 0.0 109.994 179.385 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -51.46 -47.3 63.16 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.894 0.877 . . . . 0.0 112.692 -178.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -64.55 -46.68 81.78 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 123.225 0.328 . . . . 0.0 111.024 177.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -61.07 -37.3 82.2 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.101 -178.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 146' ' ' LYS . . . . . 0.668 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 86.7 mttt -57.71 -48.85 78.42 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.136 0.493 . . . . 0.0 109.819 177.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -72.53 -37.15 68.39 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.439 -174.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -72.64 -12.21 60.95 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.603 178.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . 0.622 ' O ' ' HB2' ' B' ' 154' ' ' SER . 29.0 mmmt 59.74 53.33 4.94 Favored 'General case' 0 CA--C 1.507 -0.676 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 -178.112 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . 0.457 ' HB3' ' O ' ' A' ' 106' ' ' GLN . 79.7 mt -92.17 121.42 33.68 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.09 -177.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 151' ' ' ASN . . . . . 0.467 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 45.9 m-80 50.46 -90.55 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.236 1.815 . . . . 0.0 113.704 176.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 152' ' ' ILE . . . . . 0.521 ' O ' ' HG2' ' B' ' 155' ' ' GLU . 55.1 mt -63.48 -38.0 81.04 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.945 0 CA-C-O 121.407 0.622 . . . . 0.0 109.957 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 153' ' ' TRP . . . . . 0.468 ' CG ' ' HA ' ' B' ' 146' ' ' LYS . 60.5 m95 -79.77 -4.91 54.07 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-O 121.225 0.536 . . . . 0.0 111.574 -176.22 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . 0.622 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 32.5 t -95.62 9.54 39.88 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.724 175.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' B' ' 152' ' ' ILE . 9.2 pt-20 -70.19 -30.56 67.7 Favored 'General case' 0 C--N 1.35 0.59 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 173.26 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 18.0 t70 . . . . . 0 N--CA 1.447 -0.614 0 C-N-CA 126.153 1.781 . . . . 0.0 110.267 178.936 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.497 -1.091 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 20.0 m -80.86 96.98 7.19 Favored 'General case' 0 C--N 1.297 -1.708 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.452 ' O ' ' HE2' ' A' ' 9' ' ' LYS . 16.9 m -95.45 125.93 40.39 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.355 -174.074 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.8 p -132.27 153.93 50.17 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 177.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -87.34 -39.06 15.66 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.684 0.754 . . . . 0.0 109.878 178.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 36.2 ttmt 166.72 -39.35 0.0 OUTLIER 'General case' 0 CA--C 1.49 -1.344 0 N-CA-C 102.661 -3.088 . . . . 0.0 102.661 -171.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 20.5 mt -78.22 167.83 20.78 Favored 'General case' 0 N--CA 1.418 -2.033 0 CA-C-N 110.952 -2.84 . . . . 0.0 106.98 176.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 -125.2 103.11 7.79 Favored 'General case' 0 C--N 1.3 -1.578 0 C-N-CA 120.297 -0.561 . . . . 0.0 111.165 -176.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.452 ' HE2' ' O ' ' A' ' 3' ' ' SER . 64.6 pttt -71.39 154.91 41.21 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.65 176.123 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -139.41 152.52 69.3 Favored Pre-proline 0 C--N 1.277 -2.558 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.529 176.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -77.02 140.36 20.05 Favored 'Trans proline' 0 N--CA 1.447 -1.209 0 C-N-CA 121.989 1.793 . . . . 0.0 111.268 178.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -119.57 166.79 12.69 Favored 'General case' 0 C--N 1.288 -2.079 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 177.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.482 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 11.7 m -105.01 134.43 48.13 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 178.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.467 ' HB2' HD12 ' A' ' 72' ' ' ILE . 64.5 tp -72.99 133.61 44.36 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 120.931 0.396 . . . . 0.0 110.793 -179.131 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 64.8 mt -106.01 -59.11 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.751 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 172.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.4 pttt -170.95 134.02 0.94 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.162 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -95.5 106.25 18.31 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 107.759 -1.201 . . . . 0.0 107.759 174.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 48.3 mm -71.3 -50.13 43.16 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-O 121.399 0.619 . . . . 0.0 109.528 -176.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.498 ' HA ' ' CB ' ' A' ' 59' ' ' SER . 7.5 t70 -139.89 -162.33 1.32 Allowed 'General case' 0 C--N 1.294 -1.83 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 -178.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -91.84 -7.59 64.35 Favored Glycine 0 C--N 1.302 -1.314 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 177.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.456 ' HB2' ' OG1' ' A' ' 41' ' ' THR . 13.8 t70 -95.18 -56.97 2.55 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 113.813 -1.193 . . . . 0.0 110.117 -179.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -111.46 130.12 55.81 Favored 'General case' 0 N--CA 1.419 -2.014 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.014 -176.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.3 p -137.92 138.35 43.96 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 C-N-CA 124.461 1.105 . . . . 0.0 108.281 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.8 tttp -100.11 122.5 43.06 Favored 'General case' 0 C--N 1.293 -1.878 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 -175.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.0 mp -125.71 159.4 32.39 Favored 'General case' 0 CA--C 1.497 -1.066 0 CA-C-O 121.358 0.599 . . . . 0.0 110.477 -178.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.482 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 43.6 ttm -118.0 120.03 36.58 Favored 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 114.737 -1.119 . . . . 0.0 108.368 177.159 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.8 p90 -120.41 114.13 21.36 Favored 'General case' 0 C--N 1.295 -1.782 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 59.1 mttp 60.95 27.45 17.31 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.821 0.848 . . . . 0.0 111.856 -177.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.13 2.76 64.01 Favored Glycine 0 C--N 1.314 -0.669 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.684 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 26' ' ' MET . 42.5 mt-30 -97.97 109.27 50.78 Favored Pre-proline 0 C--N 1.313 -0.983 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 177.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 30' ' ' GLN . 14.0 Cg_endo -88.86 106.4 0.45 Allowed 'Trans proline' 0 N--CA 1.443 -1.46 0 C-N-CA 122.732 2.288 . . . . 0.0 111.949 179.261 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -119.81 145.45 46.61 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.037 178.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 10.6 m -85.47 104.5 15.31 Favored 'General case' 0 N--CA 1.42 -1.958 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 175.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -95.19 142.77 27.23 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-O 121.481 0.658 . . . . 0.0 111.155 -174.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.41 ' HD3' ' OD1' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -113.12 132.85 55.28 Favored 'General case' 0 C--N 1.275 -2.635 0 N-CA-C 104.416 -2.438 . . . . 0.0 104.416 174.016 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.511 ' HB2' ' HB ' ' A' ' 39' ' ' VAL . 6.6 mp -66.57 130.33 42.82 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -175.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 71.2 mt -62.11 127.36 30.98 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.787 174.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.404 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 74.4 mt 75.18 8.22 4.02 Favored 'General case' 0 C--O 1.221 -0.429 0 O-C-N 124.751 1.282 . . . . 0.0 113.062 176.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.511 ' HB ' ' HB2' ' A' ' 36' ' ' LEU . 84.9 t -118.12 125.8 74.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -135.56 123.57 22.79 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 178.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.456 ' OG1' ' HB2' ' A' ' 21' ' ' ASP . 73.8 p -108.19 -44.18 0.11 Allowed Pre-proline 0 CA--C 1.569 1.701 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 178.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -87.08 89.75 0.6 Allowed 'Trans proline' 0 C--N 1.378 2.095 0 C-N-CA 121.405 1.403 . . . . 0.0 111.271 -178.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.49 171.75 10.3 Favored 'General case' 0 C--N 1.295 -1.776 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.271 178.417 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.7 t -156.85 83.19 0.95 Allowed 'General case' 0 N--CA 1.407 -2.591 0 CA-C-O 122.486 1.136 . . . . 0.0 109.9 170.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -74.71 -27.94 60.59 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 114.966 -1.015 . . . . 0.0 108.273 174.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 50.9 t-80 -169.83 -53.12 0.0 OUTLIER Pre-proline 0 C--N 1.309 -1.195 0 CA-C-N 114.321 -1.309 . . . . 0.0 109.921 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -59.54 149.32 82.83 Favored 'Trans proline' 0 C--N 1.384 2.439 0 C-N-CA 121.812 1.675 . . . . 0.0 111.714 176.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -83.24 -26.54 30.66 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 122.011 0.91 . . . . 0.0 109.067 -177.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -86.98 -10.58 52.85 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.784 -177.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.83 -107.81 2.32 Favored Glycine 0 N--CA 1.432 -1.604 0 N-CA-C 109.381 -1.488 . . . . 0.0 109.381 -175.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 23.6 t -107.58 95.46 3.82 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.648 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 176.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -46.94 -61.91 1.65 Allowed 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -170.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -84.92 -25.16 28.08 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -172.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -88.93 -23.78 22.61 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.983 -0.687 . . . . 0.0 112.316 -174.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -54.94 -51.27 54.69 Favored Glycine 0 CA--C 1.539 1.577 0 CA-C-N 116.039 -0.528 . . . . 0.0 112.847 176.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -55.9 -22.99 40.39 Favored 'Trans proline' 0 C--N 1.37 1.675 0 C-N-CA 123.073 2.516 . . . . 0.0 114.237 176.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -86.3 -36.13 19.5 Favored 'General case' 0 C--O 1.209 -1.066 0 C-N-CA 120.113 -0.635 . . . . 0.0 109.817 178.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.35 -43.3 92.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.505 0.669 . . . . 0.0 110.16 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.498 ' CB ' ' HA ' ' A' ' 19' ' ' ASP . 8.8 p -68.05 -40.4 82.83 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.22 178.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.07 -46.63 64.55 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.13 -177.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -56.2 -44.78 79.77 Favored 'General case' 0 CA--C 1.507 -0.702 0 C-N-CA 123.795 0.838 . . . . 0.0 110.075 -179.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.442 ' O ' HG22 ' A' ' 66' ' ' VAL . 39.5 m -62.15 -45.17 94.61 Favored 'General case' 0 N--CA 1.439 -1.024 0 O-C-N 123.992 0.808 . . . . 0.0 110.591 179.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.533 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 49.1 mttp -58.0 -54.55 45.7 Favored 'General case' 0 C--O 1.212 -0.917 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 176.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -60.07 -33.86 72.65 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.509 -0.768 . . . . 0.0 112.046 -176.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.12 -51.44 21.39 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 179.741 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.442 HG22 ' O ' ' A' ' 62' ' ' THR . 32.8 m -71.5 -26.23 26.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -176.357 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.533 ' HG2' ' O ' ' A' ' 63' ' ' LYS . 79.9 mm-40 -71.9 -35.18 69.64 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.782 0.801 . . . . 0.0 109.191 174.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -73.59 -41.56 62.72 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.2 -178.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -67.13 146.64 54.05 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -177.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.8 mptt -78.09 -60.08 2.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.911 0.862 . . . . 0.0 108.714 179.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -107.06 128.08 54.05 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.521 -174.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.467 HD12 ' HB2' ' A' ' 14' ' ' LEU . 60.3 mt -100.56 124.11 53.91 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.345 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 170.382 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.568 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 21.5 mt-10 -112.34 133.38 54.47 Favored 'General case' 0 C--N 1.291 -1.967 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -173.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 28.9 m -111.97 129.51 67.3 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.187 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.969 179.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -128.93 142.58 50.89 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -110.13 116.29 31.28 Favored 'General case' 0 N--CA 1.423 -1.795 0 N-CA-C 110.552 -0.166 . . . . 0.0 110.552 177.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -102.29 -175.15 2.75 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 178.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.9 64.61 4.8 Favored 'General case' 0 N--CA 1.441 -0.895 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 -172.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -128.27 -106.31 1.31 Allowed Glycine 0 C--N 1.292 -1.9 0 CA-C-N 114.779 -1.101 . . . . 0.0 110.477 174.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.44 ' HG2' ' HB2' ' A' ' 115' ' ' TYR . 14.5 mm100 -137.91 145.94 42.71 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 -99.3 -10.06 22.81 Favored 'General case' 0 N--CA 1.443 -0.778 0 C-N-CA 120.356 -0.538 . . . . 0.0 109.736 178.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.448 ' HA ' ' HA2' ' A' ' 88' ' ' GLY . 40.1 p -134.3 137.08 43.96 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-O 120.857 0.36 . . . . 0.0 110.528 177.051 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.507 ' HB3' ' HB2' ' A' ' 87' ' ' ARG . 24.5 t0 -94.8 127.43 40.8 Favored 'General case' 0 CA--C 1.493 -1.22 0 N-CA-C 104.697 -2.334 . . . . 0.0 104.697 172.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -74.9 62.35 1.1 Allowed 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 114.841 1.422 . . . . 0.0 114.841 -166.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -135.58 7.24 3.28 Favored 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 126.381 1.872 . . . . 0.0 107.236 173.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 86.33 28.86 26.45 Favored Glycine 0 N--CA 1.441 -1.027 0 N-CA-C 109.149 -1.58 . . . . 0.0 109.149 -171.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.507 ' HB2' ' HB3' ' A' ' 83' ' ' ASP . 98.4 mtt180 -110.34 177.66 4.63 Favored 'General case' 0 C--N 1.309 -1.169 0 C-N-CA 123.901 0.881 . . . . 0.0 110.311 -177.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.448 ' HA2' ' HA ' ' A' ' 82' ' ' THR . . . -119.01 162.5 13.47 Favored Glycine 0 N--CA 1.421 -2.351 0 N-CA-C 108.971 -1.652 . . . . 0.0 108.971 174.046 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 74.8 mt -134.16 129.51 35.93 Favored 'General case' 0 C--N 1.29 -1.993 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 176.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -153.16 157.66 40.64 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.078 0.466 . . . . 0.0 110.004 179.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -90.96 112.31 24.14 Favored 'General case' 0 C--N 1.294 -1.841 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 176.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 45.6 mm -98.81 126.56 51.97 Favored 'Isoleucine or valine' 0 C--O 1.257 1.451 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -170.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.568 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 4.4 m-85 -112.98 152.75 29.03 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 106.133 -1.803 . . . . 0.0 106.133 173.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -130.32 100.07 5.25 Favored 'General case' 0 C--N 1.28 -2.438 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 175.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.7 t70 45.63 58.02 4.57 Favored 'General case' 0 C--O 1.244 0.793 0 C-N-CA 125.017 1.327 . . . . 0.0 113.298 -179.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.86 -25.12 23.15 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.382 -0.913 . . . . 0.0 114.432 176.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -100.29 150.33 22.67 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 117.551 0.676 . . . . 0.0 109.304 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 58.6 mtm -97.13 119.87 36.43 Favored 'General case' 0 N--CA 1.414 -2.238 0 C-N-CA 120.336 -0.546 . . . . 0.0 111.429 178.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 38.4 t -63.38 -37.93 80.81 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.27 0 CA-C-N 114.621 -1.172 . . . . 0.0 108.404 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -59.24 -42.61 91.47 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-N 114.527 -1.215 . . . . 0.0 110.851 177.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -65.57 -56.09 14.17 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.85 -51.01 62.6 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.775 0.83 . . . . 0.0 112.636 -176.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 90.0 mt -58.15 -45.55 87.2 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 60.8 t -73.23 -36.81 50.66 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.04 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 30.0 mmt180 -65.97 -34.52 78.3 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 122.544 0.338 . . . . 0.0 111.541 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -87.14 2.16 50.73 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.645 178.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.04 33.19 86.51 Favored Glycine 0 C--O 1.226 -0.406 0 CA-C-N 116.34 -0.391 . . . . 0.0 112.995 177.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.3 mt -105.32 4.28 30.77 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 120.882 0.372 . . . . 0.0 110.559 -178.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -155.84 160.16 39.97 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.515 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -112.61 171.77 7.32 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 7.3 p -78.15 126.04 38.12 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.724 0 CA-C-O 121.476 0.655 . . . . 0.0 110.185 178.144 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -89.5 122.13 32.38 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.602 178.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.542 ' HB2' ' HG3' ' A' ' 116' ' ' LYS . 5.0 p90 -82.71 98.38 9.04 Favored 'General case' 0 C--N 1.29 -2.018 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.36 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 60.5 t -102.34 141.38 18.6 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.354 -174.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.514 ' O ' ' HB3' ' B' ' 130' ' ' PRO . 12.0 t80 59.1 54.81 4.71 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.224 1.41 . . . . 0.0 109.84 177.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.542 ' HG3' ' HB2' ' A' ' 113' ' ' TYR . 71.5 mmtt -110.21 118.5 49.29 Favored Pre-proline 0 C--N 1.292 -1.912 0 CA-C-N 115.118 -0.946 . . . . 0.0 112.143 -172.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -89.07 20.14 1.16 Allowed 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.781 2.987 . . . . 0.0 110.707 178.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 66.35 62.95 0.55 Allowed 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 124.708 1.203 . . . . 0.0 109.565 -179.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 60.93 10.03 2.58 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 125.502 1.521 . . . . 0.0 112.06 179.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 13.7 m 65.4 29.7 11.27 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-O 122.954 1.359 . . . . 0.0 108.309 -175.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 64.3 t60 . . . . . 0 N--CA 1.425 -1.684 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 177.841 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.94 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 17.8 t -80.71 135.99 36.09 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 64.7 t -64.89 -39.51 85.92 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 CA-C-O 121.185 0.516 . . . . 0.0 110.231 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -116.74 106.17 13.21 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.405 179.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -78.03 96.58 5.13 Favored 'General case' 0 N--CA 1.422 -1.863 0 CA-C-O 121.899 0.857 . . . . 0.0 111.994 178.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 1.6 p -60.82 -33.92 57.2 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 CA-C-N 113.565 -1.652 . . . . 0.0 111.531 179.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 33.2 t80 74.12 -15.21 0.62 Allowed 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 125.047 1.339 . . . . 0.0 113.394 171.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.445 ' HB3' ' HD3' ' B' ' 130' ' ' PRO . 41.2 ttmt -67.08 -48.27 49.72 Favored Pre-proline 0 CA--C 1.562 1.434 0 CA-C-O 119.294 -0.384 . . . . 0.0 111.829 174.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . 0.514 ' HB3' ' O ' ' A' ' 115' ' ' TYR . 25.1 Cg_exo -70.72 -172.73 0.71 Allowed 'Trans proline' 0 C--N 1.383 2.346 0 C-N-CA 122.183 1.922 . . . . 0.0 110.548 174.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -82.68 84.92 7.13 Favored 'General case' 0 N--CA 1.437 -1.104 0 C-N-CA 118.307 -1.357 . . . . 0.0 109.87 179.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.403 ' HA ' ' HB3' ' B' ' 135' ' ' GLU . 14.9 m120 -100.64 -19.36 16.13 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.957 176.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 6.9 p -50.93 -57.14 9.28 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 125.486 1.515 . . . . 0.0 113.446 -173.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 -99.1 -9.73 23.47 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.486 ' CG ' ' HE ' ' B' ' 139' ' ' ARG . 43.6 tt0 -62.28 -45.84 91.46 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.798 -177.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -57.86 -38.44 75.73 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.294 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 85.1 mt -67.02 -50.04 63.4 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.187 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.03 -26.51 65.91 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 139' ' ' ARG . . . . . 0.486 ' HE ' ' CG ' ' B' ' 135' ' ' GLU . 47.7 mtt180 -76.24 -22.25 55.4 Favored 'General case' 0 C--O 1.211 -0.971 0 C-N-CA 119.788 -0.765 . . . . 0.0 110.733 175.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -74.08 -32.0 63.06 Favored 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 172.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 13.6 m -65.85 -44.8 84.39 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.253 -0.885 . . . . 0.0 108.629 174.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.466 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 0.0 OUTLIER -64.99 -38.86 92.37 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.047 176.75 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -58.59 -39.79 81.36 Favored 'General case' 0 C--O 1.243 0.76 0 C-N-CA 122.7 0.4 . . . . 0.0 110.937 177.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 144' ' ' GLN . . . . . 0.445 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 53.8 tt0 -69.18 -48.56 61.86 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.836 179.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -64.25 -34.35 77.91 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.223 -175.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 146' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 80.7 mttt -58.32 -50.22 74.4 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.065 0.459 . . . . 0.0 111.124 174.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -70.46 -22.76 62.65 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.127 -177.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . 0.475 ' HB2' ' HG ' ' B' ' 150' ' ' LEU . 34.5 mm-40 -89.57 -7.71 54.25 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.31 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . 0.575 ' O ' ' HB2' ' B' ' 154' ' ' SER . 30.5 mmmt 52.08 52.51 14.23 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.543 1.137 . . . . 0.0 109.02 -177.024 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . 0.475 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 95.5 mt -88.36 113.38 23.9 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.23 -177.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 54.61 -89.26 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 125.841 1.656 . . . . 0.0 114.072 172.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 22.4 mt -65.01 -36.66 78.35 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.128 0 CA-C-O 121.049 0.452 . . . . 0.0 110.444 178.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 64.5 m95 -77.59 -9.25 58.84 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-O 121.523 0.678 . . . . 0.0 111.286 -177.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . 0.575 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 32.9 t -92.66 10.59 29.95 Favored 'General case' 0 N--CA 1.428 -1.575 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.574 175.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . 0.413 ' HG3' ' N ' ' B' ' 156' ' ' ASP . 6.6 pt-20 -55.14 -37.7 67.29 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 121.24 0.543 . . . . 0.0 110.418 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 156' ' ' ASP . . . . . 0.413 ' N ' ' HG3' ' B' ' 155' ' ' GLU . 29.4 t70 . . . . . 0 N--CA 1.423 -1.805 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -177.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.508 -0.651 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.8 p -81.05 82.81 6.9 Favored 'General case' 0 N--CA 1.424 -1.749 0 CA-C-O 121.976 0.893 . . . . 0.0 111.789 -178.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.2 p -103.97 -22.1 13.52 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.1 -0.955 . . . . 0.0 110.234 177.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 21.3 m -134.85 139.53 45.12 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 107.322 -1.362 . . . . 0.0 107.322 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 6' ' ' LYS . 3.6 mptp? -86.52 -101.89 0.07 Allowed 'General case' 0 C--O 1.24 0.596 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 177.279 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 5' ' ' LYS . 22.9 tptm 165.23 125.66 0.01 OUTLIER 'General case' 0 CA--C 1.507 -0.698 0 C-N-CA 124.984 1.314 . . . . 0.0 107.64 178.347 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 88.2 mt -86.57 139.59 30.69 Favored 'General case' 0 C--N 1.292 -1.914 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 172.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -74.4 103.02 4.62 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -176.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.7 tptm -108.13 131.88 54.17 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 114.712 -1.131 . . . . 0.0 108.569 -177.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -128.38 144.76 53.15 Favored Pre-proline 0 C--N 1.303 -1.43 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_exo -81.09 138.48 11.36 Favored 'Trans proline' 0 N--CA 1.447 -1.215 0 C-N-CA 121.89 1.726 . . . . 0.0 108.762 170.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -130.36 141.0 50.58 Favored 'General case' 0 C--N 1.289 -2.043 0 CA-C-O 121.152 0.501 . . . . 0.0 111.747 -177.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.486 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 38.0 m -90.23 127.24 36.08 Favored 'General case' 0 N--CA 1.416 -2.149 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 176.219 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.0 tp -78.47 129.71 35.2 Favored 'General case' 0 C--N 1.298 -1.674 0 CA-C-O 120.623 0.249 . . . . 0.0 111.317 -177.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 71.7 mt -93.83 -56.94 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.625 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 175.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.448 ' HE3' ' HA ' ' A' ' 16' ' ' LYS . 1.8 tpmt? -175.2 145.22 0.77 Allowed 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 179.006 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.438 ' HA ' HG23 ' A' ' 23' ' ' VAL . . . -94.71 112.72 24.46 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 173.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.4 mp -82.75 -63.31 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.04 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 -173.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.417 ' HA ' ' HB3' ' A' ' 59' ' ' SER . 8.1 t70 -114.47 -164.07 0.91 Allowed 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 -176.222 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.67 -29.58 38.82 Favored Glycine 0 C--N 1.304 -1.215 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 -178.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.619 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 2.4 p30 -104.62 -30.44 9.97 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 120.869 -0.332 . . . . 0.0 111.452 178.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.75 116.14 31.95 Favored 'General case' 0 N--CA 1.435 -1.204 0 CA-C-O 121.84 0.829 . . . . 0.0 112.472 -175.064 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.438 HG23 ' HA ' ' A' ' 17' ' ' ALA . 3.5 p -131.85 142.32 43.32 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 -178.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.2 tttp -104.34 118.89 37.71 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 121.607 -0.683 . . . . 0.0 109.561 -173.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.457 HD11 HG21 ' A' ' 72' ' ' ILE . 3.6 mm? -119.06 159.3 24.16 Favored 'General case' 0 CA--C 1.502 -0.892 0 CA-C-O 121.731 0.777 . . . . 0.0 111.6 -178.224 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.486 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 46.0 ttm -121.7 102.15 8.03 Favored 'General case' 0 C--N 1.285 -2.214 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 174.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -105.29 117.62 34.47 Favored 'General case' 0 C--N 1.292 -1.913 0 C-N-CA 119.23 -0.988 . . . . 0.0 109.473 -176.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 95.9 mttt 61.96 30.62 18.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.748 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.02 -2.55 69.14 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 115.139 -0.937 . . . . 0.0 113.488 177.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.404 ' O ' ' HA ' ' A' ' 26' ' ' MET . 34.4 tt0 -103.84 112.48 65.57 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 117.013 0.406 . . . . 0.0 111.091 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -79.64 116.09 3.47 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 122.52 2.147 . . . . 0.0 111.924 177.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 51.0 ttm -136.43 141.2 43.58 Favored 'General case' 0 N--CA 1.423 -1.82 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.9 m -82.79 122.56 28.36 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 176.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.458 ' HA ' ' O ' ' A' ' 88' ' ' GLY . 56.4 m-85 -112.2 160.78 17.26 Favored 'General case' 0 N--CA 1.423 -1.796 0 CA-C-O 121.852 0.834 . . . . 0.0 112.762 -176.059 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.619 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 37.7 mtt180 -119.54 148.31 43.45 Favored 'General case' 0 C--N 1.288 -2.086 0 CA-C-N 113.508 -1.678 . . . . 0.0 106.565 167.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.406 ' HB2' HG21 ' A' ' 39' ' ' VAL . 5.9 mp -77.49 135.96 38.3 Favored 'General case' 0 C--N 1.289 -2.057 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.982 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.517 HD21 HD13 ' A' ' 89' ' ' LEU . 22.9 mt -70.34 152.73 43.82 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.357 175.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.5 HD22 ' CD2' ' A' ' 113' ' ' TYR . 3.6 mt 68.28 19.86 8.9 Favored 'General case' 0 C--O 1.212 -0.919 0 C-N-CA 125.964 1.706 . . . . 0.0 110.98 177.116 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.406 HG21 ' HB2' ' A' ' 36' ' ' LEU . 66.0 t -110.04 125.12 67.25 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 CA-C-O 121.27 0.557 . . . . 0.0 109.671 -178.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.551 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 26.6 t70 -98.33 108.07 20.69 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 105.601 -2.0 . . . . 0.0 105.601 173.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.442 HG21 ' NH2' ' A' ' 35' ' ' ARG . 5.0 t -83.37 139.49 41.68 Favored Pre-proline 0 C--N 1.288 -2.09 0 CA-C-N 114.697 -1.138 . . . . 0.0 111.698 -173.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -71.55 -9.22 24.73 Favored 'Trans proline' 0 N--CA 1.452 -0.914 0 C-N-CA 122.424 2.083 . . . . 0.0 112.091 177.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -125.14 127.29 46.62 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-O 121.777 0.799 . . . . 0.0 110.535 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.0 t -175.44 -33.05 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 124.903 1.281 . . . . 0.0 107.984 177.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 55.3 mttp -71.65 -16.45 62.26 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.182 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . 0.28 43.7 m-70 61.51 80.89 0.25 Allowed Pre-proline 0 CA--C 1.495 -1.142 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 179.095 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -71.72 154.04 59.25 Favored 'Trans proline' 0 N--CA 1.441 -1.616 0 N-CA-C 105.615 -2.494 . . . . 0.0 105.615 164.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.6 mtpt -54.09 -49.51 68.91 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 -172.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -100.37 11.71 38.81 Favored 'General case' 0 C--N 1.287 -2.128 0 CA-C-O 121.458 0.647 . . . . 0.0 110.622 178.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 75.93 -167.25 54.66 Favored Glycine 0 N--CA 1.437 -1.282 0 CA-C-N 114.915 -1.039 . . . . 0.0 111.652 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 29.6 t -99.35 86.54 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.229 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 176.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -65.81 -26.12 67.54 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.734 -170.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.48 -14.58 58.15 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 177.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -115.01 -48.61 2.82 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -60.15 -59.43 10.4 Favored Glycine 0 CA--C 1.535 1.328 0 CA-C-O 119.229 -0.761 . . . . 0.0 114.545 -175.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -55.49 -34.03 88.18 Favored 'Trans proline' 0 C--N 1.364 1.351 0 C-N-CA 123.051 2.501 . . . . 0.0 113.514 178.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -71.26 -48.43 51.02 Favored 'General case' 0 C--O 1.244 0.808 0 CA-C-O 121.071 0.462 . . . . 0.0 110.446 178.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.525 ' HA ' HD13 ' A' ' 108' ' ' LEU . . . -65.07 -40.12 94.23 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.519 -178.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.476 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 29.8 p -65.28 -43.92 89.67 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.721 -178.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.27 -37.16 86.49 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.089 0.471 . . . . 0.0 110.706 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -67.95 -47.55 68.33 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.878 179.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.565 ' O ' HG22 ' A' ' 66' ' ' VAL . 58.5 m -58.84 -41.65 87.45 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.09 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 59' ' ' SER . 48.2 mttp -54.24 -54.71 36.29 Favored 'General case' 0 C--N 1.35 0.615 0 O-C-N 123.233 0.333 . . . . 0.0 110.848 178.353 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -66.39 -32.01 73.13 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.335 -176.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 17.4 tpt -67.0 -51.08 59.44 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.972 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 62' ' ' THR . 29.6 m -83.51 -27.53 7.6 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -175.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -81.46 -20.29 40.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -85.18 -20.63 29.92 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.585 0.707 . . . . 0.0 110.619 178.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -77.97 160.47 28.17 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.034 178.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -84.6 -57.95 2.92 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -105.46 144.19 32.57 Favored 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.081 -174.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.457 HG21 HD11 ' A' ' 25' ' ' LEU . 4.0 mp -116.86 120.39 64.9 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.811 0 N-CA-C 105.987 -1.857 . . . . 0.0 105.987 174.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.496 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 22.5 mt-10 -112.81 133.28 54.88 Favored 'General case' 0 C--N 1.279 -2.466 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -175.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 30.2 m -110.87 122.75 65.93 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.321 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 176.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -118.26 140.36 49.93 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-O 121.326 0.584 . . . . 0.0 111.374 -176.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.403 ' CD1' ' HB2' ' A' ' 81' ' ' ARG . 34.2 t80 -104.76 126.28 51.68 Favored 'General case' 0 N--CA 1.421 -1.923 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.897 179.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -85.68 -173.47 4.65 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 178.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -71.78 -12.29 61.23 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.903 -0.498 . . . . 0.0 112.091 -175.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -79.79 -118.05 0.31 Allowed Glycine 0 CA--C 1.525 0.708 0 N-CA-C 114.557 0.583 . . . . 0.0 114.557 -178.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -124.36 153.34 41.98 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 -176.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.403 ' HB2' ' CD1' ' A' ' 76' ' ' PHE . 43.0 ttm180 -106.97 -15.63 14.65 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 121.832 0.825 . . . . 0.0 108.876 174.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 2.2 p -101.87 133.79 46.09 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.96 178.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -100.05 149.3 23.63 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.214 178.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -61.84 -26.89 68.4 Favored 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 124.855 1.262 . . . . 0.0 112.478 -175.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -78.48 -5.49 52.7 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 121.464 0.65 . . . . 0.0 110.215 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 85.78 56.68 2.3 Favored Glycine 0 N--CA 1.431 -1.658 0 N-CA-C 109.407 -1.477 . . . . 0.0 109.407 -178.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 9.7 tpp180 -142.89 149.48 38.54 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 -177.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.458 ' O ' ' HA ' ' A' ' 34' ' ' PHE . . . -95.53 142.43 16.09 Favored Glycine 0 N--CA 1.432 -1.573 0 N-CA-C 109.18 -1.568 . . . . 0.0 109.18 175.446 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.517 HD13 HD21 ' A' ' 37' ' ' LEU . 0.4 OUTLIER -134.38 135.15 42.45 Favored 'General case' 0 N--CA 1.419 -1.987 0 CA-C-N 117.9 0.85 . . . . 0.0 112.504 177.06 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -152.49 156.49 39.51 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -83.31 130.73 35.08 Favored 'General case' 0 N--CA 1.434 -1.259 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 178.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 60.5 mt -103.72 126.54 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.025 0 CA-C-O 121.563 0.697 . . . . 0.0 112.02 -175.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.496 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 79.1 m-85 -107.43 132.44 53.18 Favored 'General case' 0 N--CA 1.423 -1.805 0 N-CA-C 107.203 -1.406 . . . . 0.0 107.203 172.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.27 99.36 8.97 Favored 'General case' 0 C--N 1.285 -2.237 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 177.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.3 t70 45.83 53.25 9.04 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 125.155 1.382 . . . . 0.0 111.355 -176.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 84.1 -5.02 81.65 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-N 115.617 -0.72 . . . . 0.0 114.641 179.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -96.89 141.07 30.52 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 117.927 0.863 . . . . 0.0 109.681 177.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 62.9 mtm -84.29 110.58 18.69 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-O 121.37 0.605 . . . . 0.0 110.901 179.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 54.9 t -65.94 -42.2 91.4 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 CA-C-N 114.525 -1.216 . . . . 0.0 111.49 -176.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -69.41 -30.41 68.36 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.057 0.456 . . . . 0.0 110.46 -178.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -62.12 -38.47 89.07 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 175.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -69.58 -36.72 76.52 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.237 178.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 89.2 mt -64.02 -44.16 93.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.35 177.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 66.3 t -69.74 -32.5 52.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 121.018 0.437 . . . . 0.0 110.27 178.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.93 -17.25 64.4 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.265 0.555 . . . . 0.0 111.008 179.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -108.86 -3.68 17.44 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 121.086 0.469 . . . . 0.0 110.033 176.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.537 ' HA3' ' O ' ' B' ' 150' ' ' LEU . . . 63.08 42.47 99.54 Favored Glycine 0 N--CA 1.437 -1.244 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.034 -177.191 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.525 HD13 ' HA ' ' A' ' 58' ' ' ALA . 75.8 mt -90.68 -20.57 22.34 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 121.006 0.432 . . . . 0.0 110.39 -179.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -155.1 173.51 16.49 Favored 'General case' 0 N--CA 1.433 -1.275 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.523 -177.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.551 ' HB2' ' HB3' ' A' ' 40' ' ' ASP . 89.6 mttt -118.14 168.78 10.25 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 105.472 -2.048 . . . . 0.0 105.472 178.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 11.6 m -106.83 127.84 62.07 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 C-N-CA 117.378 -1.729 . . . . 0.0 111.937 178.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.494 ' HB2' ' HB2' ' A' ' 40' ' ' ASP . . . -114.01 119.64 37.88 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 175.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.5 ' CD2' HD22 ' A' ' 38' ' ' LEU . 1.8 t80 -120.45 120.49 36.05 Favored 'General case' 0 C--N 1.286 -2.195 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 -176.28 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 90.7 t -88.63 108.43 18.84 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.79 0 C-N-CA 119.702 -0.799 . . . . 0.0 109.751 176.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.539 ' HA ' ' HB2' ' B' ' 131' ' ' ASN . 23.7 p90 -85.54 162.41 18.91 Favored 'General case' 0 N--CA 1.395 -3.19 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 170.006 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.8 mppt? 82.07 140.68 0.06 OUTLIER Pre-proline 0 C--N 1.318 -0.801 0 C-N-CA 125.151 1.38 . . . . 0.0 108.274 -164.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -53.23 -52.8 7.89 Favored 'Trans proline' 0 C--O 1.247 0.925 0 C-N-CA 122.106 1.871 . . . . 0.0 112.712 -178.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 61.24 22.08 12.47 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.761 0.824 . . . . 0.0 112.584 176.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -123.55 87.81 2.81 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 72.9 p 72.23 1.92 4.13 Favored 'General case' 0 C--N 1.308 -1.232 0 C-N-CA 127.111 2.164 . . . . 0.0 112.007 -176.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 1.6 p80 . . . . . 0 N--CA 1.434 -1.261 0 N-CA-C 106.627 -1.619 . . . . 0.0 106.627 177.097 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.325 0 N-CA-C 110.526 -1.03 . . . . 0.0 110.526 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 40.5 m 68.52 -57.04 0.5 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.971 1.309 . . . . 0.0 113.72 178.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 30.1 m -72.72 -45.09 58.35 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.092 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -176.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -116.06 94.78 4.8 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-O 121.477 0.656 . . . . 0.0 110.61 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -144.69 -64.42 0.35 Allowed 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.142 177.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 14.5 p -100.12 119.11 47.76 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.167 0 CA-C-O 121.972 0.891 . . . . 0.0 110.642 -173.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -101.27 -8.16 22.39 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.662 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -88.71 108.19 21.64 Favored Pre-proline 0 C--N 1.306 -1.284 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 173.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -52.36 -56.47 2.85 Favored 'Trans proline' 0 C--O 1.243 0.762 0 C-N-CA 122.373 2.049 . . . . 0.0 112.082 -177.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 131' ' ' ASN . . . . . 0.539 ' HB2' ' HA ' ' A' ' 115' ' ' TYR . 2.6 m-20 -101.49 95.08 6.24 Favored 'General case' 0 N--CA 1.427 -1.583 0 N-CA-C 107.605 -1.258 . . . . 0.0 107.605 178.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -142.26 12.66 1.98 Allowed 'General case' 0 C--N 1.293 -1.848 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 177.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 1.6 m -47.98 -44.34 30.42 Favored 'General case' 0 N--CA 1.441 -0.92 0 C-N-CA 126.784 2.033 . . . . 0.0 112.661 -172.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 88.6 m-70 -128.19 11.3 6.44 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.689 179.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -67.45 -50.27 59.98 Favored 'General case' 0 CA--C 1.501 -0.904 0 N-CA-C 112.921 0.711 . . . . 0.0 112.921 -172.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . 0.489 ' O ' ' HG3' ' B' ' 140' ' ' LYS . 72.7 mt-30 -52.24 -45.33 65.3 Favored 'General case' 0 C--N 1.314 -0.939 0 O-C-N 124.07 0.856 . . . . 0.0 111.784 -175.429 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 86.9 mt -63.59 -50.3 69.98 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 120.828 0.346 . . . . 0.0 110.871 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.64 -38.9 87.84 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.688 -178.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 77.0 mtt-85 -75.24 -29.15 60.14 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -176.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' B' ' 136' ' ' GLN . 63.5 mttm -70.56 -34.42 72.2 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.546 174.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 47.4 m -67.13 -41.75 85.62 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.489 174.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.522 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 40.0 tt0 -57.47 -52.77 64.03 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.427 176.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -51.84 -49.38 62.96 Favored 'General case' 0 C--O 1.24 0.558 0 O-C-N 123.782 0.676 . . . . 0.0 111.525 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 144' ' ' GLN . . . . . 0.47 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 27.5 tt0 -61.93 -47.19 86.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.417 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -63.28 -36.77 84.79 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 123.536 0.734 . . . . 0.0 111.746 -177.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 146' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 87.7 mttt -57.62 -48.81 78.41 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.344 0.593 . . . . 0.0 109.844 176.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -66.11 -32.33 73.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.858 -178.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 22.4 mm-40 -73.51 -20.58 60.63 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.456 178.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt 54.93 65.01 1.62 Allowed 'General case' 0 CA--C 1.506 -0.733 0 C-N-CA 124.501 1.12 . . . . 0.0 110.615 -172.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . 0.537 ' O ' ' HA3' ' A' ' 107' ' ' GLY . 95.7 mt -89.33 108.19 19.49 Favored 'General case' 0 C--N 1.301 -1.528 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.092 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 151' ' ' ASN . . . . . 0.408 ' HB3' ' O ' ' A' ' 107' ' ' GLY . 61.5 t30 48.45 -81.64 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 126.635 1.974 . . . . 0.0 114.525 175.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 12.6 tt -72.85 -25.15 21.83 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.499 0 CA-C-O 121.475 0.655 . . . . 0.0 109.833 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 153' ' ' TRP . . . . . 0.494 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 52.4 m95 -82.08 -4.74 57.51 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-O 121.783 0.802 . . . . 0.0 109.243 178.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 11.7 t -110.27 31.92 5.54 Favored 'General case' 0 N--CA 1.407 -2.606 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 175.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -69.67 -26.52 64.42 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 119.61 -0.836 . . . . 0.0 109.636 176.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 . . . . . 0 C--O 1.237 0.435 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 173.237 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.612 0 CA-C-O 120.647 0.261 . . . . 0.0 111.043 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 34.5 m 63.29 67.7 0.65 Allowed 'General case' 0 C--O 1.248 1.022 0 CA-C-O 122.754 1.264 . . . . 0.0 109.385 -174.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 44.9 m -89.31 -175.52 4.78 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 114.202 -1.363 . . . . 0.0 109.973 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.9 m -72.76 91.18 1.46 Allowed 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -174.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -97.18 98.85 10.37 Favored 'General case' 0 N--CA 1.427 -1.609 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 170.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.415 ' HD3' ' O ' ' A' ' 6' ' ' LYS . 2.6 tmtp? -97.59 -36.38 10.3 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -178.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.528 HD13 ' HB2' ' A' ' 77' ' ' ASP . 40.3 mt -130.28 -149.76 0.41 Allowed 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 114.974 -1.012 . . . . 0.0 108.451 -176.172 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 67.7 t60 -98.13 104.84 16.91 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -179.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 75' ' ' GLU . 0.2 OUTLIER -106.83 153.56 22.3 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.158 0.504 . . . . 0.0 110.06 179.246 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.434 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 7.8 pt-20 -139.97 149.08 57.52 Favored Pre-proline 0 C--N 1.272 -2.785 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 172.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 8.0 Cg_exo -74.3 144.16 32.61 Favored 'Trans proline' 0 C--O 1.247 0.973 0 C-N-CA 121.924 1.749 . . . . 0.0 111.505 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.402 ' HB1' ' HB3' ' A' ' 25' ' ' LEU . . . -132.1 152.38 51.25 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.277 179.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.494 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 22.7 m -98.21 131.69 44.35 Favored 'General case' 0 C--N 1.295 -1.8 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 178.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.438 ' HA ' HD13 ' A' ' 25' ' ' LEU . 61.4 tp -76.27 124.21 27.13 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 120.943 0.402 . . . . 0.0 111.437 -178.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 70.0 mt -95.64 -60.21 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.224 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 176.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -154.81 160.2 41.1 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 123.756 0.822 . . . . 0.0 109.994 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -111.97 121.75 45.86 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 106.73 -1.582 . . . . 0.0 106.73 173.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.9 mp -92.95 -56.98 4.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.402 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.092 -175.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -141.57 -167.82 2.51 Favored 'General case' 0 C--N 1.311 -1.071 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 -177.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.532 ' HA2' ' OG1' ' A' ' 62' ' ' THR . . . -88.24 51.89 4.02 Favored Glycine 0 N--CA 1.44 -1.063 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 178.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.434 ' OD1' ' HD3' ' A' ' 35' ' ' ARG . 2.6 t70 179.06 -59.97 0.01 OUTLIER 'General case' 0 CA--C 1.495 -1.143 0 C-N-CA 125.813 1.645 . . . . 0.0 108.087 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.4 m -82.46 110.08 17.26 Favored 'General case' 0 N--CA 1.405 -2.706 0 CA-C-N 114.048 -1.433 . . . . 0.0 110.634 -175.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.1 t -125.15 152.82 31.98 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.2 tttp -111.19 117.67 33.86 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 118.793 0.724 . . . . 0.0 109.39 -175.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.481 ' HB2' ' CE1' ' A' ' 34' ' ' PHE . 3.3 mm? -123.62 153.94 40.02 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.614 0.721 . . . . 0.0 111.358 -175.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.531 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 49.1 ttm -112.29 109.1 18.56 Favored 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 174.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -115.96 116.19 27.49 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.165 -177.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.48 ' HA ' ' HE2' ' A' ' 28' ' ' LYS . 9.8 mmpt? 63.84 26.92 14.46 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.423 1.089 . . . . 0.0 109.577 -178.132 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.402 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 92.8 4.96 64.92 Favored Glycine 0 C--N 1.303 -1.263 0 CA-C-N 114.603 -1.18 . . . . 0.0 113.32 179.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.531 ' O ' ' HA ' ' A' ' 26' ' ' MET . 46.4 mt-30 -97.03 106.93 34.54 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 179.53 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.402 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 5.8 Cg_exo -80.42 102.49 1.42 Allowed 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 122.694 2.263 . . . . 0.0 110.354 177.424 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 89.6 mtp -133.98 150.64 51.27 Favored 'General case' 0 C--N 1.307 -1.246 0 CA-C-O 121.371 0.605 . . . . 0.0 110.814 -177.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.6 m -86.47 126.74 34.63 Favored 'General case' 0 N--CA 1.415 -2.2 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 177.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.481 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 33.2 m-85 -97.15 157.95 15.68 Favored 'General case' 0 C--N 1.292 -1.903 0 C-N-CA 123.174 0.589 . . . . 0.0 111.853 -177.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.434 ' HD3' ' OD1' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -139.08 133.78 32.03 Favored 'General case' 0 C--N 1.293 -1.866 0 N-CA-C 104.104 -2.554 . . . . 0.0 104.104 -179.187 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 87.6 mt -84.61 132.66 34.47 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 121.897 0.856 . . . . 0.0 112.265 -174.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.473 HD21 ' HB3' ' A' ' 89' ' ' LEU . 74.1 mt -73.31 138.34 45.37 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.115 177.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 38.8 mt 66.75 17.88 10.63 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.265 1.426 . . . . 0.0 112.964 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 59.5 t -110.64 136.92 45.16 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -126.15 106.67 9.73 Favored 'General case' 0 C--N 1.288 -2.103 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 174.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.507 ' H ' ' HD2' ' A' ' 42' ' ' PRO . 19.6 m -101.58 -58.41 0.11 Allowed Pre-proline 0 C--N 1.285 -2.22 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 177.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.507 ' HD2' ' H ' ' A' ' 41' ' ' THR . 31.4 Cg_endo -64.84 107.74 0.96 Allowed 'Trans proline' 0 C--N 1.383 2.382 0 C-N-CA 121.622 1.548 . . . . 0.0 111.441 175.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -67.17 154.15 41.95 Favored 'General case' 0 C--O 1.258 1.55 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.771 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.4 m 78.42 153.8 0.14 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 125.217 1.407 . . . . 0.0 108.759 -172.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -59.41 -25.82 64.63 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.515 0.674 . . . . 0.0 110.864 178.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 23.1 t60 -135.28 122.28 14.81 Favored Pre-proline 0 N--CA 1.429 -1.483 0 N-CA-C 106.016 -1.846 . . . . 0.0 106.016 172.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -65.39 98.53 0.33 Allowed 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 121.574 1.516 . . . . 0.0 111.916 179.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -92.8 -44.16 8.65 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 178.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -85.28 -24.92 27.53 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 175.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 84.97 -132.03 10.82 Favored Glycine 0 N--CA 1.425 -2.097 0 N-CA-C 108.423 -1.871 . . . . 0.0 108.423 -177.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.423 ' CG2' ' HA ' ' A' ' 42' ' ' PRO . 5.0 t -135.25 88.29 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 173.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -83.37 -45.96 13.11 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.634 -177.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -50.06 -63.2 1.19 Allowed 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 114.797 1.406 . . . . 0.0 114.797 -175.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -134.47 20.49 3.64 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 121.261 0.553 . . . . 0.0 111.02 -175.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -61.82 -58.86 11.03 Favored Glycine 0 C--N 1.317 -0.508 0 CA-C-N 115.048 -0.978 . . . . 0.0 112.741 -179.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -51.55 -29.49 32.3 Favored 'Trans proline' 0 C--N 1.363 1.315 0 C-N-CA 123.154 2.569 . . . . 0.0 113.082 177.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -72.77 -47.58 45.55 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 122.554 0.342 . . . . 0.0 110.283 178.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.33 -44.85 93.73 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.69 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.568 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 12.9 m -59.21 -46.87 87.31 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.111 178.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.11 -46.26 89.84 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -177.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 64.9 t80 -59.37 -40.86 87.86 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.742 -177.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.532 ' OG1' ' HA2' ' A' ' 20' ' ' GLY . 30.2 m -64.45 -47.15 80.15 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.217 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.568 ' HG3' ' O ' ' A' ' 59' ' ' SER . 55.2 mtpt -60.46 -44.03 96.31 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.379 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp -56.15 -54.04 49.85 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.625 177.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 53.0 ttm -66.07 -42.17 89.77 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.729 -175.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 35.1 m -71.65 -37.75 64.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 C-N-CA 119.921 -0.712 . . . . 0.0 112.351 -178.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -75.36 -24.78 57.34 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -78.67 -21.63 47.99 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 121.508 0.671 . . . . 0.0 110.203 178.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.487 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -78.62 147.08 33.78 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.518 -178.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.25 -47.49 7.75 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 178.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.4 mtmp? -110.07 139.08 45.59 Favored 'General case' 0 CA--C 1.494 -1.211 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 3.8 mp -112.25 135.0 52.96 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.404 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 176.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.531 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 7.0 mm-40 -111.99 132.89 54.51 Favored 'General case' 0 N--CA 1.422 -1.826 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 -177.082 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.443 HG12 ' CD1' ' A' ' 92' ' ' ILE . 35.4 m -116.74 118.91 60.35 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 175.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.451 ' HA ' ' HA ' ' A' ' 9' ' ' LYS . 25.1 tt0 -116.25 136.45 53.0 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 121.395 0.617 . . . . 0.0 112.539 -173.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -108.48 140.22 42.12 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 125.222 1.409 . . . . 0.0 111.104 -176.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.528 ' HB2' HD13 ' A' ' 7' ' ' LEU . 47.3 t0 -122.89 -179.3 4.21 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -179.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -73.74 69.55 1.33 Allowed 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 124.766 1.226 . . . . 0.0 112.549 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.495 ' HA2' HG21 ' B' ' 127' ' ' VAL . . . -150.75 -164.03 11.7 Favored Glycine 0 C--N 1.28 -2.557 0 CA-C-N 113.297 -1.774 . . . . 0.0 109.573 174.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -89.81 142.47 27.66 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 176.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -101.51 -10.6 19.99 Favored 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.697 -176.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.3 p -132.3 142.32 49.32 Favored 'General case' 0 C--N 1.29 -2.005 0 O-C-N 122.114 -0.366 . . . . 0.0 110.157 178.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -108.7 -174.9 2.63 Favored 'General case' 0 C--O 1.254 1.326 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 119' ' ' ASN . 29.9 ttpp -77.08 -27.36 54.18 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -178.05 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -75.2 -27.19 59.5 Favored 'General case' 0 C--O 1.246 0.912 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 105.15 40.87 2.03 Favored Glycine 0 N--CA 1.433 -1.52 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.53 173.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -117.42 150.38 38.97 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-O 120.796 0.331 . . . . 0.0 110.47 176.443 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.66 115.01 3.97 Favored Glycine 0 N--CA 1.426 -1.987 0 N-CA-C 110.711 -0.956 . . . . 0.0 110.711 179.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.473 ' HB3' HD21 ' A' ' 37' ' ' LEU . 69.5 mt -86.41 101.55 13.23 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -157.19 167.81 29.26 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 -177.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.431 ' CE1' ' HB2' ' A' ' 37' ' ' LEU . 11.9 m-85 -90.21 127.51 36.14 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.352 175.425 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.443 ' CD1' HG12 ' A' ' 74' ' ' VAL . 51.0 mm -99.17 122.91 51.47 Favored 'Isoleucine or valine' 0 C--O 1.261 1.7 0 C-N-CA 120.193 -0.603 . . . . 0.0 109.508 177.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.531 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 14.1 m-85 -114.48 135.93 53.57 Favored 'General case' 0 N--CA 1.427 -1.623 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 174.6 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.487 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -105.45 109.17 21.05 Favored 'General case' 0 C--N 1.278 -2.529 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 -178.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 11.1 t70 46.95 40.45 9.28 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.614 1.566 . . . . 0.0 111.319 -177.193 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 96.03 -14.35 64.72 Favored Glycine 0 N--CA 1.443 -0.852 0 CA-C-N 115.339 -0.846 . . . . 0.0 113.792 177.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 8.4 mptt -92.29 140.84 29.2 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -179.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . 0.414 ' HG3' ' CD1' ' A' ' 93' ' ' TYR . 1.9 mpt? -85.08 105.05 15.53 Favored 'General case' 0 C--N 1.297 -1.689 0 O-C-N 122.294 -0.254 . . . . 0.0 111.63 -176.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 30.0 t -66.59 -44.91 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-O 122.256 1.027 . . . . 0.0 108.456 -179.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.447 HD22 ' C ' ' A' ' 100' ' ' ASN . 0.1 OUTLIER -56.45 -43.61 79.67 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 113.37 -1.741 . . . . 0.0 110.721 -179.259 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -66.83 -51.44 55.57 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.517 179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.48 -45.24 76.98 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.111 -0.95 . . . . 0.0 112.066 -177.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.2 mt -54.65 -52.67 61.58 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 178.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 62.0 t -71.01 -37.83 69.43 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.125 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.737 -178.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 23.5 ttp85 -69.94 -21.49 63.26 Favored 'General case' 0 CA--C 1.547 0.851 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 -179.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -95.93 3.71 53.33 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.977 175.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.74 29.49 73.84 Favored Glycine 0 C--N 1.331 0.287 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.792 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 91.9 mt -95.08 -15.03 23.73 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.192 0.52 . . . . 0.0 110.198 -179.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -149.24 162.27 40.35 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -106.22 171.47 7.33 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 10.2 p -93.56 133.57 34.23 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 177.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -98.09 121.56 40.15 Favored 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 174.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -91.95 98.3 11.49 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -177.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 42.5 t -128.09 143.54 40.55 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.584 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.286 -174.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -97.66 -60.95 1.46 Allowed 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 173.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -135.93 137.79 26.1 Favored Pre-proline 0 C--N 1.31 -1.132 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 170.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -76.02 -167.68 0.47 Allowed 'Trans proline' 0 C--O 1.25 1.105 0 C-N-CA 121.86 1.707 . . . . 0.0 112.602 -175.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -62.78 -42.88 99.89 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.927 -177.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . 0.404 ' O ' ' HB2' ' A' ' 84' ' ' LYS . 89.8 m-20 72.27 -60.08 0.54 Allowed 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 125.314 1.446 . . . . 0.0 111.429 178.548 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 23.4 m -167.32 -58.78 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 125.783 1.633 . . . . 0.0 107.821 179.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 . . . . . 0 N--CA 1.442 -0.839 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -179.962 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.949 0 N-CA-C 112.591 -0.203 . . . . 0.0 112.591 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 24.8 p -81.8 83.11 7.25 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-O 121.425 0.631 . . . . 0.0 110.158 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 7.2 p -156.48 133.59 2.32 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.393 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -178.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . 68.52 -72.27 0.1 Allowed 'General case' 0 C--O 1.24 0.57 0 C-N-CA 125.208 1.403 . . . . 0.0 112.207 178.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -159.25 131.66 6.69 Favored 'General case' 0 N--CA 1.427 -1.59 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 127' ' ' VAL . . . . . 0.495 HG21 ' HA2' ' A' ' 79' ' ' GLY . 26.8 m -98.41 142.32 14.83 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.34 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 174.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -78.99 -51.82 9.08 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.965 -172.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -82.1 158.48 67.06 Favored Pre-proline 0 C--N 1.315 -0.924 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.073 -177.259 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -75.73 154.35 39.07 Favored 'Trans proline' 0 C--O 1.252 1.186 0 C-N-CA 122.418 2.079 . . . . 0.0 112.091 176.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 131' ' ' ASN . . . . . 0.506 ' ND2' ' HB3' ' A' ' 77' ' ' ASP . 23.5 t-20 -85.85 73.84 10.28 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 175.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.466 ' C ' ' H ' ' B' ' 134' ' ' HIS . 26.6 p-10 -137.76 26.94 2.75 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.179 -172.479 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 1.7 m -81.58 27.75 0.43 Allowed 'General case' 0 CA--C 1.568 1.654 0 CA-C-O 122.76 1.267 . . . . 0.0 110.005 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . 0.466 ' H ' ' C ' ' B' ' 132' ' ' ASN . 5.5 p80 -162.63 21.19 0.09 Allowed 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 126.623 1.969 . . . . 0.0 107.852 -176.016 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.452 ' HB2' ' HB2' ' B' ' 132' ' ' ASN . 25.2 tt0 -67.75 -48.34 66.68 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.212 -173.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -60.08 -33.56 72.25 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.069 -0.969 . . . . 0.0 112.937 -178.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 91.8 mt -59.54 -47.71 84.48 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.324 0.583 . . . . 0.0 109.538 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 138' ' ' LEU . . . . . 0.444 HD11 ' ND2' ' A' ' 100' ' ' ASN . 4.4 mm? -68.5 -40.61 80.81 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.404 178.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 41.9 mtp180 -63.96 -36.46 84.05 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.486 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -68.63 -43.72 75.73 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.707 0.289 . . . . 0.0 110.718 175.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.0 m -61.41 -45.39 94.52 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.945 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.493 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 0.1 OUTLIER -68.78 -43.11 76.41 Favored 'General case' 0 N--CA 1.44 -0.951 0 CA-C-N 116.006 -0.543 . . . . 0.0 112.207 178.434 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -60.1 -44.36 94.9 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.803 0.335 . . . . 0.0 110.722 179.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 144' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 35.5 tt0 -67.43 -47.85 69.01 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.774 -179.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.91 85.4 Favored 'General case' 0 C--O 1.243 0.726 0 N-CA-C 111.863 0.32 . . . . 0.0 111.863 -177.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 146' ' ' LYS . . . . . 0.493 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 84.6 mttt -62.25 -47.35 84.76 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.888 175.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -69.92 -31.36 69.09 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 123.447 0.467 . . . . 0.0 112.019 -175.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 11.8 mm-40 -79.95 -17.68 52.36 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.89 178.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . 0.63 ' O ' ' HB3' ' B' ' 154' ' ' SER . 13.0 mmmm 60.25 65.45 1.08 Allowed 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 -174.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . 0.478 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 97.6 mt -98.98 123.44 43.28 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 115.925 -0.579 . . . . 0.0 112.287 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 49.45 -88.51 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 126.324 1.85 . . . . 0.0 114.951 173.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 48.3 mt -66.29 -37.35 79.51 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.165 0.507 . . . . 0.0 110.226 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 153' ' ' TRP . . . . . . . . . . . . . 62.7 m95 -77.25 -21.0 54.38 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.575 -175.095 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . 0.63 ' HB3' ' O ' ' B' ' 149' ' ' LYS . 80.7 p -91.89 21.11 5.11 Favored 'General case' 0 N--CA 1.419 -1.989 0 CA-C-O 121.338 0.59 . . . . 0.0 111.049 -178.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -64.33 -31.97 73.38 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 170.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 27.0 t70 . . . . . 0 N--CA 1.42 -1.948 0 CA-C-N 113.076 -1.875 . . . . 0.0 107.832 -179.378 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.252 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.3 t 179.65 158.19 0.67 Allowed 'General case' 0 N--CA 1.438 -1.056 0 N-CA-C 107.257 -1.386 . . . . 0.0 107.257 178.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.7 p -79.07 130.4 35.47 Favored 'General case' 0 N--CA 1.415 -2.175 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 173.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 14.1 t -74.4 132.74 42.24 Favored 'General case' 0 N--CA 1.421 -1.924 0 CA-C-O 121.588 0.709 . . . . 0.0 110.195 -174.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.417 ' HD2' ' N ' ' A' ' 5' ' ' LYS . 3.1 mptp? -86.53 112.78 21.87 Favored 'General case' 0 N--CA 1.428 -1.554 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 179.018 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 53.2 tptt -63.68 -46.06 87.26 Favored 'General case' 0 C--N 1.317 -0.841 0 O-C-N 123.962 0.789 . . . . 0.0 109.87 -176.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 93.6 mt 59.73 -169.27 0.15 Allowed 'General case' 0 C--O 1.239 0.532 0 O-C-N 124.368 1.043 . . . . 0.0 111.11 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.6 m80 -123.22 109.08 13.53 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -177.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -96.6 145.45 25.73 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.68 175.332 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.401 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 11.2 pt-20 -139.28 149.72 61.76 Favored Pre-proline 0 C--N 1.287 -2.15 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 10' ' ' GLU . 5.1 Cg_exo -78.39 140.96 17.61 Favored 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 122.272 1.981 . . . . 0.0 113.172 -177.021 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.437 ' O ' ' HB ' ' A' ' 72' ' ' ILE . . . -132.24 154.83 49.24 Favored 'General case' 0 N--CA 1.424 -1.761 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.433 178.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.478 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 50.0 m -98.52 122.46 41.74 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.2 tp -66.56 118.84 10.73 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 176.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 39.0 mm -90.09 -56.9 4.69 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.558 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 178.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -165.0 153.93 12.47 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.567 ' HB3' ' HG2' ' A' ' 63' ' ' LYS . . . -111.25 123.11 49.54 Favored 'General case' 0 C--N 1.287 -2.15 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 176.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.3 mp -90.79 -64.32 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -175.016 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -130.65 -173.71 3.15 Favored 'General case' 0 C--N 1.31 -1.138 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 179.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -87.67 54.63 4.39 Favored Glycine 0 C--N 1.314 -0.654 0 N-CA-C 111.401 -0.68 . . . . 0.0 111.401 -178.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.543 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 4.2 p-10 -177.14 -36.51 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -178.115 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 p -111.33 112.06 23.55 Favored 'General case' 0 N--CA 1.422 -1.832 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.92 -178.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.8 m -131.63 143.19 41.14 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.645 0 CA-C-N 114.6 -1.182 . . . . 0.0 108.178 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 33' ' ' THR . 81.0 tttt -104.8 117.77 34.88 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 122.023 -0.423 . . . . 0.0 110.069 -176.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.2 mp -120.49 147.01 45.69 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.502 -179.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.629 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 44.1 ttm -108.15 108.96 20.25 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 175.128 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 5.4 p90 -115.38 130.7 56.97 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 -178.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 32.4 pttt 41.77 35.74 0.54 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.849 1.26 . . . . 0.0 113.559 -174.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.445 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 95.32 -0.92 64.07 Favored Glycine 0 N--CA 1.442 -0.9 0 CA-C-N 114.929 -1.032 . . . . 0.0 114.668 177.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.629 ' O ' ' HA ' ' A' ' 26' ' ' MET . 1.8 mp0 -99.09 105.8 34.33 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 117.973 0.886 . . . . 0.0 111.458 178.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.445 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 1.7 Cg_endo -82.79 104.13 1.26 Allowed 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 122.261 1.974 . . . . 0.0 109.686 173.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 86.8 mtp -128.54 143.25 50.93 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 120.658 0.266 . . . . 0.0 110.562 -177.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.408 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 15.8 m -80.48 116.22 20.41 Favored 'General case' 0 N--CA 1.421 -1.92 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 174.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -98.19 154.62 17.64 Favored 'General case' 0 C--N 1.293 -1.891 0 C-N-CA 124.04 0.936 . . . . 0.0 111.551 -177.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.543 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -122.47 122.98 40.23 Favored 'General case' 0 C--N 1.293 -1.849 0 N-CA-C 103.73 -2.693 . . . . 0.0 103.73 174.048 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.6 mp -61.77 126.0 25.81 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 123.389 0.431 . . . . 0.0 111.766 -177.184 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.432 HD21 ' HB3' ' A' ' 89' ' ' LEU . 71.7 mt -57.63 134.76 56.45 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.364 175.41 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.543 ' O ' ' HA ' ' A' ' 111' ' ' VAL . 44.0 mt 70.04 16.77 7.5 Favored 'General case' 0 C--O 1.215 -0.714 0 C-N-CA 124.957 1.303 . . . . 0.0 113.002 179.354 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.599 HG23 HD22 ' A' ' 100' ' ' ASN . 55.6 t -119.49 127.5 75.86 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.755 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 177.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -137.15 129.52 29.78 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 123.432 0.457 . . . . 0.0 110.179 177.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 4.9 m -80.98 121.29 80.65 Favored Pre-proline 0 N--CA 1.426 -1.657 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 174.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -69.38 97.41 0.6 Allowed 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 122.186 1.924 . . . . 0.0 112.791 -178.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.432 ' HA ' ' HA2' ' A' ' 50' ' ' GLY . 46.6 mm-40 -62.68 122.97 17.18 Favored 'General case' 0 C--O 1.246 0.919 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.992 177.049 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.7 m -102.97 159.31 15.62 Favored 'General case' 0 N--CA 1.42 -1.974 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 177.016 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.511 ' HE2' ' HA ' ' A' ' 45' ' ' LYS . 0.4 OUTLIER -49.18 -34.84 15.44 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 -173.094 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -103.61 -59.16 0.08 OUTLIER Pre-proline 0 CA--C 1.555 1.137 0 N-CA-C 113.66 0.985 . . . . 0.0 113.66 -179.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.91 143.89 29.93 Favored 'Trans proline' 0 C--N 1.369 1.621 0 C-N-CA 121.709 1.606 . . . . 0.0 114.62 -174.117 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.9 mmmt -95.81 1.68 53.33 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.385 178.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.603 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.0 mmpt? -97.69 14.34 27.14 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 174.116 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.432 ' HA2' ' HA ' ' A' ' 43' ' ' GLU . . . 87.8 -73.06 2.38 Favored Glycine 0 N--CA 1.422 -2.239 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.495 -178.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.3 p -141.52 129.24 21.72 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.719 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -66.36 -33.89 76.73 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -171.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -77.79 -46.2 22.3 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -178.223 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -95.9 -22.21 17.58 Favored 'General case' 0 C--N 1.309 -1.173 0 C-N-CA 119.937 -0.705 . . . . 0.0 112.706 -172.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -53.59 -58.16 13.24 Favored Glycine 0 CA--C 1.535 1.297 0 CA-C-O 119.634 -0.537 . . . . 0.0 113.7 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -58.15 -22.57 57.12 Favored 'Trans proline' 0 C--N 1.361 1.203 0 C-N-CA 122.792 2.328 . . . . 0.0 113.154 177.321 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -82.69 -37.94 24.08 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.949 0.404 . . . . 0.0 109.914 178.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.63 -47.14 85.05 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.799 177.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.523 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 16.3 p -62.16 -44.7 96.04 Favored 'General case' 0 N--CA 1.435 -1.175 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.367 179.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -57.59 -47.52 81.91 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 122.684 0.394 . . . . 0.0 111.499 -179.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -64.37 -40.64 96.23 Favored 'General case' 0 C--O 1.244 0.807 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.353 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 38.7 m -61.06 -45.14 95.98 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.9 178.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.567 ' HG2' ' HB3' ' A' ' 17' ' ' ALA . 61.4 mtpt -59.83 -52.94 63.32 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.593 -178.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.462 ' N ' ' HE2' ' A' ' 64' ' ' LYS . 0.3 OUTLIER -62.14 -33.46 74.54 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 179.258 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 53.3 tpp -65.5 -44.53 86.75 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 120.713 0.292 . . . . 0.0 110.8 -179.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.7 m -75.39 -25.03 17.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.972 179.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.531 ' HG3' ' O ' ' A' ' 63' ' ' LYS . 44.9 mt-10 -71.43 -31.57 67.37 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.915 0.388 . . . . 0.0 110.053 174.059 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -78.13 -9.67 59.27 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 123.858 0.863 . . . . 0.0 111.319 -177.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.03 128.36 36.26 Favored 'General case' 0 C--O 1.252 1.211 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.459 -178.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 49.1 mttp -68.16 -47.81 67.03 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 105.755 -1.942 . . . . 0.0 105.755 171.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.462 ' H ' ' HB3' ' A' ' 95' ' ' ASP . 4.2 mtpm? -132.96 133.51 43.28 Favored 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 105.25 -2.13 . . . . 0.0 105.25 -179.108 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.437 ' HB ' ' O ' ' A' ' 12' ' ' ALA . 3.8 mp -91.72 119.96 39.98 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.361 0 N-CA-C 105.803 -1.925 . . . . 0.0 105.803 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.579 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 5.5 mm-40 -112.53 133.5 54.56 Favored 'General case' 0 C--N 1.294 -1.817 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.067 -171.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.5 m -110.94 125.62 68.28 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 174.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -114.01 131.33 56.39 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -178.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.466 ' CE1' ' HB2' ' A' ' 81' ' ' ARG . 60.3 t80 -102.47 122.58 44.6 Favored 'General case' 0 N--CA 1.421 -1.878 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.382 178.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.498 ' CG ' ' H ' ' B' ' 133' ' ' THR . 14.9 t70 -94.52 -173.51 3.06 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-N 114.925 -1.034 . . . . 0.0 108.442 178.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.412 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 82.1 mttt -81.58 17.03 1.52 Allowed 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 125.002 1.321 . . . . 0.0 111.184 -173.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -107.19 -121.91 4.79 Favored Glycine 0 N--CA 1.44 -1.083 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.377 -178.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -110.81 149.14 30.99 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 122.509 0.323 . . . . 0.0 110.638 -176.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.466 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . 43.2 ttp180 -110.23 -8.16 14.78 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.577 0.703 . . . . 0.0 109.172 177.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 2.1 p -148.95 151.11 34.02 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.515 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -108.38 153.18 23.65 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 108.355 -0.979 . . . . 0.0 108.355 176.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -69.0 -15.27 63.44 Favored 'General case' 0 C--N 1.314 -0.942 0 C-N-CA 123.533 0.733 . . . . 0.0 111.431 -176.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -74.57 -10.13 59.25 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 121.293 0.568 . . . . 0.0 109.793 176.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 90.84 43.11 4.88 Favored Glycine 0 CA--C 1.496 -1.108 0 N-CA-C 110.06 -1.216 . . . . 0.0 110.06 -178.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.441 ' CG ' ' HB2' ' A' ' 35' ' ' ARG . 9.8 tpp180 -126.86 142.25 51.6 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 -176.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -83.23 146.27 23.73 Favored Glycine 0 N--CA 1.439 -1.159 0 N-CA-C 109.821 -1.312 . . . . 0.0 109.821 177.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.432 ' HB3' HD21 ' A' ' 37' ' ' LEU . 93.0 mt -126.64 119.91 28.2 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -156.05 161.65 40.39 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.443 ' CZ ' ' HB3' ' A' ' 100' ' ' ASN . 29.9 t80 -91.89 123.45 35.28 Favored 'General case' 0 N--CA 1.412 -2.369 0 N-CA-C 105.469 -2.049 . . . . 0.0 105.469 174.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 38.1 mm -99.44 130.84 47.83 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 CA-C-O 120.879 0.371 . . . . 0.0 110.736 -172.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.579 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 87.4 m-85 -122.09 147.59 45.93 Favored 'General case' 0 CA--C 1.492 -1.276 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 174.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.13 98.95 8.59 Favored 'General case' 0 C--N 1.284 -2.241 0 N-CA-C 105.342 -2.095 . . . . 0.0 105.342 171.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.462 ' HB3' ' H ' ' A' ' 71' ' ' LYS . 4.2 p30 45.41 31.24 0.83 Allowed 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 125.045 1.338 . . . . 0.0 113.608 -175.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.49 -5.41 35.36 Favored Glycine 0 CA--C 1.524 0.633 0 CA-C-N 115.949 -0.568 . . . . 0.0 113.712 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -83.26 125.02 31.14 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 107.108 -1.441 . . . . 0.0 107.108 173.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 1.5 mpt? -67.4 102.85 1.17 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 117.868 0.303 . . . . 0.0 110.26 177.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 49.5 t -66.5 -38.69 82.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.599 HD22 HG23 ' A' ' 39' ' ' VAL . 6.7 t-20 -57.78 -51.68 68.59 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.438 176.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.493 ' O ' ' HG3' ' A' ' 105' ' ' ARG . 35.1 tt0 -69.96 -34.94 74.07 Favored 'General case' 0 C--O 1.204 -1.32 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.696 -174.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.49 -43.3 88.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.925 0.393 . . . . 0.0 110.293 177.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.7 mt -65.33 -42.81 92.53 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.757 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 100' ' ' ASN . 84.2 t -65.48 -41.48 91.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.346 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 101' ' ' GLU . 17.1 mtm180 -70.29 -16.39 63.01 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.082 0.553 . . . . 0.0 111.701 -178.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -105.56 1.85 27.84 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.586 176.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 59.55 44.37 96.84 Favored Glycine 0 C--O 1.219 -0.795 0 CA-C-N 115.757 -0.656 . . . . 0.0 112.525 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 93.3 mt -106.27 10.4 31.75 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -177.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -165.5 170.33 14.51 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 178.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.406 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 96.8 mttt -116.57 147.12 42.14 Favored 'General case' 0 CA--C 1.491 -1.296 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 175.021 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.543 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 99.1 t -73.79 133.85 30.81 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 C-N-CA 120.122 -0.631 . . . . 0.0 109.744 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -86.33 154.8 20.96 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -72.03 139.38 48.5 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -172.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.475 HG13 ' ND2' ' B' ' 131' ' ' ASN . 93.8 t -88.56 151.92 3.43 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 CA-C-N 113.511 -1.677 . . . . 0.0 109.044 -177.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -84.6 72.89 10.63 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 122.59 1.186 . . . . 0.0 108.129 176.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -106.24 143.65 27.37 Favored Pre-proline 0 N--CA 1.429 -1.491 0 CA-C-N 114.062 -1.427 . . . . 0.0 108.269 -175.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -87.38 -165.17 0.22 Allowed 'Trans proline' 0 N--CA 1.438 -1.788 0 C-N-CA 121.826 1.684 . . . . 0.0 110.107 175.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -87.17 -25.39 24.09 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-O 121.088 0.47 . . . . 0.0 111.323 -178.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -148.29 105.83 3.67 Favored 'General case' 0 CA--C 1.49 -1.341 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -176.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 12.5 t -141.62 13.75 2.13 Favored 'General case' 0 C--N 1.283 -2.304 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 171.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 . . . . . 0 N--CA 1.43 -1.454 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 -178.63 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.59 0 N-CA-C 110.549 -1.021 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 12.0 p -79.06 -18.86 52.68 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 117.32 0.56 . . . . 0.0 112.079 -178.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 30.3 m -78.81 128.63 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.771 0 CA-C-O 122.062 0.934 . . . . 0.0 113.01 -178.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -151.24 83.04 1.31 Allowed 'General case' 0 C--N 1.291 -1.975 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 174.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 56.5 t80 -78.47 81.73 4.79 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-O 122.159 0.98 . . . . 0.0 111.987 -174.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 2.7 m -120.15 85.04 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.282 -2.346 0 CA-C-N 113.836 -1.529 . . . . 0.0 107.182 171.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 128' ' ' TYR . . . . . 0.489 ' O ' ' HD3' ' B' ' 130' ' ' PRO . 36.8 t80 -98.3 95.62 7.5 Favored 'General case' 0 N--CA 1.41 -2.451 0 CA-C-N 115.071 -0.968 . . . . 0.0 109.622 -175.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -97.81 101.88 11.87 Favored Pre-proline 0 C--N 1.3 -1.58 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.231 173.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . 0.489 ' HD3' ' O ' ' B' ' 128' ' ' TYR . 2.7 Cg_exo -74.05 146.9 37.59 Favored 'Trans proline' 0 C--O 1.251 1.16 0 C-N-CA 121.721 1.614 . . . . 0.0 109.544 175.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 131' ' ' ASN . . . . . 0.475 ' ND2' HG13 ' A' ' 114' ' ' VAL . 4.3 p-10 -79.35 145.45 33.42 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -95.84 -58.13 2.18 Favored 'General case' 0 C--N 1.291 -1.959 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -179.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 133' ' ' THR . . . . . 0.498 ' H ' ' CG ' ' A' ' 77' ' ' ASP . 6.3 p 56.06 17.43 2.66 Favored 'General case' 0 C--O 1.213 -0.864 0 C-N-CA 125.884 1.673 . . . . 0.0 113.392 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . 0.502 ' O ' ' HG ' ' B' ' 138' ' ' LEU . 64.4 m-70 67.46 25.04 8.62 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.955 1.302 . . . . 0.0 109.373 -179.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -37.44 -63.67 0.43 Allowed 'General case' 0 C--O 1.205 -1.253 0 C-N-CA 126.279 1.832 . . . . 0.0 113.907 -174.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -61.96 -33.55 74.49 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -170.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 88.0 mt -70.47 -47.25 61.48 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 122.052 0.929 . . . . 0.0 108.775 176.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 138' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' B' ' 134' ' ' HIS . 62.5 mt -67.79 -41.18 83.58 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 114.387 -1.279 . . . . 0.0 111.763 -176.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 139' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -75.44 -19.73 59.29 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.216 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 17.3 tppt? -72.6 -38.89 67.68 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 173.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 45.2 m -66.81 -35.45 80.09 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.404 174.414 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.555 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 24.6 tt0 -62.68 -54.08 44.81 Favored 'General case' 0 C--O 1.205 -1.24 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.245 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.56 -35.92 66.25 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 123.19 0.596 . . . . 0.0 111.226 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 144' ' ' GLN . . . . . 0.614 ' HA ' HE21 ' B' ' 144' ' ' GLN . 0.0 OUTLIER -70.97 -47.85 56.65 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.952 176.95 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -65.07 -35.41 81.07 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 122.45 0.3 . . . . 0.0 111.66 -178.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 146' ' ' LYS . . . . . 0.555 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 82.6 mttt -60.88 -46.18 91.63 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 177.009 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -62.53 -35.52 79.67 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.082 -177.345 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 43.7 mm-40 -88.86 -6.43 57.33 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-N 114.592 -1.185 . . . . 0.0 112.41 -174.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . 0.564 ' O ' ' HB2' ' B' ' 154' ' ' SER . 35.4 mmtp 53.61 54.35 10.13 Favored 'General case' 0 CA--C 1.512 -0.497 0 O-C-N 123.964 0.79 . . . . 0.0 110.927 -178.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 95.6 mt -82.92 114.76 21.43 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.783 -179.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 151' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 51.31 -93.28 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.475 1.51 . . . . 0.0 114.734 176.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 12.1 mt -64.38 -36.19 76.47 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.851 0 C-N-CA 122.605 0.362 . . . . 0.0 111.748 -179.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 153' ' ' TRP . . . . . 0.406 ' CH2' ' HG2' ' A' ' 110' ' ' LYS . 60.3 m95 -67.97 -23.14 65.01 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.043 0.449 . . . . 0.0 110.363 -179.284 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . 0.564 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 10.1 t -85.79 42.98 1.0 Allowed 'General case' 0 N--CA 1.442 -0.871 0 CA-C-O 122.116 0.96 . . . . 0.0 108.792 179.227 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -74.22 -22.66 59.26 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 114.684 -1.143 . . . . 0.0 108.41 172.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 19.5 t70 . . . . . 0 N--CA 1.432 -1.355 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 175.305 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.575 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 73.1 p 60.33 1.86 0.41 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 126.453 1.901 . . . . 0.0 115.978 175.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.464 ' HA ' ' CE1' ' A' ' 8' ' ' HIS . 73.0 m 45.21 68.58 0.55 Allowed 'General case' 0 C--O 1.237 0.397 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.9 t -110.06 176.01 5.22 Favored 'General case' 0 N--CA 1.419 -2.005 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 176.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.8 mttt 71.08 -83.57 0.03 OUTLIER 'General case' 0 C--O 1.238 0.461 0 C-N-CA 125.298 1.439 . . . . 0.0 110.558 -177.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -121.69 -161.8 0.94 Allowed 'General case' 0 N--CA 1.426 -1.67 0 C-N-CA 123.847 0.859 . . . . 0.0 109.802 -176.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.533 HD22 ' HA ' ' A' ' 77' ' ' ASP . 49.5 mt -97.7 151.03 20.55 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 179.368 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.464 ' CE1' ' HA ' ' A' ' 3' ' ' SER . 23.0 m170 -104.87 131.0 52.9 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -177.059 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.421 ' HA ' ' O ' ' A' ' 74' ' ' VAL . 36.6 ttmt -121.01 135.16 55.28 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 114.377 -1.283 . . . . 0.0 109.094 -179.122 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -138.95 157.35 71.71 Favored Pre-proline 0 C--N 1.296 -1.735 0 C-N-CA 122.504 0.322 . . . . 0.0 110.848 177.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -71.18 148.09 55.24 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 122.358 2.039 . . . . 0.0 112.75 -178.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.24 161.51 37.25 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.951 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.433 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 20.4 m -109.78 145.36 36.81 Favored 'General case' 0 C--N 1.293 -1.891 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 176.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.7 tp -83.95 134.98 34.64 Favored 'General case' 0 C--N 1.295 -1.769 0 C-N-CA 120.089 -0.645 . . . . 0.0 109.752 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 41.3 mm -91.79 -57.58 4.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.468 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 171.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -168.84 141.73 2.82 Favored 'General case' 0 N--CA 1.416 -2.171 0 CA-C-N 115.164 -0.925 . . . . 0.0 108.899 178.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.484 ' HA ' HG23 ' A' ' 23' ' ' VAL . . . -99.93 110.1 22.44 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 171.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.6 mp -89.54 -53.79 8.74 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-O 121.376 0.608 . . . . 0.0 110.034 -174.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -129.99 169.08 15.72 Favored 'General case' 0 C--N 1.291 -1.947 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -175.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -62.31 -29.48 73.27 Favored Glycine 0 C--N 1.306 -1.104 0 O-C-N 123.987 0.805 . . . . 0.0 111.775 178.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.575 ' O ' ' HA ' ' A' ' 35' ' ' ARG . 2.3 m-20 -96.99 -46.99 5.98 Favored 'General case' 0 CA--C 1.492 -1.274 0 CA-C-O 120.952 0.406 . . . . 0.0 110.866 177.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.6 m -96.72 113.33 24.87 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-O 121.472 0.653 . . . . 0.0 111.84 -171.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.484 HG23 ' HA ' ' A' ' 17' ' ' ALA . 5.8 p -135.07 144.76 33.56 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.182 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.109 -177.44 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -106.98 123.01 47.57 Favored 'General case' 0 CA--C 1.49 -1.353 0 O-C-N 121.63 -0.669 . . . . 0.0 111.524 -179.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.9 mp -125.82 151.03 47.34 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.987 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.497 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 25.9 ttt -117.52 106.26 12.96 Favored 'General case' 0 C--N 1.289 -2.054 0 CA-C-N 114.911 -1.041 . . . . 0.0 108.871 -178.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -113.39 123.66 50.6 Favored 'General case' 0 C--N 1.287 -2.131 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 96.4 mttt 58.79 27.73 16.43 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 123.399 0.679 . . . . 0.0 111.803 177.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.444 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 93.82 6.6 61.99 Favored Glycine 0 N--CA 1.44 -1.062 0 C-N-CA 120.83 -0.7 . . . . 0.0 113.104 179.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.497 ' O ' ' HA ' ' A' ' 26' ' ' MET . 17.9 mm-40 -107.3 98.37 22.64 Favored Pre-proline 0 C--N 1.318 -0.775 0 CA-C-N 116.85 0.325 . . . . 0.0 110.562 178.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 6.0 Cg_exo -80.76 97.16 1.0 Allowed 'Trans proline' 0 C--O 1.243 0.742 0 C-N-CA 122.98 2.453 . . . . 0.0 110.565 174.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 49.8 ttm -112.87 145.62 40.37 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.387 -176.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 32.1 m -82.16 120.08 24.87 Favored 'General case' 0 N--CA 1.42 -1.957 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 174.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.431 ' HA ' ' O ' ' A' ' 88' ' ' GLY . 74.9 m-85 -114.38 154.2 28.51 Favored 'General case' 0 C--N 1.295 -1.766 0 CA-C-O 121.399 0.619 . . . . 0.0 111.682 -177.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.575 ' HA ' ' O ' ' A' ' 21' ' ' ASP . 37.8 mtp180 -118.23 148.09 42.75 Favored 'General case' 0 C--N 1.288 -2.109 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.058 164.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.419 ' HB3' ' ND2' ' A' ' 100' ' ' ASN . 5.2 mp -77.66 123.32 26.5 Favored 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.668 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 68.1 mt -63.94 142.04 58.55 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.432 176.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.637 ' HA ' ' O ' ' A' ' 112' ' ' ALA . 67.3 mt 72.65 10.56 5.59 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.336 1.055 . . . . 0.0 112.503 177.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 97.5 t -113.49 140.85 31.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.223 0.535 . . . . 0.0 111.979 -176.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.4 ' HB3' ' HB2' ' A' ' 110' ' ' LYS . 17.8 t70 -135.1 107.52 7.31 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 172.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.402 ' N ' ' HD2' ' A' ' 42' ' ' PRO . 82.3 p -109.43 -11.04 0.12 Allowed Pre-proline 0 CA--C 1.571 1.772 0 N-CA-C 116.555 2.058 . . . . 0.0 116.555 179.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.402 ' HD2' ' N ' ' A' ' 41' ' ' THR . 37.7 Cg_endo -62.27 152.91 73.57 Favored 'Trans proline' 0 C--N 1.403 3.401 0 CA-C-N 122.941 2.086 . . . . 0.0 111.445 -175.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.566 ' OE2' ' HG2' ' A' ' 53' ' ' LYS . 7.9 tp10 -48.35 127.44 12.95 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 124.404 1.065 . . . . 0.0 110.859 -177.433 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.5 t -50.15 -66.62 0.36 Allowed 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 114.812 1.412 . . . . 0.0 114.812 -163.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.474 ' HB2' ' HE2' ' A' ' 48' ' ' LYS . 2.2 mptp? -96.97 -0.12 47.96 Favored 'General case' 0 CA--C 1.496 -1.109 0 C-N-CA 120.107 -0.637 . . . . 0.0 110.147 177.444 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 29.1 m-70 80.1 131.94 0.04 OUTLIER Pre-proline 0 N--CA 1.472 0.644 0 C-N-CA 124.707 1.203 . . . . 0.0 108.52 -170.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -37.84 119.84 0.35 Allowed 'Trans proline' 0 N--CA 1.492 1.41 1 C-N-CA 125.578 4.185 . . . . 0.0 118.935 -166.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.474 ' HE2' ' HB2' ' A' ' 45' ' ' LYS . 0.0 OUTLIER -113.38 -39.47 4.11 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 167.307 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -91.93 -37.04 13.11 Favored 'General case' 0 CA--C 1.502 -0.893 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 176.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 138.72 -47.93 0.9 Allowed Glycine 0 N--CA 1.431 -1.669 0 N-CA-C 108.097 -2.001 . . . . 0.0 108.097 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -141.3 104.94 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.41 -2.467 0 C-N-CA 124.903 1.281 . . . . 0.0 109.139 174.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -91.48 -56.88 2.96 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.347 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.584 ' HE2' HG12 ' B' ' 152' ' ' ILE . 11.6 ptmm? -87.17 -14.72 40.4 Favored 'General case' 0 CA--C 1.499 -1.016 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 176.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 76.78 86.05 0.08 Allowed 'General case' 0 C--O 1.244 0.772 0 C-N-CA 124.572 1.149 . . . . 0.0 111.049 179.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -58.22 -58.71 13.14 Favored Glycine 0 CA--C 1.537 1.423 0 CA-C-N 114.868 -1.06 . . . . 0.0 112.611 175.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -53.89 -34.98 78.33 Favored 'Trans proline' 0 C--N 1.368 1.601 0 C-N-CA 123.256 2.637 . . . . 0.0 113.764 179.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -66.4 -38.3 87.19 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.29 0.567 . . . . 0.0 109.628 -179.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.92 -48.44 63.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.871 177.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.453 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 19.1 m -57.71 -39.61 77.62 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.024 179.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -63.03 -34.88 78.51 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.142 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -69.63 -41.93 74.98 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 -177.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.463 ' O ' HG22 ' A' ' 66' ' ' VAL . 28.8 m -59.4 -47.99 83.33 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 175.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 59' ' ' SER . 60.8 mtpt -55.23 -51.89 65.14 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.682 178.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -64.22 -34.17 77.47 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -177.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 20.1 mmt -70.36 -47.93 58.7 Favored 'General case' 0 C--N 1.312 -1.032 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.659 177.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.463 HG22 ' O ' ' A' ' 62' ' ' THR . 33.9 m -75.18 -36.53 37.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -176.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -75.28 -23.94 57.49 Favored 'General case' 0 C--O 1.24 0.583 0 O-C-N 122.111 -0.368 . . . . 0.0 111.904 -179.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -78.98 -40.32 31.99 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.057 175.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -56.27 132.66 51.36 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 123.688 0.795 . . . . 0.0 112.329 -177.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 mppt? -75.02 -50.33 16.87 Favored 'General case' 0 CA--C 1.501 -0.937 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 175.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.2 mtmm -104.3 119.91 40.02 Favored 'General case' 0 C--N 1.308 -1.208 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.954 -178.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 69.4 mt -102.3 128.94 54.5 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.664 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 175.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.55 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 23.2 mt-10 -122.5 139.16 54.2 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 120.504 0.192 . . . . 0.0 110.758 -176.201 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.421 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 18.1 m -113.73 128.69 70.5 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 175.062 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -122.62 115.71 22.59 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.0 p90 -91.56 124.89 36.06 Favored 'General case' 0 N--CA 1.417 -2.12 0 CA-C-O 121.409 0.623 . . . . 0.0 111.323 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.533 ' HA ' HD22 ' A' ' 7' ' ' LEU . 17.1 t70 -91.67 176.8 6.41 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.255 -176.025 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.438 ' H ' ' HG2' ' A' ' 78' ' ' LYS . 18.0 pttm -82.14 -5.65 58.6 Favored 'General case' 0 C--N 1.307 -1.28 0 C-N-CA 126.56 1.944 . . . . 0.0 112.109 -177.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -81.77 -138.45 2.63 Favored Glycine 0 C--O 1.246 0.87 0 C-N-CA 120.584 -0.817 . . . . 0.0 111.468 176.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -74.22 120.84 20.34 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 176.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -108.56 -8.18 15.56 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-O 121.82 0.819 . . . . 0.0 109.141 -176.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 10.0 p -139.79 141.11 36.79 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 114.986 -1.007 . . . . 0.0 110.331 179.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.528 ' HB3' ' HB2' ' A' ' 87' ' ' ARG . 22.2 t70 -102.91 134.14 46.83 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 104.823 -2.288 . . . . 0.0 104.823 171.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -60.4 -16.32 34.52 Favored 'General case' 0 CA--C 1.557 1.237 0 N-CA-C 113.94 1.089 . . . . 0.0 113.94 -169.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -68.39 -22.06 64.66 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.33 0.586 . . . . 0.0 110.157 175.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 105.67 56.31 0.68 Allowed Glycine 0 N--CA 1.436 -1.339 0 N-CA-C 110.462 -1.055 . . . . 0.0 110.462 -176.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.528 ' HB2' ' HB3' ' A' ' 83' ' ' ASP . 32.1 mtm180 -135.86 150.54 49.42 Favored 'General case' 0 CA--C 1.484 -1.568 0 C-N-CA 123.871 0.869 . . . . 0.0 109.639 178.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . 0.431 ' O ' ' HA ' ' A' ' 34' ' ' PHE . . . -93.42 149.72 19.58 Favored Glycine 0 N--CA 1.42 -2.373 0 N-CA-C 109.29 -1.524 . . . . 0.0 109.29 176.182 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 89.3 mt -123.52 120.35 32.64 Favored 'General case' 0 C--N 1.287 -2.116 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 179.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -149.98 167.44 26.69 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 120.832 0.349 . . . . 0.0 110.489 -176.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.505 ' CZ ' ' HB2' ' A' ' 100' ' ' ASN . 5.4 t80 -94.25 133.02 38.22 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 105.618 -1.993 . . . . 0.0 105.618 174.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 44.4 mm -103.32 125.39 57.82 Favored 'Isoleucine or valine' 0 C--O 1.249 1.064 0 CA-C-O 120.919 0.39 . . . . 0.0 110.315 -175.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.55 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 61.8 m-85 -109.63 133.16 53.43 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 177.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -105.53 103.44 12.96 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -178.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.8 t70 46.98 40.46 9.38 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 125.69 1.596 . . . . 0.0 111.944 179.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.54 -25.0 24.38 Favored Glycine 0 N--CA 1.434 -1.458 0 CA-C-N 115.034 -0.985 . . . . 0.0 113.584 177.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.3 mtpt -97.09 160.46 14.33 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 117.081 0.44 . . . . 0.0 110.682 -176.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . 0.49 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 3.8 mpp? -92.47 116.18 28.75 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -174.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 49.1 t -73.05 -46.8 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 120.817 0.342 . . . . 0.0 110.697 -178.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.505 ' HB2' ' CZ ' ' A' ' 91' ' ' TYR . 1.4 m-20 -54.43 -50.92 66.49 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.025 -0.988 . . . . 0.0 112.25 -173.474 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.488 ' HB3' HD22 ' B' ' 138' ' ' LEU . 9.8 pt-20 -75.22 -27.34 59.51 Favored 'General case' 0 N--CA 1.426 -1.646 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -179.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.87 -39.78 95.5 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.038 0.447 . . . . 0.0 110.131 176.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 82.8 mt -56.72 -45.91 81.63 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.5 175.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 46.7 t -73.14 -35.4 47.54 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.141 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.109 -178.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 13.2 mmm180 -55.92 -41.47 74.61 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.983 0.913 . . . . 0.0 111.862 176.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -87.17 1.42 53.1 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.041 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.514 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 70.22 37.33 71.66 Favored Glycine 0 C--O 1.222 -0.595 0 C-N-CA 121.536 -0.364 . . . . 0.0 112.631 179.087 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 83.6 mt -106.61 -8.85 16.78 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-O 121.01 0.433 . . . . 0.0 110.733 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -147.47 154.28 40.59 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.279 -178.19 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.4 ' HB2' ' HB3' ' A' ' 40' ' ' ASP . 94.9 mttt -105.3 166.23 10.56 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 175.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.411 HG12 ' OE2' ' B' ' 142' ' ' GLU . 7.3 p -86.99 122.61 39.12 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 CA-C-O 121.762 0.791 . . . . 0.0 110.914 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.637 ' O ' ' HA ' ' A' ' 38' ' ' LEU . . . -94.34 120.95 35.35 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 107.135 -1.431 . . . . 0.0 107.135 174.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -83.55 112.38 19.94 Favored 'General case' 0 C--N 1.29 -1.989 0 CA-C-O 121.554 0.692 . . . . 0.0 111.993 -177.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 86.4 t -88.1 126.15 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.149 0 CA-C-N 114.861 -1.063 . . . . 0.0 108.445 -179.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.526 ' HA ' ' HA ' ' B' ' 130' ' ' PRO . 37.3 p90 -95.18 151.15 19.47 Favored 'General case' 0 C--N 1.282 -2.336 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.141 -177.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -78.07 126.26 83.96 Favored Pre-proline 0 N--CA 1.423 -1.813 0 N-CA-C 105.407 -2.071 . . . . 0.0 105.407 172.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -77.18 -176.94 3.47 Favored 'Trans proline' 0 N--CA 1.441 -1.597 0 C-N-CA 122.013 1.808 . . . . 0.0 114.978 -166.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -101.15 106.9 18.19 Favored 'General case' 0 N--CA 1.412 -2.36 0 CA-C-N 113.496 -1.683 . . . . 0.0 106.613 -175.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -116.52 96.41 5.5 Favored 'General case' 0 C--N 1.282 -2.345 0 CA-C-N 114.96 -1.018 . . . . 0.0 108.728 -175.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 19.5 m 86.18 -33.86 0.04 OUTLIER 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 113.349 -1.75 . . . . 0.0 112.406 172.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 . . . . . 0 C--O 1.243 0.72 0 C-N-CA 123.939 0.896 . . . . 0.0 110.021 179.071 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.853 0 N-CA-C 110.736 -0.945 . . . . 0.0 110.736 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 27.2 m 62.03 -159.38 0.32 Allowed 'General case' 0 C--O 1.246 0.883 0 C-N-CA 123.635 0.774 . . . . 0.0 110.19 -179.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 27.0 m -84.24 10.09 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -179.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -78.01 83.65 4.31 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 176.174 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 21.8 p90 -86.64 -49.11 7.75 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.752 -174.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 127' ' ' VAL . . . . . 0.52 HG11 ' HB2' ' A' ' 115' ' ' TYR . 70.3 t 66.4 133.1 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 O-C-N 124.16 0.912 . . . . 0.0 111.764 -176.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 78.4 m-85 -76.3 -60.89 2.14 Favored 'General case' 0 C--N 1.311 -1.101 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.214 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -157.85 171.32 7.59 Favored Pre-proline 0 C--N 1.307 -1.261 0 N-CA-C 107.489 -1.301 . . . . 0.0 107.489 -177.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . 0.526 ' HA ' ' HA ' ' A' ' 115' ' ' TYR . 35.2 Cg_exo -66.02 168.85 14.59 Favored 'Trans proline' 0 C--O 1.245 0.855 0 C-N-CA 122.173 1.915 . . . . 0.0 111.809 174.424 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 131' ' ' ASN . . . . . 0.411 ' HB2' ' OD2' ' A' ' 77' ' ' ASP . 31.4 p-10 -66.87 -42.74 85.12 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 177.238 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.585 ' HA ' ' HB3' ' B' ' 135' ' ' GLU . 29.0 t-20 73.31 4.97 4.98 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 124.81 1.244 . . . . 0.0 113.761 168.163 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 7.1 t -49.06 -53.8 18.71 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 113.585 0.958 . . . . 0.0 113.585 -176.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . 0.432 ' O ' HD23 ' B' ' 138' ' ' LEU . 11.2 m-70 -135.05 19.99 3.45 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 176.473 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.585 ' HB3' ' HA ' ' B' ' 132' ' ' ASN . 2.3 tm-20 -57.61 -42.59 83.59 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.451 -1.25 . . . . 0.0 112.459 -172.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -69.81 -42.59 73.49 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-O 121.466 0.651 . . . . 0.0 109.449 -178.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 95.3 mt -60.95 -45.56 94.22 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.317 178.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 138' ' ' LEU . . . . . 0.488 HD22 ' HB3' ' A' ' 101' ' ' GLU . 4.3 mm? -60.38 -47.41 86.17 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.743 176.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 139' ' ' ARG . . . . . 0.464 ' HD2' ' OE2' ' B' ' 135' ' ' GLU . 53.3 mtt180 -62.62 -41.08 98.8 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 178.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -64.48 -35.47 81.05 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.553 176.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 30.7 m -68.35 -41.9 80.04 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.228 177.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.525 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 38.5 tt0 -64.56 -50.66 66.42 Favored 'General case' 0 CA--C 1.495 -1.162 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.146 179.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . 0.519 ' O ' ' HG2' ' B' ' 147' ' ' LYS . . . -56.64 -39.22 73.3 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.857 0.723 . . . . 0.0 110.896 -179.097 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 144' ' ' GLN . . . . . 0.485 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 35.4 tt0 -65.1 -47.67 76.39 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 116.032 -0.531 . . . . 0.0 109.689 178.239 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -63.62 -33.48 75.71 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.02 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 146' ' ' LYS . . . . . 0.545 ' HA ' ' CG ' ' B' ' 153' ' ' TRP . 79.8 mttt -62.4 -45.76 91.68 Favored 'General case' 0 CA--C 1.51 -0.589 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.216 177.226 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . 0.519 ' HG2' ' O ' ' B' ' 143' ' ' ALA . 34.7 mmtp -66.71 -44.97 80.19 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.602 -178.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 22.5 mm-40 -75.43 -10.21 59.25 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.323 -176.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp 58.26 48.94 11.88 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.013 0.925 . . . . 0.0 110.588 -178.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . 0.425 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 95.7 mt -86.02 115.39 23.59 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.277 -177.033 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 151' ' ' ASN . . . . . 0.514 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 40.3 m-80 53.67 -81.47 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 126.107 1.763 . . . . 0.0 113.019 178.248 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 152' ' ' ILE . . . . . 0.584 HG12 ' HE2' ' A' ' 53' ' ' LYS . 67.3 mt -56.85 -60.35 2.08 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.328 0 C-N-CA 124.183 0.993 . . . . 0.0 110.426 -178.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 153' ' ' TRP . . . . . 0.545 ' CG ' ' HA ' ' B' ' 146' ' ' LYS . 62.4 m95 -71.62 -7.83 50.26 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 114.291 -1.322 . . . . 0.0 113.414 -166.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 27.1 t -74.93 -0.67 19.42 Favored 'General case' 0 CA--C 1.567 1.633 0 CA-C-O 121.134 0.492 . . . . 0.0 109.808 174.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -64.39 -17.64 63.94 Favored 'General case' 0 C--O 1.25 1.1 0 C-N-CA 124.757 1.223 . . . . 0.0 111.023 173.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 29.7 t70 . . . . . 0 N--CA 1.445 -0.689 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.146 -178.117 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.25 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.6 t -154.33 136.48 14.78 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.7 m -81.3 109.24 15.62 Favored 'General case' 0 N--CA 1.427 -1.593 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.6 m -138.97 96.91 3.2 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-O 121.44 0.638 . . . . 0.0 110.362 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -146.86 -43.29 0.18 Allowed 'General case' 0 C--N 1.298 -1.657 0 CA-C-N 114.922 -1.035 . . . . 0.0 110.263 177.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -70.07 -47.12 63.28 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -177.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.686 HD11 ' HE2' ' B' ' 134' ' ' HIS . 63.1 mt -136.21 -169.97 2.55 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 -177.595 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.563 ' O ' ' HA ' ' A' ' 75' ' ' GLU . 46.3 m-70 -94.81 103.4 15.3 Favored 'General case' 0 C--O 1.212 -0.911 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -113.8 117.68 32.15 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 120.685 0.279 . . . . 0.0 111.239 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -139.01 157.72 70.95 Favored Pre-proline 0 C--N 1.305 -1.344 0 CA-C-O 119.441 -0.314 . . . . 0.0 110.993 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -78.92 147.98 21.76 Favored 'Trans proline' 0 C--O 1.243 0.766 0 C-N-CA 121.998 1.799 . . . . 0.0 111.431 178.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -136.13 156.85 48.09 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 178.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.457 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 87.8 m -94.7 132.83 39.02 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.72 -178.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.497 ' HB2' HD12 ' A' ' 72' ' ' ILE . 60.7 tp -77.04 127.17 32.2 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 120.578 0.228 . . . . 0.0 111.026 -179.101 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 51.0 mm -98.79 -54.7 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 N-CA-C 107.375 -1.342 . . . . 0.0 107.375 172.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -170.67 157.15 5.56 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.065 179.46 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.423 ' HB2' HG21 ' A' ' 66' ' ' VAL . . . -111.04 120.61 42.94 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 174.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.45 ' HB ' ' O ' ' A' ' 22' ' ' THR . 67.0 mt -89.47 -64.12 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.102 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -175.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -129.14 -164.46 1.4 Allowed 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -177.272 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -88.64 48.33 3.53 Favored Glycine 0 CA--C 1.507 -0.452 0 N-CA-C 110.688 -0.965 . . . . 0.0 110.688 -179.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.556 ' HB3' HG23 ' A' ' 41' ' ' THR . 1.9 t70 178.5 -61.91 0.01 OUTLIER 'General case' 0 CA--C 1.496 -1.123 0 C-N-CA 125.565 1.546 . . . . 0.0 108.534 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.45 ' O ' ' HB ' ' A' ' 18' ' ' ILE . 24.1 m -76.58 106.71 8.39 Favored 'General case' 0 N--CA 1.404 -2.752 0 CA-C-N 114.094 -1.412 . . . . 0.0 109.995 -174.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 24.6 m -131.63 164.54 34.24 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 -179.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -121.7 114.27 20.89 Favored 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 118.514 0.597 . . . . 0.0 109.812 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.502 HD21 HG21 ' A' ' 72' ' ' ILE . 7.4 mp -126.32 159.18 33.86 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-O 121.217 0.532 . . . . 0.0 111.517 177.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.457 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 57.5 ttp -114.77 117.08 29.77 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.523 179.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.5 p90 -122.91 131.65 53.83 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 54.2 mttp 55.97 27.44 11.21 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 123.7 0.8 . . . . 0.0 112.514 -176.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 88.97 3.84 75.91 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 121.077 -0.582 . . . . 0.0 112.89 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.414 ' O ' ' HA ' ' A' ' 26' ' ' MET . 14.7 mm100 -106.29 104.96 52.52 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 116.842 0.321 . . . . 0.0 110.744 -179.058 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -78.98 107.37 2.23 Favored 'Trans proline' 0 C--O 1.247 0.962 0 C-N-CA 122.696 2.264 . . . . 0.0 110.264 175.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 65.5 mtt -127.32 154.13 45.32 Favored 'General case' 0 C--N 1.293 -1.851 0 CA-C-O 121.137 0.494 . . . . 0.0 110.783 -177.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.9 m -81.2 136.62 35.87 Favored 'General case' 0 N--CA 1.42 -1.947 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 175.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.455 ' CE1' ' HB2' ' A' ' 25' ' ' LEU . 39.2 m-85 -105.05 149.05 26.13 Favored 'General case' 0 C--N 1.277 -2.568 0 CA-C-O 121.319 0.58 . . . . 0.0 112.257 -178.125 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.536 HH12 ' HA ' ' A' ' 40' ' ' ASP . 12.7 tpt85 -130.63 119.21 22.12 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 104.285 -2.487 . . . . 0.0 104.285 176.679 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.424 ' CD2' HG12 ' A' ' 92' ' ' ILE . 26.5 mt -83.98 137.76 33.46 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-O 122.142 0.972 . . . . 0.0 112.437 -169.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.487 HD21 ' HB3' ' A' ' 89' ' ' LEU . 98.5 mt -73.38 130.8 40.94 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 114.646 -1.161 . . . . 0.0 110.205 178.449 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.507 HD12 ' OH ' ' A' ' 91' ' ' TYR . 87.3 mt 73.78 7.41 4.95 Favored 'General case' 0 C--O 1.212 -0.869 0 C-N-CA 124.464 1.106 . . . . 0.0 113.438 176.106 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.7 t -125.01 125.66 69.9 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.716 0 N-CA-C 107.108 -1.442 . . . . 0.0 107.108 175.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.536 ' HA ' HH12 ' A' ' 35' ' ' ARG . 11.0 t70 -105.58 140.68 38.29 Favored 'General case' 0 C--N 1.282 -2.346 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 179.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.556 HG23 ' HB3' ' A' ' 21' ' ' ASP . 1.0 OUTLIER -71.73 121.67 85.12 Favored Pre-proline 0 N--CA 1.425 -1.693 0 O-C-N 124.254 0.971 . . . . 0.0 110.399 -171.387 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -61.61 -54.87 1.38 Allowed 'Trans proline' 0 C--O 1.259 1.527 0 C-N-CA 122.65 2.233 . . . . 0.0 109.124 178.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.431 ' HB2' ' HG3' ' A' ' 45' ' ' LYS . 37.3 mt-10 64.32 168.49 0.17 Allowed 'General case' 0 CA--C 1.51 -0.579 0 C-N-CA 125.804 1.642 . . . . 0.0 112.341 178.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.7 t -102.78 66.95 0.96 Allowed 'General case' 0 N--CA 1.397 -3.088 0 N-CA-C 105.295 -2.113 . . . . 0.0 105.295 168.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.431 ' HG3' ' HB2' ' A' ' 43' ' ' GLU . 53.7 mttp -49.72 -31.5 11.44 Favored 'General case' 0 N--CA 1.485 1.312 0 CA-C-N 113.797 -1.547 . . . . 0.0 113.618 -174.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . 0.449 ' HB2' ' HB2' ' A' ' 49' ' ' LYS . 76.7 m-70 -134.44 105.38 11.04 Favored Pre-proline 0 C--N 1.288 -2.086 0 N-CA-C 103.424 -2.806 . . . . 0.0 103.424 171.419 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -36.45 -48.77 1.31 Allowed 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 125.062 3.841 . . . . 0.0 116.762 -171.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -77.15 -24.07 51.61 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-O 121.172 0.511 . . . . 0.0 111.24 -178.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.449 ' HB2' ' HB2' ' A' ' 46' ' ' HIS . 27.9 mmmt -98.72 -1.09 41.43 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.038 -175.081 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -62.92 -18.7 60.19 Favored Glycine 0 C--N 1.337 0.584 0 CA-C-N 116.215 -0.448 . . . . 0.0 112.525 -178.374 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 41.3 t -67.57 -35.9 74.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 178.65 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.9 mm-40 -74.08 -24.17 59.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.638 0.733 . . . . 0.0 109.619 -177.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.8 mmtm -83.58 -15.59 48.56 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.758 -1.11 . . . . 0.0 110.533 177.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 65.29 21.64 12.03 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 123.815 0.846 . . . . 0.0 110.229 -176.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -53.6 -50.78 52.13 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-N 114.05 -1.432 . . . . 0.0 113.85 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -50.84 -50.56 13.42 Favored 'Trans proline' 0 C--N 1.37 1.676 0 C-N-CA 122.735 2.29 . . . . 0.0 112.684 176.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -63.07 -42.78 99.73 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.22 -45.59 90.93 Favored 'General case' 0 C--O 1.243 0.761 0 CA-C-O 121.066 0.46 . . . . 0.0 111.353 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.45 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 36.1 p -70.17 -41.91 73.17 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.365 -179.115 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.48 -42.1 92.59 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 122.199 0.2 . . . . 0.0 111.046 179.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -55.47 -43.9 75.97 Favored 'General case' 0 C--O 1.242 0.686 0 C-N-CA 122.715 0.406 . . . . 0.0 109.929 178.052 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 34.8 m -63.95 -46.3 85.31 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.033 177.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' A' ' 59' ' ' SER . 49.7 mttp -57.39 -54.93 41.28 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.227 -179.582 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -63.98 -29.69 70.83 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -177.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.574 ' SD ' HG22 ' A' ' 99' ' ' VAL . 49.6 ttm -72.64 -46.12 55.59 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 119.621 -0.831 . . . . 0.0 111.194 179.367 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.423 HG21 ' HB2' ' A' ' 17' ' ' ALA . 33.8 m -73.39 -30.11 29.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 C-N-CA 120.338 -0.545 . . . . 0.0 112.172 -177.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -76.02 -23.55 55.18 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 120.549 0.214 . . . . 0.0 111.364 177.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -77.53 -31.84 53.61 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.492 0.663 . . . . 0.0 109.829 177.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.746 ' HB2' ' HB1' ' A' ' 94' ' ' ALA . . . -65.89 157.74 29.79 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 114.913 -1.04 . . . . 0.0 112.32 -178.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.48 ' N ' ' HD3' ' A' ' 70' ' ' LYS . 2.3 mppt? -110.42 -39.93 4.79 Favored 'General case' 0 C--N 1.291 -1.95 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 175.397 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.6 mtmt -120.75 121.81 39.02 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 114.748 -1.115 . . . . 0.0 108.506 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.502 HG21 HD21 ' A' ' 25' ' ' LEU . 61.0 mt -113.16 135.48 52.52 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.147 0 N-CA-C 108.836 -0.802 . . . . 0.0 108.836 178.268 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.561 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 33.8 mm-40 -112.45 141.4 46.23 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -179.007 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.3 m -114.75 127.31 72.32 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.076 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 174.083 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.563 ' HA ' ' O ' ' A' ' 8' ' ' HIS . 40.2 tt0 -121.83 117.23 26.01 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.477 -179.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.523 ' O ' ' HB3' ' A' ' 7' ' ' LEU . 50.7 m-85 -95.84 143.41 27.08 Favored 'General case' 0 C--O 1.254 1.324 0 C-N-CA 123.781 0.832 . . . . 0.0 109.437 -177.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.505 ' HA ' HD22 ' A' ' 7' ' ' LEU . 8.2 t70 -87.98 -174.26 4.62 Favored 'General case' 0 C--O 1.253 1.255 0 CA-C-O 120.96 0.41 . . . . 0.0 111.117 -173.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.457 ' HE2' ' HA ' ' A' ' 78' ' ' LYS . 9.3 mmpt? -72.95 -21.06 60.93 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 124.087 0.955 . . . . 0.0 112.618 -170.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -99.22 -80.7 1.55 Allowed Glycine 0 C--N 1.314 -0.664 0 C-N-CA 119.303 -1.427 . . . . 0.0 114.882 -170.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -122.69 128.39 50.51 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 122.401 -0.47 . . . . 0.0 110.012 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.424 ' HD2' ' N ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -103.4 -4.67 23.81 Favored 'General case' 0 N--CA 1.427 -1.578 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.219 -173.185 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 21.9 p -136.24 150.65 49.06 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -179.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -116.58 153.74 31.7 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-O 120.836 0.35 . . . . 0.0 111.03 -178.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -65.45 -16.64 63.85 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.557 1.143 . . . . 0.0 113.634 -175.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -72.15 -12.81 61.36 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 121.206 0.527 . . . . 0.0 110.13 173.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 95.72 35.87 5.49 Favored Glycine 0 N--CA 1.439 -1.112 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -176.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -121.94 165.27 16.22 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 115.289 -0.456 . . . . 0.0 110.481 -176.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -100.44 137.7 13.41 Favored Glycine 0 N--CA 1.434 -1.438 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 174.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.487 ' HB3' HD21 ' A' ' 37' ' ' LEU . 95.3 mt -100.98 107.05 18.42 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 -178.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -154.38 168.06 27.91 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.437 0.637 . . . . 0.0 112.542 -175.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.507 ' OH ' HD12 ' A' ' 38' ' ' LEU . 2.5 m-85 -94.59 134.95 36.61 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.396 -1.274 . . . . 0.0 108.571 170.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.424 HG12 ' CD2' ' A' ' 36' ' ' LEU . 47.8 mm -99.89 126.09 53.42 Favored 'Isoleucine or valine' 0 C--O 1.254 1.328 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 175.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.561 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 31.1 m-85 -120.48 131.75 54.88 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 174.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.746 ' HB1' ' HB2' ' A' ' 69' ' ' ALA . . . -106.28 98.49 8.16 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 177.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.479 1.1 p30 31.95 57.32 0.34 Allowed 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 116.214 1.931 . . . . 0.0 116.214 -176.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 103.84 -21.95 36.83 Favored Glycine 0 N--CA 1.427 -1.925 0 CA-C-N 114.135 -1.393 . . . . 0.0 113.77 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -89.56 123.73 33.9 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 -178.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . 0.499 ' HG3' ' CE2' ' A' ' 93' ' ' TYR . 4.5 mpp? -84.32 101.6 12.06 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.255 178.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.574 HG22 ' SD ' ' A' ' 65' ' ' MET . 37.9 t -62.87 -46.06 97.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -54.86 -47.81 73.72 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 113.812 -1.54 . . . . 0.0 110.893 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.42 ' HB3' ' HB2' ' A' ' 98' ' ' MET . 13.7 tp10 -62.09 -50.64 71.13 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 123.734 0.814 . . . . 0.0 109.994 179.27 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.63 -41.14 85.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.582 -0.735 . . . . 0.0 112.192 -176.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 99' ' ' VAL . 95.8 mt -58.4 -46.34 86.6 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-O 120.738 0.304 . . . . 0.0 111.814 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.8 t -73.29 -43.87 56.08 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-O 121.191 0.52 . . . . 0.0 109.99 178.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 21.8 tpt180 -60.95 -40.32 92.87 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.951 -176.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -84.0 -5.45 59.23 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.426 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 68.93 38.68 85.11 Favored Glycine 0 CA--C 1.503 -0.661 0 N-CA-C 111.575 -0.61 . . . . 0.0 111.575 -178.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.8 mt -94.27 -22.07 18.62 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -178.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -140.57 174.43 10.52 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 115.284 -0.871 . . . . 0.0 108.842 -177.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 93.0 mttt -111.54 166.08 11.45 Favored 'General case' 0 C--N 1.309 -1.166 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.492 ' HA ' ' O ' ' A' ' 38' ' ' LEU . 73.6 t -83.89 127.07 40.12 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.237 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.076 177.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -88.69 125.68 34.96 Favored 'General case' 0 CA--C 1.496 -1.133 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -71.89 122.57 21.01 Favored 'General case' 0 N--CA 1.428 -1.538 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.969 179.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.479 HG11 HD22 ' B' ' 131' ' ' ASN . 13.5 t -88.07 152.27 3.41 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.446 0 N-CA-C 106.04 -1.837 . . . . 0.0 106.04 175.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -94.19 133.89 37.22 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-O 121.035 0.445 . . . . 0.0 111.414 -168.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 8.6 mptt -103.97 159.17 30.18 Favored Pre-proline 0 C--N 1.31 -1.137 0 CA-C-N 115.398 -0.819 . . . . 0.0 108.956 -178.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.19 -9.17 24.05 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.06 1.84 . . . . 0.0 109.183 173.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -79.65 -1.9 40.3 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 113.781 -1.554 . . . . 0.0 109.642 177.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -57.2 -45.41 83.79 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 175.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 7.5 t -101.11 -37.31 8.64 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.095 -0.957 . . . . 0.0 108.883 173.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 . . . . . 0 C--N 1.351 0.659 0 C-N-CA 125.08 1.352 . . . . 0.0 110.713 -177.457 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.172 0 N-CA-C 109.354 -1.498 . . . . 0.0 109.354 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . . . . . . . . . 14.1 m -88.84 -18.59 27.31 Favored 'General case' 0 N--CA 1.434 -1.274 0 CA-C-O 120.996 0.427 . . . . 0.0 111.167 -175.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 42.8 t -92.18 100.05 10.65 Favored 'Isoleucine or valine' 0 C--O 1.244 0.78 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 177.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -83.04 55.32 3.06 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-O 121.755 0.788 . . . . 0.0 111.046 -178.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -127.66 97.62 4.91 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 178.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 33.6 m -103.52 -29.87 2.9 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 C-N-CA 120.132 -0.627 . . . . 0.0 111.811 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 69.5 t80 55.29 84.91 0.07 Allowed 'General case' 0 C--O 1.246 0.919 0 O-C-N 124.028 0.83 . . . . 0.0 109.946 -170.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.457 ' HA ' ' HD3' ' B' ' 130' ' ' PRO . 83.2 tttt -55.16 122.56 43.43 Favored Pre-proline 0 C--N 1.304 -1.405 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 172.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' B' ' 129' ' ' LYS . 17.2 Cg_exo -63.52 149.18 91.68 Favored 'Trans proline' 0 N--CA 1.449 -1.102 0 C-N-CA 122.305 2.003 . . . . 0.0 113.102 -172.19 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 131' ' ' ASN . . . . . 0.479 HD22 HG11 ' A' ' 114' ' ' VAL . 4.0 t30 -77.23 102.47 6.68 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 104.687 -2.338 . . . . 0.0 104.687 175.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -157.71 -72.17 0.09 Allowed 'General case' 0 C--N 1.297 -1.706 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -169.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 133' ' ' THR . . . . . 0.411 ' HB ' ' CD2' ' B' ' 134' ' ' HIS . 3.2 m 44.96 -53.62 0.0 OUTLIER 'General case' 0 CA--C 1.585 2.323 0 C-N-CA 128.67 2.788 . . . . 0.0 117.862 177.552 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . 0.686 ' HE2' HD11 ' A' ' 7' ' ' LEU . 3.0 p80 -129.26 20.37 5.78 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 125.029 1.332 . . . . 0.0 111.227 -172.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . 0.427 ' HA ' ' CD1' ' A' ' 38' ' ' LEU . 36.3 tt0 -58.56 -44.48 89.72 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.37 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -61.47 -34.17 75.01 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.396 -176.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 82.9 mt -63.3 -50.97 68.0 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-O 121.126 0.488 . . . . 0.0 110.002 179.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 138' ' ' LEU . . . . . 0.41 ' HA ' HD23 ' B' ' 138' ' ' LEU . 24.7 mt -69.92 -34.42 73.45 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 178.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 139' ' ' ARG . . . . . 0.417 ' HG2' HG11 ' A' ' 111' ' ' VAL . 15.4 mtp85 -69.23 -31.49 70.09 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 179.03 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -77.26 -22.66 51.78 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 121.359 0.599 . . . . 0.0 111.138 174.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 49.1 m -76.4 -38.09 56.18 Favored 'General case' 0 N--CA 1.427 -1.605 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 173.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.571 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 36.4 tt0 -60.48 -42.98 97.37 Favored 'General case' 0 C--O 1.209 -1.069 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 173.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -52.96 -43.37 66.3 Favored 'General case' 0 C--O 1.242 0.693 0 C-N-CA 123.451 0.7 . . . . 0.0 111.452 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 144' ' ' GLN . . . . . 0.496 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 75.3 mt-30 -70.7 -48.36 55.07 Favored 'General case' 0 CA--C 1.497 -1.084 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.154 177.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -57.91 -38.85 76.61 Favored 'General case' 0 C--O 1.244 0.777 0 O-C-N 123.945 0.778 . . . . 0.0 112.038 -176.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 146' ' ' LYS . . . . . 0.571 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 89.4 mttt -57.62 -51.72 68.37 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 175.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -64.13 -45.15 89.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.109 -178.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 23.3 mm-40 -64.14 -14.08 52.51 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 124.093 0.957 . . . . 0.0 113.035 -178.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . 0.48 ' O ' ' HB2' ' B' ' 154' ' ' SER . 0.0 OUTLIER 62.39 40.95 10.57 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -178.932 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . 0.412 ' HG ' ' HB2' ' B' ' 148' ' ' GLU . 90.5 mt -76.41 109.7 10.35 Favored 'General case' 0 C--N 1.315 -0.918 0 C-N-CA 120.948 -0.301 . . . . 0.0 111.238 -175.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 151' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 2.7 m-20 46.1 -88.3 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.415 1.886 . . . . 0.0 114.224 179.492 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 13.1 tt -68.19 -27.63 37.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 -176.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 153' ' ' TRP . . . . . 0.522 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 63.9 m95 -80.8 -7.25 59.36 Favored 'General case' 0 N--CA 1.435 -1.198 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.545 -178.143 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . 0.48 ' HB2' ' O ' ' B' ' 149' ' ' LYS . 22.5 t -81.6 13.38 3.14 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 120.985 0.421 . . . . 0.0 110.052 177.058 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -81.96 -20.81 37.8 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 172.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 156' ' ' ASP . . . . . 0.475 ' HB3' ' HE2' ' B' ' 149' ' ' LYS . 14.2 t70 . . . . . 0 N--CA 1.443 -0.82 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.27 -176.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.603 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.2 t -158.74 143.15 15.75 Favored 'General case' 0 N--CA 1.422 -1.853 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 176.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 30.2 t -100.85 119.82 39.22 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 178.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 25.7 p -88.59 134.51 33.86 Favored 'General case' 0 N--CA 1.421 -1.896 0 C-N-CA 120.336 -0.546 . . . . 0.0 110.116 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 61.1 mttp 65.78 -92.78 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 124.749 1.219 . . . . 0.0 110.547 -177.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.441 ' HG2' ' H ' ' A' ' 7' ' ' LEU . 4.1 ttmp? 178.15 176.02 0.49 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 105.213 -2.143 . . . . 0.0 105.213 178.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.441 ' H ' ' HG2' ' A' ' 6' ' ' LYS . 0.7 OUTLIER -109.68 92.43 4.05 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-O 122.307 1.051 . . . . 0.0 113.232 177.635 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -123.81 169.85 11.13 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-N 113.917 -1.492 . . . . 0.0 111.058 173.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.432 ' HA ' ' O ' ' A' ' 74' ' ' VAL . 43.1 mtmt -65.29 143.98 57.43 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 124.481 1.113 . . . . 0.0 112.562 -172.186 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -126.86 158.09 69.53 Favored Pre-proline 0 C--N 1.297 -1.71 0 N-CA-C 105.31 -2.107 . . . . 0.0 105.31 167.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -74.34 147.34 36.91 Favored 'Trans proline' 0 C--N 1.322 -0.817 0 C-N-CA 122.163 1.909 . . . . 0.0 112.096 -178.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -139.01 155.47 47.96 Favored 'General case' 0 N--CA 1.428 -1.566 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.429 ' HB ' ' HB3' ' A' ' 26' ' ' MET . 37.5 m -103.19 123.07 46.02 Favored 'General case' 0 N--CA 1.415 -2.195 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 49.1 tp -69.29 124.76 24.69 Favored 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 178.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.4 mm -88.15 -52.33 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.173 0 N-CA-C 107.159 -1.422 . . . . 0.0 107.159 174.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -174.87 161.92 3.1 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 176.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -103.55 147.52 27.08 Favored 'General case' 0 C--N 1.285 -2.196 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 174.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.0 mp -107.25 -58.08 3.99 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 N-CA-C 107.359 -1.349 . . . . 0.0 107.359 176.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -140.91 173.58 11.34 Favored 'General case' 0 CA--C 1.484 -1.562 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.517 178.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -82.91 60.63 4.87 Favored Glycine 0 CA--C 1.5 -0.878 0 N-CA-C 108.449 -1.86 . . . . 0.0 108.449 174.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.463 ' HB2' ' HB ' ' A' ' 41' ' ' THR . 7.2 t70 -174.86 -56.98 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 124.691 1.196 . . . . 0.0 108.682 -172.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 34.8 m -119.04 127.78 53.74 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.966 178.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 15.9 m -135.52 167.57 24.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 C-N-CA 124.356 1.062 . . . . 0.0 109.796 -176.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -121.09 117.88 28.32 Favored 'General case' 0 C--N 1.316 -0.856 0 O-C-N 121.852 -0.53 . . . . 0.0 110.044 -177.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.407 ' HB2' ' CD1' ' A' ' 34' ' ' PHE . 7.0 mp -127.92 159.5 34.75 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.473 0.654 . . . . 0.0 111.667 -178.453 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.47 ' HA ' ' O ' ' A' ' 30' ' ' GLN . 57.7 ttp -119.92 111.19 17.63 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 175.047 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.6 p90 -109.91 114.93 28.88 Favored 'General case' 0 C--N 1.293 -1.85 0 C-N-CA 118.709 -1.197 . . . . 0.0 109.962 -177.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 52.5 mtpt 63.28 28.44 15.73 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.736 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.449 ' O ' ' HD3' ' A' ' 31' ' ' PRO . . . 94.82 2.78 62.67 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 114.868 -1.06 . . . . 0.0 113.072 -178.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.47 ' O ' ' HA ' ' A' ' 26' ' ' MET . 1.9 mp0 -99.72 101.97 15.47 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 117.022 0.411 . . . . 0.0 111.488 178.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.449 ' HD3' ' O ' ' A' ' 29' ' ' GLY . 4.4 Cg_exo -78.09 113.7 3.46 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.351 2.034 . . . . 0.0 110.828 177.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 26.4 mmt -136.25 156.06 49.21 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.954 -178.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.0 m -95.04 112.21 23.94 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 176.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.407 ' CD1' ' HB2' ' A' ' 25' ' ' LEU . 60.2 m-85 -95.85 145.07 25.65 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-O 121.526 0.679 . . . . 0.0 112.129 -174.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -123.07 117.75 26.14 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 105.464 -2.05 . . . . 0.0 105.464 176.607 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.401 ' HG ' ' CG1' ' A' ' 92' ' ' ILE . 6.7 mp -60.62 116.14 4.15 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 123.945 0.778 . . . . 0.0 112.219 -174.166 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.402 HD21 ' HB3' ' A' ' 89' ' ' LEU . 74.1 mt -70.19 140.35 52.51 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.571 175.723 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 62.5 mt 76.54 10.07 2.92 Favored 'General case' 0 C--O 1.217 -0.625 0 C-N-CA 125.534 1.534 . . . . 0.0 110.705 -175.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.48 HG13 ' HB1' ' A' ' 109' ' ' ALA . 53.8 t -126.02 138.21 55.29 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.135 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 176.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.409 ' C ' ' HD3' ' A' ' 42' ' ' PRO . 14.5 t70 -148.13 106.58 3.77 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 179.471 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.596 ' N ' ' HD3' ' A' ' 42' ' ' PRO . 3.3 m -127.61 38.55 0.43 Allowed Pre-proline 0 CA--C 1.598 2.821 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 175.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.596 ' HD3' ' N ' ' A' ' 41' ' ' THR . 4.0 Cg_endo -89.76 77.12 1.03 Allowed 'Trans proline' 0 C--N 1.375 1.956 0 C-N-CA 121.829 1.686 . . . . 0.0 111.976 -179.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -129.9 127.86 41.0 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 174.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 22.4 m -65.37 113.01 3.78 Favored 'General case' 0 N--CA 1.429 -1.521 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 178.068 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.561 ' O ' ' HD2' ' A' ' 47' ' ' PRO . 56.9 mttp -66.88 -44.46 80.83 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.845 -173.51 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . 0.358 97.9 m-70 85.53 -83.12 0.0 OUTLIER Pre-proline 0 CA--C 1.555 1.149 0 C-N-CA 126.271 1.828 . . . . 0.0 112.381 -177.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.561 ' HD2' ' O ' ' A' ' 45' ' ' LYS . 72.5 Cg_endo -81.06 173.82 11.49 Favored 'Trans proline' 0 C--N 1.366 1.473 0 CA-C-N 122.306 1.859 . . . . 0.0 109.696 172.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -118.62 -37.52 3.27 Favored 'General case' 0 C--N 1.294 -1.812 0 CA-C-O 121.193 0.52 . . . . 0.0 110.273 178.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -83.83 -6.07 59.34 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.647 -174.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -151.38 85.02 0.15 Allowed Glycine 0 C--N 1.305 -1.157 0 C-N-CA 120.116 -1.04 . . . . 0.0 112.383 -178.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 59.5 t -124.91 113.25 35.07 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.221 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -61.41 -29.94 70.25 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.564 0.746 . . . . 0.0 112.526 -176.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.2 ptpt -86.23 -12.72 48.9 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 69.48 30.39 4.08 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 175.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -47.46 -50.94 17.19 Favored Glycine 0 CA--C 1.55 2.266 0 CA-C-N 115.047 -0.979 . . . . 0.0 114.429 176.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -64.83 -25.85 60.16 Favored 'Trans proline' 0 C--N 1.373 1.82 0 CA-C-N 120.488 2.144 . . . . 0.0 112.379 178.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -80.06 -28.15 39.26 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.581 -177.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.19 -48.06 81.71 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 174.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.408 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 14.6 m -62.84 -34.54 77.56 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.21 177.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -64.46 -46.9 81.11 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.893 0.378 . . . . 0.0 110.056 177.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -60.82 -41.63 96.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.913 177.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.514 ' O ' HG22 ' A' ' 66' ' ' VAL . 54.2 m -58.38 -48.63 79.99 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.127 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 59' ' ' SER . 56.2 mtpt -56.37 -51.84 66.82 Favored 'General case' 0 CA--C 1.509 -0.61 0 O-C-N 123.601 0.563 . . . . 0.0 110.734 178.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -58.74 -39.76 81.84 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.213 -177.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 13.2 tpt -69.9 -47.73 61.37 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.663 -179.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 62' ' ' THR . 35.8 m -77.85 -34.68 19.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.928 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 -175.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -76.47 -19.49 57.97 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-O 121.027 0.442 . . . . 0.0 110.693 -179.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -89.93 -10.02 46.69 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.287 176.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -78.8 133.68 37.04 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 120.904 0.383 . . . . 0.0 111.767 -175.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -73.31 -34.13 65.55 Favored 'General case' 0 CA--C 1.502 -0.874 0 CA-C-O 121.439 0.637 . . . . 0.0 111.219 176.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.9 mtmt -131.66 123.1 27.11 Favored 'General case' 0 C--N 1.292 -1.899 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 4.4 mp -101.71 121.54 52.79 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.314 0 N-CA-C 104.983 -2.228 . . . . 0.0 104.983 173.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.557 ' HB2' ' HB2' ' A' ' 93' ' ' TYR . 24.4 mt-10 -119.08 145.51 45.85 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-O 120.793 0.33 . . . . 0.0 110.904 -173.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.432 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 11.0 m -120.96 133.39 67.77 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.759 179.119 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -135.64 134.42 39.23 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.555 ' HB3' ' HG2' ' A' ' 81' ' ' ARG . 89.9 m-85 -95.28 148.03 22.85 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.469 -175.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -85.81 163.71 17.99 Favored 'General case' 0 C--O 1.246 0.877 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 -179.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.437 ' HG3' ' HB2' ' B' ' 131' ' ' ASN . 19.8 ptmt -73.1 -6.05 43.12 Favored 'General case' 0 C--O 1.246 0.887 0 C-N-CA 123.167 0.587 . . . . 0.0 111.955 -178.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -96.44 -99.28 1.89 Allowed Glycine 0 N--CA 1.433 -1.542 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 175.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 19.5 mp0 -93.52 134.93 35.27 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-O 121.041 0.448 . . . . 0.0 111.125 -176.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.555 ' HG2' ' HB3' ' A' ' 76' ' ' PHE . 55.8 mtt180 -111.67 -27.61 8.46 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.922 175.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 16.2 p -140.25 133.91 30.31 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.568 -176.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -97.86 146.41 25.46 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 176.479 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -68.0 -13.19 61.99 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -176.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -87.76 -0.85 57.48 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 178.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 89.85 54.81 2.12 Favored Glycine 0 N--CA 1.427 -1.92 0 C-N-CA 120.43 -0.891 . . . . 0.0 111.547 178.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -131.14 143.91 50.98 Favored 'General case' 0 C--N 1.307 -1.26 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 176.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -90.28 121.52 6.23 Favored Glycine 0 N--CA 1.422 -2.254 0 N-CA-C 108.172 -1.971 . . . . 0.0 108.172 173.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.402 ' HB3' HD21 ' A' ' 37' ' ' LEU . 90.4 mt -101.33 107.4 18.74 Favored 'General case' 0 C--N 1.289 -2.023 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 -177.594 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -153.92 167.33 30.09 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.463 -176.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.403 ' OH ' ' HB ' ' B' ' 133' ' ' THR . 41.1 m-85 -87.31 142.33 27.97 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 173.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.401 ' CG1' ' HG ' ' A' ' 36' ' ' LEU . 50.0 mm -108.31 123.32 63.83 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 178.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.557 ' HB2' ' HB2' ' A' ' 73' ' ' GLU . 17.4 m-85 -115.44 150.5 36.35 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 177.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -120.59 99.93 6.83 Favored 'General case' 0 C--N 1.291 -1.956 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 176.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . 0.315 4.4 p-10 44.08 57.91 3.96 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 125.07 1.348 . . . . 0.0 113.638 -177.303 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.16 -23.34 27.45 Favored Glycine 0 N--CA 1.432 -1.601 0 CA-C-N 114.884 -1.053 . . . . 0.0 114.176 178.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -93.16 123.84 36.72 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -177.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . 0.478 ' HG3' ' CB ' ' A' ' 101' ' ' GLU . 25.7 ptp -79.0 116.38 19.27 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-O 121.971 0.891 . . . . 0.0 111.125 -179.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 56.3 t -65.17 -31.37 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.599 -175.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 25.2 p-10 -65.11 -31.15 72.2 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.871 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.478 ' CB ' ' HG3' ' A' ' 98' ' ' MET . 5.1 tp10 -63.8 -51.47 64.62 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 173.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -57.46 -45.57 84.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.9 -177.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 94.2 mt -61.66 -41.15 97.13 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.747 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 96.7 t -70.66 -43.18 77.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.749 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 -67.29 -26.63 66.63 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 86.7 mm-40 -93.65 -4.23 51.04 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 120.829 0.347 . . . . 0.0 111.196 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.463 ' O ' ' HB2' ' B' ' 151' ' ' ASN . . . 66.35 44.13 91.21 Favored Glycine 0 C--O 1.215 -1.082 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.741 -179.051 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 90.9 mt -113.16 7.85 18.05 Favored 'General case' 0 C--N 1.297 -1.682 0 CA-C-O 121.511 0.672 . . . . 0.0 109.779 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.48 ' HB1' HG13 ' A' ' 39' ' ' VAL . . . -159.38 171.04 20.51 Favored 'General case' 0 N--CA 1.427 -1.588 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -179.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.563 ' HG2' ' CH2' ' B' ' 153' ' ' TRP . 95.3 mttt -120.97 161.47 21.55 Favored 'General case' 0 N--CA 1.424 -1.734 0 N-CA-C 104.921 -2.251 . . . . 0.0 104.921 177.045 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.6 p -76.56 150.73 6.09 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.701 0 C-N-CA 118.739 -1.184 . . . . 0.0 109.159 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -86.89 126.89 34.97 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 175.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 15.4 t80 -71.04 107.39 4.09 Favored 'General case' 0 C--N 1.291 -1.944 0 CA-C-N 114.718 -1.128 . . . . 0.0 110.394 -171.044 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.497 HG11 ' HA ' ' B' ' 132' ' ' ASN . 47.7 t -97.0 152.15 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.579 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.138 177.613 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -85.07 133.41 34.23 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 123.414 0.686 . . . . 0.0 111.04 -175.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -95.28 159.05 33.68 Favored Pre-proline 0 C--N 1.305 -1.326 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 176.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -58.35 -36.85 97.17 Favored 'Trans proline' 0 C--O 1.245 0.873 0 C-N-CA 121.945 1.763 . . . . 0.0 111.324 176.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 7.7 t30 71.38 -58.91 0.56 Allowed 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 125.977 1.711 . . . . 0.0 110.188 178.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -106.55 -83.05 0.53 Allowed 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 106.014 -1.847 . . . . 0.0 106.014 175.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -168.61 74.87 0.11 Allowed 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 125.144 1.378 . . . . 0.0 108.874 172.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 . . . . . 0 C--O 1.246 0.893 0 CA-C-N 113.964 -1.471 . . . . 0.0 109.837 -179.481 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.498 -0.986 0 N-CA-C 110.634 -0.987 . . . . 0.0 110.634 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 123' ' ' SER . . . . . 0.443 ' HB3' ' O ' ' B' ' 126' ' ' TYR . 34.7 t -147.85 147.16 29.49 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 179.061 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 124' ' ' VAL . . . . . . . . . . . . . 33.7 m -100.54 -12.99 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.003 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 175.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 125' ' ' ALA . . . . . . . . . . . . . . . -75.27 -48.83 21.44 Favored 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 175.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 126' ' ' TYR . . . . . 0.443 ' O ' ' HB3' ' B' ' 123' ' ' SER . 74.0 t80 -131.34 104.95 7.31 Favored 'General case' 0 N--CA 1.426 -1.631 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 170.64 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 127' ' ' VAL . . . . . . . . . . . . . 21.2 t -72.49 115.41 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.676 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 -179.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -74.17 -28.99 61.56 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.396 -177.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -79.69 126.15 81.02 Favored Pre-proline 0 N--CA 1.432 -1.342 0 CA-C-N 114.889 -1.05 . . . . 0.0 109.012 177.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -59.68 -171.74 0.06 OUTLIER 'Trans proline' 0 C--N 1.358 1.077 0 C-N-CA 123.534 2.823 . . . . 0.0 114.431 -178.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 131' ' ' ASN . . . . . 0.437 ' HB2' ' HG3' ' A' ' 78' ' ' LYS . 6.4 p-10 -99.55 155.99 17.29 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.036 -0.984 . . . . 0.0 109.377 -174.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 132' ' ' ASN . . . . . 0.497 ' HA ' HG11 ' A' ' 114' ' ' VAL . 10.5 p30 179.42 -39.73 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.691 0 C-N-CA 125.555 1.542 . . . . 0.0 107.538 175.575 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 133' ' ' THR . . . . . 0.403 ' HB ' ' OH ' ' A' ' 91' ' ' TYR . 2.9 m 56.64 -73.69 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.226 0 C-N-CA 125.977 1.711 . . . . 0.0 113.245 177.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -138.48 21.38 2.73 Favored 'General case' 0 C--N 1.312 -1.063 0 O-C-N 121.876 -0.515 . . . . 0.0 112.236 177.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 135' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -53.56 -50.47 65.47 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.873 175.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 136' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -48.77 -37.99 20.58 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.621 1.168 . . . . 0.0 112.977 -176.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 95.2 mt -70.41 -50.08 42.24 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 120.974 0.416 . . . . 0.0 110.599 -179.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 138' ' ' LEU . . . . . . . . . . . . . 19.8 mt -69.58 -41.24 76.06 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-O 121.563 0.697 . . . . 0.0 111.361 -178.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 139' ' ' ARG . . . . . 0.475 ' O ' ' HB3' ' B' ' 142' ' ' GLU . 64.4 ttt180 -67.32 -31.91 72.51 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.431 -175.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -78.74 -24.43 44.82 Favored 'General case' 0 N--CA 1.432 -1.326 0 C-N-CA 119.654 -0.819 . . . . 0.0 111.116 176.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 141' ' ' SER . . . . . . . . . . . . . 51.0 m -69.03 -36.97 78.34 Favored 'General case' 0 N--CA 1.434 -1.239 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 171.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 142' ' ' GLU . . . . . 0.646 ' O ' ' HG3' ' B' ' 146' ' ' LYS . 28.1 tt0 -56.62 -49.25 75.53 Favored 'General case' 0 C--O 1.204 -1.324 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.358 174.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -50.81 -45.47 59.4 Favored 'General case' 0 C--O 1.255 1.379 0 CA-C-O 121.44 0.638 . . . . 0.0 111.512 -178.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 144' ' ' GLN . . . . . 0.499 ' O ' ' HG2' ' B' ' 148' ' ' GLU . 29.0 tt0 -67.1 -47.78 70.16 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.241 -0.89 . . . . 0.0 109.586 178.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -60.06 -34.0 72.81 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 123.532 0.733 . . . . 0.0 112.17 -178.255 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 146' ' ' LYS . . . . . 0.646 ' HG3' ' O ' ' B' ' 142' ' ' GLU . 60.2 mttm -55.15 -51.37 66.67 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 175.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 147' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -71.77 -27.42 62.95 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.299 -0.864 . . . . 0.0 112.252 -178.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 148' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' B' ' 144' ' ' GLN . 9.5 mm-40 -73.25 -16.19 61.4 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.931 176.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 149' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt 51.92 55.63 9.0 Favored 'General case' 0 CA--C 1.505 -0.754 0 C-N-CA 125.052 1.341 . . . . 0.0 110.838 -178.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 150' ' ' LEU . . . . . . . . . . . . . 95.0 mt -86.37 114.06 22.85 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.211 -178.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 151' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 107' ' ' GLY . 44.3 m-80 48.23 -87.53 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.314 1.846 . . . . 0.0 114.257 177.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 152' ' ' ILE . . . . . . . . . . . . . 10.7 tt -72.01 -24.89 23.1 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-O 120.932 0.396 . . . . 0.0 110.286 -175.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 153' ' ' TRP . . . . . 0.626 ' CZ2' ' HG3' ' B' ' 142' ' ' GLU . 52.6 m95 -80.64 -10.43 59.73 Favored 'General case' 0 CA--C 1.506 -0.731 0 CA-C-O 121.771 0.796 . . . . 0.0 110.288 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 154' ' ' SER . . . . . . . . . . . . . 22.6 t -87.33 12.82 11.05 Favored 'General case' 0 N--CA 1.419 -1.993 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.001 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 155' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -66.62 -31.24 71.81 Favored 'General case' 0 C--N 1.356 0.871 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 172.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 156' ' ' ASP . . . . . . . . . . . . . 20.9 t70 . . . . . 0 C--O 1.254 1.318 0 C-N-CA 125.007 1.323 . . . . 0.0 113.261 173.266 . . . . . . . . 0 0 . 1 stop_ save_