data_1bwx_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 1bwx _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.566 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 96.1 mt . . . . . 0 N--CA 1.516 2.854 0 CA-C-O 121.365 0.602 . . . . 0.0 110.97 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -142.16 -63.57 0.43 Allowed 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.863 -0.523 . . . . 0.0 110.645 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.2 p -107.96 -88.1 0.48 Allowed 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.76 -0.588 . . . . 0.0 109.726 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -72.22 -27.55 62.6 Favored 'General case' 0 N--CA 1.51 2.559 0 CA-C-N 118.958 0.799 . . . . 0.0 110.406 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.566 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 23.5 mt-10 -71.73 -46.38 58.75 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.446 -0.784 . . . . 0.0 109.068 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -61.59 -57.56 11.56 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 122.028 -0.42 . . . . 0.0 110.791 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.9 p -47.97 -38.44 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.788 0 CA-C-N 117.903 0.32 . . . . 0.0 110.809 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.466 ' HA ' ' HD3' ' A' ' 25' ' ' ARG . 0.4 OUTLIER -63.12 -43.15 99.2 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.564 -0.71 . . . . 0.0 109.252 178.278 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.512 ' CE3' HD23 ' A' ' 24' ' ' LEU . 4.6 t90 -62.96 -43.8 97.8 Favored 'General case' 0 N--CA 1.504 2.268 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.512 HD23 ' CE3' ' A' ' 23' ' ' TRP . 1.2 mm? -65.49 -38.62 90.29 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.989 -0.444 . . . . 0.0 110.093 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.466 ' HD3' ' HA ' ' A' ' 22' ' ' GLU . 22.1 mtp180 -58.55 -43.7 89.38 Favored 'General case' 0 N--CA 1.508 2.445 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 178.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.48 ' HA ' ' HE2' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -66.43 -40.43 89.49 Favored 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.655 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.45 ' HD3' ' HA ' ' A' ' 27' ' ' LYS . 1.5 tppm? -56.02 -36.2 67.71 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 122.243 -0.286 . . . . 0.0 110.741 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.9 mt -60.43 -40.36 90.81 Favored 'General case' 0 N--CA 1.511 2.602 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 178.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -69.92 -37.83 76.06 Favored 'General case' 0 N--CA 1.508 2.434 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 . . . . . 0 N--CA 1.509 2.486 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.357 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.588 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 1.6 tm? . . . . . 0 N--CA 1.499 2.002 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -158.16 -63.55 0.09 Allowed 'General case' 0 N--CA 1.517 2.894 0 O-C-N 121.952 -0.467 . . . . 0.0 110.491 177.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.8 p -143.22 -63.48 0.4 Allowed 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.646 -0.659 . . . . 0.0 109.744 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 3.8 tpt -66.19 -27.08 67.72 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.846 -0.534 . . . . 0.0 109.799 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.588 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 2.2 mp0 -79.63 -32.02 41.65 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.445 ' HB3' ' CD1' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -99.29 32.32 2.78 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.549 -0.72 . . . . 0.0 112.434 -179.644 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 2.3 p -121.95 -54.57 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.136 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 176.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.412 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . 9.5 tp10 -68.34 -35.74 78.22 Favored 'General case' 0 N--CA 1.507 2.415 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 176.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.581 ' CE3' HD23 ' A' ' 24' ' ' LEU . 0.6 OUTLIER -49.88 -50.07 47.18 Favored 'General case' 0 N--CA 1.513 2.72 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 176.493 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.581 HD23 ' CE3' ' A' ' 23' ' ' TRP . 2.5 mm? -76.85 -37.37 55.73 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.421 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.412 ' HB2' ' HA ' ' A' ' 22' ' ' GLU . 0.1 OUTLIER -63.23 -30.81 71.88 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.805 -0.56 . . . . 0.0 110.049 178.183 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.41 44.68 1.09 Allowed 'General case' 0 N--CA 1.5 2.054 0 CA-C-O 122.147 0.975 . . . . 0.0 108.791 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 0.1 OUTLIER -145.42 -56.22 0.31 Allowed 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 179.311 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mt -76.69 -39.06 53.23 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -57.74 -30.71 65.79 Favored 'General case' 0 N--CA 1.514 2.74 0 O-C-N 121.369 -0.832 . . . . 0.0 110.442 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 . . . . . 0 N--CA 1.502 2.17 0 O-C-N 121.836 -0.54 . . . . 0.0 110.098 179.214 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.426 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 36.5 mt . . . . . 0 N--CA 1.499 1.994 0 CA-C-O 122.209 1.004 . . . . 0.0 108.587 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -105.96 -49.3 3.42 Favored 'General case' 0 N--CA 1.506 2.327 0 CA-C-N 115.397 -0.82 . . . . 0.0 108.883 -179.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.28 151.07 22.43 Favored 'General case' 0 N--CA 1.5 2.059 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 178.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 74.69 -65.58 0.34 Allowed 'General case' 0 N--CA 1.518 2.968 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -177.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -59.17 -35.81 74.2 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.789 -0.57 . . . . 0.0 109.789 177.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.488 ' HA ' ' HD1' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -100.0 -29.71 12.39 Favored 'General case' 0 N--CA 1.506 2.342 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -178.617 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.8 p -61.44 -44.02 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.503 0 CA-C-N 119.979 1.263 . . . . 0.0 108.069 178.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.42 -37.29 71.48 Favored 'General case' 0 N--CA 1.506 2.347 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 177.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.488 ' HD1' ' HA ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -60.13 -45.57 92.57 Favored 'General case' 0 N--CA 1.508 2.459 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.226 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -59.76 -28.44 67.4 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.742 -0.599 . . . . 0.0 111.917 178.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.1 -45.49 93.25 Favored 'General case' 0 N--CA 1.513 2.676 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.476 ' HE3' ' HB2' ' A' ' 30' ' ' ASP . 3.9 tptt -68.42 -37.2 80.08 Favored 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.43 ' HB2' ' CZ3' ' A' ' 23' ' ' TRP . 33.0 tttm -56.78 -41.24 77.31 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.905 -0.497 . . . . 0.0 110.6 178.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -71.73 -55.77 7.04 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.581 -0.699 . . . . 0.0 110.105 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -62.58 -19.79 64.06 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 121.378 -0.826 . . . . 0.0 112.289 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.476 ' HB2' ' HE3' ' A' ' 26' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.5 2.025 0 CA-C-N 119.257 0.935 . . . . 0.0 110.362 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.643 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 74.8 mt . . . . . 0 N--CA 1.507 2.395 0 CA-C-O 121.895 0.855 . . . . 0.0 109.651 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -121.23 -62.93 1.38 Allowed 'General case' 0 N--CA 1.503 2.197 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.66 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.9 m -136.43 -67.46 0.51 Allowed 'General case' 0 N--CA 1.506 2.346 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -69.33 -30.44 68.49 Favored 'General case' 0 N--CA 1.509 2.505 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.643 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 1.2 mt-10 -79.43 -41.35 27.8 Favored 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 178.165 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 mtt180 -61.92 -54.91 35.38 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.915 -0.49 . . . . 0.0 111.255 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.3 p -47.33 -39.08 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.021 0 CA-C-N 118.317 0.508 . . . . 0.0 110.714 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -68.89 -43.81 74.53 Favored 'General case' 0 N--CA 1.505 2.325 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 178.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.579 ' CE3' HD23 ' A' ' 24' ' ' LEU . 1.1 t90 -56.31 -46.59 79.78 Favored 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 178.112 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.579 HD23 ' CE3' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -56.59 -42.55 78.9 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 122.109 -0.369 . . . . 0.0 110.095 -179.319 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.7 mtt-85 -59.7 -43.92 93.9 Favored 'General case' 0 N--CA 1.507 2.409 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -41.08 69.92 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.83 -0.544 . . . . 0.0 109.737 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.47 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -63.39 -37.45 87.31 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.975 -0.453 . . . . 0.0 110.548 179.403 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.0 mt -67.35 -44.71 78.37 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -80.2 -6.08 57.21 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.839 -0.538 . . . . 0.0 111.643 179.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.511 2.6 0 CA-C-N 119.357 0.981 . . . . 0.0 109.618 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.717 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 2.9 tp . . . . . 0 N--CA 1.502 2.166 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -129.52 -60.43 1.05 Allowed 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.97 -0.456 . . . . 0.0 110.206 -178.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 27.4 t -131.34 -72.47 0.55 Allowed 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.701 -0.625 . . . . 0.0 109.756 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -27.87 65.51 Favored 'General case' 0 N--CA 1.516 2.831 0 CA-C-N 118.77 0.714 . . . . 0.0 110.653 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.717 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 1.2 mp0 -84.25 -38.18 20.83 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 178.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.472 ' HA ' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.7 -52.73 63.1 Favored 'General case' 0 N--CA 1.504 2.236 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.529 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.3 p -58.36 -38.06 67.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.405 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -60.25 -38.1 82.44 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.841 -0.537 . . . . 0.0 109.701 178.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.509 ' CE3' HD23 ' A' ' 24' ' ' LEU . 4.8 t90 -56.24 -40.92 74.91 Favored 'General case' 0 N--CA 1.51 2.529 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 177.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.509 HD23 ' CE3' ' A' ' 23' ' ' TRP . 2.2 mm? -68.49 -42.12 79.11 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -43.58 90.11 Favored 'General case' 0 N--CA 1.513 2.676 0 O-C-N 121.844 -0.535 . . . . 0.0 109.614 178.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.59 -27.16 68.21 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 122.043 -0.411 . . . . 0.0 110.009 178.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.532 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -84.94 -39.74 17.8 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.702 -0.624 . . . . 0.0 109.789 179.095 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.83 -38.48 79.86 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.666 -0.646 . . . . 0.0 110.599 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -57.35 -25.13 58.94 Favored 'General case' 0 N--CA 1.513 2.72 0 O-C-N 121.854 -0.529 . . . . 0.0 111.558 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 . . . . . 0 N--CA 1.509 2.51 0 CA-C-N 118.85 0.75 . . . . 0.0 109.013 178.837 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.602 ' HA ' ' HG3' ' A' ' 19' ' ' GLU . 1.5 mp . . . . . 0 N--CA 1.496 1.835 0 CA-C-O 121.599 0.714 . . . . 0.0 109.245 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.1 m-80 -82.87 -60.59 2.12 Favored 'General case' 0 N--CA 1.503 2.191 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.511 -178.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 17.1 p -149.66 -74.84 0.16 Allowed 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.195 -0.941 . . . . 0.0 111.301 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 17.7 ptp -62.54 -38.38 89.77 Favored 'General case' 0 N--CA 1.517 2.909 0 CA-C-N 118.866 0.757 . . . . 0.0 110.892 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.602 ' HG3' ' HA ' ' A' ' 15' ' ' LEU . 1.2 pm0 -70.76 -25.08 62.75 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.815 -0.553 . . . . 0.0 110.219 178.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.463 ' HG2' HD22 ' A' ' 24' ' ' LEU . 33.7 ttp85 -84.26 -57.36 3.2 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.531 -0.73 . . . . 0.0 109.694 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.3 p -49.43 -42.2 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.808 -0.558 . . . . 0.0 110.727 179.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.84 -40.2 69.22 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.408 -0.807 . . . . 0.0 109.369 178.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.478 ' CH2' ' HD2' ' A' ' 27' ' ' LYS . 2.2 t90 -52.61 -48.16 66.49 Favored 'General case' 0 N--CA 1.517 2.878 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 176.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.565 ' N ' HD21 ' A' ' 24' ' ' LEU . 3.7 mm? -74.68 -32.75 62.3 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.089 -178.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.7 mtp85 -67.96 -51.94 41.69 Favored 'General case' 0 N--CA 1.51 2.526 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.68 -48.46 63.88 Favored 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.478 ' HD2' ' CH2' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -56.02 -41.89 75.63 Favored 'General case' 0 N--CA 1.512 2.641 0 CA-C-N 118.1 0.409 . . . . 0.0 110.663 179.902 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.0 tt -63.55 -44.54 93.88 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.874 -0.516 . . . . 0.0 109.629 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -95.93 24.41 5.52 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.784 -0.572 . . . . 0.0 111.311 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.502 2.127 0 O-C-N 120.998 -1.064 . . . . 0.0 108.339 178.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.658 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 5.7 mp . . . . . 0 N--CA 1.508 2.432 0 CA-C-O 122.483 1.135 . . . . 0.0 109.737 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -85.69 -52.42 5.8 Favored 'General case' 0 N--CA 1.502 2.129 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.079 -178.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -156.52 -59.05 0.09 Allowed 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.881 -0.512 . . . . 0.0 110.188 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -28.34 69.55 Favored 'General case' 0 N--CA 1.514 2.748 0 O-C-N 122.0 -0.438 . . . . 0.0 111.746 -179.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.658 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 1.5 mp0 -87.62 -48.13 8.14 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.474 -0.766 . . . . 0.0 109.607 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.449 ' HA ' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -72.59 -20.18 61.34 Favored 'General case' 0 N--CA 1.512 2.642 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -179.442 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.7 p -66.72 -40.84 87.0 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.534 0 CA-C-N 119.722 1.146 . . . . 0.0 108.147 177.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.414 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 23.3 mm-40 -74.81 -37.4 62.34 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.449 ' HB3' ' HA ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -61.3 -47.72 84.67 Favored 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 106.946 -1.502 . . . . 0.0 106.946 177.217 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -63.76 -30.56 71.64 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.724 -0.61 . . . . 0.0 111.381 177.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.414 ' HD2' ' HA ' ' A' ' 22' ' ' GLU . 0.2 OUTLIER -56.71 -40.17 75.17 Favored 'General case' 0 N--CA 1.51 2.566 0 CA-C-N 118.895 0.77 . . . . 0.0 109.189 179.295 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 13.1 ttpp -78.88 -41.5 29.66 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.43 ' HE2' ' CH2' ' A' ' 23' ' ' TRP . 25.6 tttm -51.45 -40.7 59.95 Favored 'General case' 0 N--CA 1.515 2.799 0 C-N-CA 122.443 0.297 . . . . 0.0 110.687 178.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.6 mt -58.69 -44.68 90.37 Favored 'General case' 0 N--CA 1.509 2.476 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -70.82 -39.07 73.24 Favored 'General case' 0 N--CA 1.504 2.261 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 178.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 . . . . . 0 N--CA 1.51 2.554 0 O-C-N 121.832 -0.543 . . . . 0.0 109.696 179.462 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.417 ' HB2' ' HB2' ' A' ' 20' ' ' ARG . 24.1 mt . . . . . 0 N--CA 1.496 1.861 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -175.17 115.05 0.15 Allowed 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.255 -0.903 . . . . 0.0 110.955 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 71.6 m 46.12 -102.95 0.07 Allowed 'General case' 0 N--CA 1.52 3.054 0 C-N-CA 123.167 0.587 . . . . 0.0 112.357 177.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.537 ' HA ' ' CG1' ' A' ' 21' ' ' VAL . 50.3 mtp -63.47 -35.63 81.08 Favored 'General case' 0 N--CA 1.516 2.833 0 CA-C-N 119.488 1.04 . . . . 0.0 110.342 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.432 ' O ' ' HB3' ' A' ' 23' ' ' TRP . 1.7 mp0 -67.56 -20.84 65.45 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 178.132 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.465 ' HA ' ' CD1' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -114.15 39.28 2.78 Favored 'General case' 0 N--CA 1.503 2.2 0 CA-C-O 122.113 0.959 . . . . 0.0 110.487 179.238 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.537 ' CG1' ' HA ' ' A' ' 18' ' ' MET . 3.4 p -146.47 -51.26 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.515 2.776 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 176.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -68.04 -26.6 65.95 Favored 'General case' 0 N--CA 1.509 2.48 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 174.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.665 ' CH2' ' HE2' ' A' ' 27' ' ' LYS . 2.8 p-90 -56.09 -37.71 69.72 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 122.087 -0.383 . . . . 0.0 110.241 178.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.582 ' HG ' ' NE1' ' A' ' 23' ' ' TRP . 30.3 mt -77.65 -29.74 51.78 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 122.126 -0.359 . . . . 0.0 110.427 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.5 ttm105 -58.88 -43.49 90.91 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.885 -0.509 . . . . 0.0 110.114 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.06 -43.32 13.2 Favored 'General case' 0 N--CA 1.506 2.357 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 177.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.665 ' HE2' ' CH2' ' A' ' 23' ' ' TRP . 0.1 OUTLIER -52.1 -43.56 63.98 Favored 'General case' 0 N--CA 1.517 2.89 0 O-C-N 122.079 -0.388 . . . . 0.0 110.57 179.362 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.4 tp -69.05 -43.08 75.37 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.556 -0.715 . . . . 0.0 109.724 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 62.4 mm-40 -95.88 28.97 2.86 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.74 -0.6 . . . . 0.0 110.443 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.496 1.874 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 20' ' ' ARG . 56.3 mt . . . . . 0 N--CA 1.497 1.894 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -86.76 69.98 10.34 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 122.051 -0.406 . . . . 0.0 110.673 -178.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 24.6 m 60.64 -79.08 0.02 OUTLIER 'General case' 0 N--CA 1.519 3.008 0 C-N-CA 123.217 0.607 . . . . 0.0 111.783 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 39.0 mmm -64.19 -34.97 79.29 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.552 -0.718 . . . . 0.0 110.107 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.04 -28.67 69.03 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.31 -0.869 . . . . 0.0 109.173 177.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.407 ' HA ' HD12 ' A' ' 15' ' ' LEU . 2.6 ttm-85 -66.37 -63.92 0.97 Allowed 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 178.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.9 p -53.16 -37.97 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 177.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.37 -40.73 85.78 Favored 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.318 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.53 ' CE3' HD23 ' A' ' 24' ' ' LEU . 3.4 t90 -55.35 -39.99 70.71 Favored 'General case' 0 N--CA 1.51 2.568 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.53 HD23 ' CE3' ' A' ' 23' ' ' TRP . 2.0 mm? -67.21 -47.82 69.7 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.72 -40.65 93.09 Favored 'General case' 0 N--CA 1.51 2.532 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.66 -41.24 98.23 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 178.047 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.452 ' HD3' ' HA ' ' A' ' 27' ' ' LYS . 2.0 tppm? -57.87 -42.81 85.32 Favored 'General case' 0 N--CA 1.503 2.213 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 179.245 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -70.34 -41.6 72.98 Favored 'General case' 0 N--CA 1.506 2.354 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -92.87 33.92 1.13 Allowed 'General case' 0 N--CA 1.501 2.124 0 O-C-N 122.04 -0.412 . . . . 0.0 110.231 178.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.505 2.309 0 O-C-N 120.967 -1.083 . . . . 0.0 109.641 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.447 ' HB2' ' HB3' ' A' ' 19' ' ' GLU . 0.9 OUTLIER . . . . . 0 N--CA 1.504 2.24 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.6 m120 61.69 92.87 0.05 Allowed 'General case' 0 N--CA 1.513 2.697 0 C-N-CA 122.852 0.461 . . . . 0.0 110.093 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.0 m 81.16 -48.15 0.26 Allowed 'General case' 0 N--CA 1.521 3.086 0 C-N-CA 123.791 0.836 . . . . 0.0 109.991 -178.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' MET . . . . . 0.564 ' HA ' ' CG1' ' A' ' 21' ' ' VAL . 22.5 mmm -66.6 -20.53 66.02 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.555 -0.716 . . . . 0.0 111.357 179.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.447 ' HB3' ' HB2' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -66.87 -8.68 30.81 Favored 'General case' 0 N--CA 1.514 2.73 0 CA-C-N 119.406 1.003 . . . . 0.0 110.773 177.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -128.48 29.59 5.28 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.354 -0.841 . . . . 0.0 109.851 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.564 ' CG1' ' HA ' ' A' ' 18' ' ' MET . 3.4 p -157.21 -59.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.5 0 O-C-N 120.998 -1.064 . . . . 0.0 108.434 179.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.0 -32.17 61.58 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 107.362 -1.348 . . . . 0.0 107.362 175.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.48 ' CE3' HD23 ' A' ' 24' ' ' LEU . 8.4 t90 -50.72 -43.41 57.92 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 177.124 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.48 HD23 ' CE3' ' A' ' 23' ' ' TRP . 2.9 mm? -62.85 -44.81 95.14 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -178.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.83 -32.78 74.64 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.992 -0.442 . . . . 0.0 110.147 178.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.0 mtmm -75.08 -44.29 48.31 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.81 -42.14 83.64 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 21.0 mt -68.42 -34.44 76.01 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 122.011 -0.43 . . . . 0.0 110.294 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.38 4.96 18.96 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.709 -0.619 . . . . 0.0 112.227 179.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.511 2.585 0 CA-C-N 119.463 1.029 . . . . 0.0 110.498 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.8 p . . . . . 0 N--CA 1.501 2.107 0 CA-C-O 120.77 0.319 . . . . 0.0 110.279 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 47.9 t -122.06 120.07 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.264 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 90.8 p -104.56 144.98 30.95 Favored 'General case' 0 N--CA 1.503 2.207 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.409 ' HB3' ' HB3' ' A' ' 7' ' ' LEU . 5.2 mp0 59.07 37.19 24.36 Favored 'General case' 0 N--CA 1.517 2.875 0 CA-C-O 120.889 0.375 . . . . 0.0 110.789 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.7 tt -61.85 -42.3 94.05 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.525 0 O-C-N 121.189 -0.944 . . . . 0.0 110.242 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -72.81 -34.77 67.09 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.618 -0.676 . . . . 0.0 109.676 178.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.409 ' HB3' ' HB3' ' A' ' 4' ' ' GLU . 2.8 tt -54.24 -49.4 69.59 Favored 'General case' 0 N--CA 1.51 2.547 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 178.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.4 mpp? -67.66 -37.85 82.95 Favored 'General case' 0 N--CA 1.506 2.335 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 63.3 m170 -61.53 -28.27 69.2 Favored 'General case' 0 N--CA 1.515 2.799 0 O-C-N 121.746 -0.596 . . . . 0.0 110.85 178.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -74.36 -37.06 63.61 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.558 -0.714 . . . . 0.0 110.633 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.548 ' HA ' ' HG2' ' A' ' 19' ' ' GLU . 0.7 OUTLIER 33.56 58.63 0.53 Allowed 'General case' 0 N--CA 1.526 3.337 0 C-N-CA 123.964 0.906 . . . . 0.0 112.689 -179.497 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 129.8 -34.36 2.77 Favored Glycine 0 N--CA 1.505 3.235 0 N-CA-C 110.201 -1.16 . . . . 0.0 110.201 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.5 mtmt -77.95 -26.56 48.89 Favored 'General case' 0 N--CA 1.51 2.569 0 CA-C-N 118.055 0.927 . . . . 0.0 111.207 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -94.96 -45.87 7.08 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.436 -0.79 . . . . 0.0 110.542 -179.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.566 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 96.1 mt 57.22 86.6 0.07 Allowed 'General case' 0 N--CA 1.516 2.854 0 CA-C-O 121.365 0.602 . . . . 0.0 110.97 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -142.16 -63.57 0.43 Allowed 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.863 -0.523 . . . . 0.0 110.645 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.2 p -107.96 -88.1 0.48 Allowed 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.76 -0.588 . . . . 0.0 109.726 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -72.22 -27.55 62.6 Favored 'General case' 0 N--CA 1.51 2.559 0 CA-C-N 118.958 0.799 . . . . 0.0 110.406 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.566 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 23.5 mt-10 -71.73 -46.38 58.75 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.446 -0.784 . . . . 0.0 109.068 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -61.59 -57.56 11.56 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 122.028 -0.42 . . . . 0.0 110.791 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.9 p -47.97 -38.44 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.788 0 CA-C-N 117.903 0.32 . . . . 0.0 110.809 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.466 ' HA ' ' HD3' ' A' ' 25' ' ' ARG . 0.4 OUTLIER -63.12 -43.15 99.2 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.564 -0.71 . . . . 0.0 109.252 178.278 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.512 ' CE3' HD23 ' A' ' 24' ' ' LEU . 4.6 t90 -62.96 -43.8 97.8 Favored 'General case' 0 N--CA 1.504 2.268 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.512 HD23 ' CE3' ' A' ' 23' ' ' TRP . 1.2 mm? -65.49 -38.62 90.29 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.989 -0.444 . . . . 0.0 110.093 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.466 ' HD3' ' HA ' ' A' ' 22' ' ' GLU . 22.1 mtp180 -58.55 -43.7 89.38 Favored 'General case' 0 N--CA 1.508 2.445 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 178.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.48 ' HA ' ' HE2' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -66.43 -40.43 89.49 Favored 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.655 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.45 ' HD3' ' HA ' ' A' ' 27' ' ' LYS . 1.5 tppm? -56.02 -36.2 67.71 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 122.243 -0.286 . . . . 0.0 110.741 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.9 mt -60.43 -40.36 90.81 Favored 'General case' 0 N--CA 1.511 2.602 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 178.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -69.92 -37.83 76.06 Favored 'General case' 0 N--CA 1.508 2.434 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -63.25 -49.31 74.62 Favored 'General case' 0 N--CA 1.509 2.486 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 74.0 t -60.57 -40.83 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.662 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 16.0 t60 -55.76 -46.19 77.93 Favored 'General case' 0 N--CA 1.508 2.429 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 178.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -103.51 44.28 1.03 Allowed 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -110.58 -59.13 1.99 Allowed 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.265 -0.897 . . . . 0.0 109.614 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.2 m -127.01 -43.19 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.638 0 O-C-N 122.017 -0.427 . . . . 0.0 110.198 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -142.88 137.72 29.73 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.8 mt -83.66 81.04 8.92 Favored 'General case' 0 N--CA 1.504 2.251 0 CA-C-O 121.522 0.677 . . . . 0.0 110.303 -179.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -107.25 -59.93 0.57 Allowed Glycine 0 N--CA 1.5 2.916 0 N-CA-C 108.77 -1.732 . . . . 0.0 108.77 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.504 2.227 0 CA-C-O 117.834 -1.079 . . . . 0.0 110.178 179.388 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 67.2 m . . . . . 0 N--CA 1.5 2.027 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 6.4 m -93.44 70.52 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.542 0 CA-C-O 121.831 0.824 . . . . 0.0 109.185 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 12.1 p -135.86 -54.84 0.77 Allowed 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.65 -0.656 . . . . 0.0 109.924 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.88 -42.95 13.65 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.886 -0.509 . . . . 0.0 109.989 179.293 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.0 mp 48.1 51.68 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.517 2.912 0 CA-C-O 121.636 0.731 . . . . 0.0 110.739 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.2 -45.06 0.38 Allowed 'General case' 0 N--CA 1.514 2.731 0 O-C-N 121.421 -0.799 . . . . 0.0 110.757 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.77 -41.61 97.93 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.498 -0.751 . . . . 0.0 109.331 178.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 15.6 ttt -62.94 -39.78 95.66 Favored 'General case' 0 N--CA 1.508 2.47 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 63.7 t-80 -62.41 -44.72 95.77 Favored 'General case' 0 N--CA 1.506 2.338 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -103.0 49.08 0.84 Allowed 'General case' 0 N--CA 1.502 2.127 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 tp -99.51 98.63 9.5 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.465 -0.772 . . . . 0.0 109.436 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.639 ' CA ' ' HB2' ' A' ' 16' ' ' ASN . . . -133.82 -62.94 0.07 OUTLIER Glycine 0 N--CA 1.503 3.153 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.0 mptt 73.18 -67.13 0.28 Allowed 'General case' 0 N--CA 1.515 2.793 0 N-CA-C 106.284 -1.747 . . . . 0.0 106.284 -176.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -95.87 -33.68 12.13 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 175.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.588 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 1.6 tm? -162.04 127.01 3.38 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.385 -0.822 . . . . 0.0 112.546 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.639 ' HB2' ' CA ' ' A' ' 12' ' ' GLY . 20.8 t-20 -158.16 -63.55 0.09 Allowed 'General case' 0 N--CA 1.517 2.894 0 O-C-N 121.952 -0.467 . . . . 0.0 110.491 177.132 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.8 p -143.22 -63.48 0.4 Allowed 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.646 -0.659 . . . . 0.0 109.744 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 3.8 tpt -66.19 -27.08 67.72 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.846 -0.534 . . . . 0.0 109.799 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.588 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 2.2 mp0 -79.63 -32.02 41.65 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.445 ' HB3' ' CD1' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -99.29 32.32 2.78 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.549 -0.72 . . . . 0.0 112.434 -179.644 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 2.3 p -121.95 -54.57 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.136 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 176.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.412 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . 9.5 tp10 -68.34 -35.74 78.22 Favored 'General case' 0 N--CA 1.507 2.415 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 176.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.581 ' CE3' HD23 ' A' ' 24' ' ' LEU . 0.6 OUTLIER -49.88 -50.07 47.18 Favored 'General case' 0 N--CA 1.513 2.72 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 176.493 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.581 HD23 ' CE3' ' A' ' 23' ' ' TRP . 2.5 mm? -76.85 -37.37 55.73 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.421 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.412 ' HB2' ' HA ' ' A' ' 22' ' ' GLU . 0.1 OUTLIER -63.23 -30.81 71.88 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.805 -0.56 . . . . 0.0 110.049 178.183 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.41 44.68 1.09 Allowed 'General case' 0 N--CA 1.5 2.054 0 CA-C-O 122.147 0.975 . . . . 0.0 108.791 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 0.1 OUTLIER -145.42 -56.22 0.31 Allowed 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 179.311 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mt -76.69 -39.06 53.23 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -57.74 -30.71 65.79 Favored 'General case' 0 N--CA 1.514 2.74 0 O-C-N 121.369 -0.832 . . . . 0.0 110.442 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -68.72 -43.51 75.8 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.836 -0.54 . . . . 0.0 110.098 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 98.0 t -121.42 -89.11 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.206 0 O-C-N 121.666 -0.647 . . . . 0.0 109.769 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 60.3 t60 43.59 54.98 5.2 Favored 'General case' 0 N--CA 1.52 3.072 0 CA-C-N 118.953 0.797 . . . . 0.0 110.663 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 57.7 60.19 2.91 Favored 'General case' 0 N--CA 1.507 2.42 0 CA-C-O 121.482 0.658 . . . . 0.0 110.068 -179.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 43.6 p90 -65.01 -27.29 68.72 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 121.608 -0.683 . . . . 0.0 110.727 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 8.3 p -66.28 -32.89 60.13 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.458 0 O-C-N 121.614 -0.679 . . . . 0.0 110.657 179.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -140.06 97.64 3.28 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.756 -0.59 . . . . 0.0 109.44 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.3 tt -80.22 122.29 26.67 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.849 -0.532 . . . . 0.0 109.629 -179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -101.17 63.27 0.55 Allowed Glycine 0 N--CA 1.503 3.155 0 N-CA-C 109.899 -1.28 . . . . 0.0 109.899 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.507 2.406 0 CA-C-O 117.729 -1.129 . . . . 0.0 110.059 179.838 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 55.8 m . . . . . 0 N--CA 1.501 2.087 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 24.5 t 74.58 -55.46 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.521 3.097 0 C-N-CA 123.41 0.684 . . . . 0.0 111.256 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.1 p -53.78 -48.49 69.72 Favored 'General case' 0 N--CA 1.514 2.768 0 O-C-N 121.483 -0.761 . . . . 0.0 111.925 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.06 -35.38 80.04 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 121.822 -0.549 . . . . 0.0 111.686 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 7.9 tp -84.28 -21.94 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.394 0 O-C-N 121.397 -0.814 . . . . 0.0 110.507 179.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -63.18 -50.57 69.79 Favored 'General case' 0 N--CA 1.51 2.541 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 178.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.5 pp -68.32 -34.83 76.82 Favored 'General case' 0 N--CA 1.509 2.502 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 177.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.11 -32.38 74.05 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.783 -0.573 . . . . 0.0 109.949 178.211 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -57.69 -35.91 71.25 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.758 -0.589 . . . . 0.0 110.227 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 38.0 m-80 -92.04 51.42 1.81 Allowed 'General case' 0 N--CA 1.507 2.381 0 CA-C-O 121.395 0.617 . . . . 0.0 109.488 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -176.67 -56.07 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.527 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.6 91.18 0.1 Allowed Glycine 0 N--CA 1.499 2.898 0 N-CA-C 108.298 -1.921 . . . . 0.0 108.298 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.74 97.29 0.07 Allowed 'General case' 0 N--CA 1.511 2.578 0 CA-C-N 117.43 0.615 . . . . 0.0 110.521 -178.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 10.2 t-80 48.71 40.42 15.88 Favored 'General case' 0 N--CA 1.509 2.52 0 CA-C-O 121.166 0.508 . . . . 0.0 111.3 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.426 ' HB3' ' HB3' ' A' ' 20' ' ' ARG . 36.5 mt -96.12 72.95 2.93 Favored 'General case' 0 N--CA 1.499 1.994 0 CA-C-O 122.209 1.004 . . . . 0.0 108.587 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -105.96 -49.3 3.42 Favored 'General case' 0 N--CA 1.506 2.327 0 CA-C-N 115.397 -0.82 . . . . 0.0 108.883 -179.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.28 151.07 22.43 Favored 'General case' 0 N--CA 1.5 2.059 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 178.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 74.69 -65.58 0.34 Allowed 'General case' 0 N--CA 1.518 2.968 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -177.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -59.17 -35.81 74.2 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.789 -0.57 . . . . 0.0 109.789 177.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.488 ' HA ' ' HD1' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -100.0 -29.71 12.39 Favored 'General case' 0 N--CA 1.506 2.342 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -178.617 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.8 p -61.44 -44.02 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.503 0 CA-C-N 119.979 1.263 . . . . 0.0 108.069 178.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.42 -37.29 71.48 Favored 'General case' 0 N--CA 1.506 2.347 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 177.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.488 ' HD1' ' HA ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -60.13 -45.57 92.57 Favored 'General case' 0 N--CA 1.508 2.459 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.226 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -59.76 -28.44 67.4 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.742 -0.599 . . . . 0.0 111.917 178.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.1 -45.49 93.25 Favored 'General case' 0 N--CA 1.513 2.676 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.476 ' HE3' ' HB2' ' A' ' 30' ' ' ASP . 3.9 tptt -68.42 -37.2 80.08 Favored 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.43 ' HB2' ' CZ3' ' A' ' 23' ' ' TRP . 33.0 tttm -56.78 -41.24 77.31 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.905 -0.497 . . . . 0.0 110.6 178.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.412 ' O ' ' HB3' ' A' ' 32' ' ' HIS . 2.5 mm? -71.73 -55.77 7.04 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.581 -0.699 . . . . 0.0 110.105 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -62.58 -19.79 64.06 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 121.378 -0.826 . . . . 0.0 112.289 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.476 ' HB2' ' HE3' ' A' ' 26' ' ' LYS . 0.9 OUTLIER -100.6 -59.43 1.7 Allowed 'General case' 0 N--CA 1.5 2.025 0 CA-C-N 119.257 0.935 . . . . 0.0 110.362 -179.731 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 32.9 t -67.47 -52.63 39.64 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.661 0 O-C-N 121.712 -0.618 . . . . 0.0 110.153 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.412 ' HB3' ' O ' ' A' ' 28' ' ' LEU . 49.3 t-80 -69.59 -41.86 75.22 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.79 -0.569 . . . . 0.0 110.394 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -111.01 58.87 0.61 Allowed 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.712 -0.618 . . . . 0.0 110.196 -179.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -83.41 -59.25 2.51 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.32 -0.862 . . . . 0.0 109.234 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.6 p -109.1 -35.94 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.314 0 O-C-N 121.958 -0.464 . . . . 0.0 110.602 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 74.62 -63.44 0.42 Allowed 'General case' 0 N--CA 1.514 2.762 0 C-N-CA 123.051 0.54 . . . . 0.0 110.22 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -138.87 -44.25 0.47 Allowed 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.671 -0.643 . . . . 0.0 110.958 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 80.45 54.43 3.75 Favored Glycine 0 N--CA 1.501 3.012 0 N-CA-C 109.957 -1.257 . . . . 0.0 109.957 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.504 2.267 0 CA-C-O 117.795 -1.097 . . . . 0.0 110.172 -179.843 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.501 2.096 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 28.4 m -71.54 -35.8 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.754 0 O-C-N 121.905 -0.497 . . . . 0.0 110.306 179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.0 t -113.46 177.92 4.46 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.629 -0.669 . . . . 0.0 110.228 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.06 -17.67 58.59 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.618 -0.676 . . . . 0.0 110.802 179.198 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.514 ' HB ' ' HB2' ' A' ' 9' ' ' HIS . 25.5 mm 82.22 -56.6 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.516 2.867 0 CA-C-N 118.657 0.662 . . . . 0.0 109.385 -179.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.4 mm-40 65.13 -66.53 0.14 Allowed 'General case' 0 N--CA 1.517 2.911 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 178.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -66.24 -61.84 1.8 Allowed 'General case' 0 N--CA 1.513 2.688 0 CA-C-N 119.173 0.897 . . . . 0.0 110.037 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.404 ' HB2' ' CG2' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -68.23 -22.81 64.76 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.888 -0.508 . . . . 0.0 110.653 178.957 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.514 ' HB2' ' HB ' ' A' ' 5' ' ' ILE . 14.0 t-160 -77.4 -50.45 12.7 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.508 -0.745 . . . . 0.0 109.506 178.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -122.01 97.88 5.68 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.833 -0.542 . . . . 0.0 109.978 -178.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -132.03 118.42 19.66 Favored 'General case' 0 N--CA 1.51 2.57 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.4 ' HA2' ' HB3' ' A' ' 19' ' ' GLU . . . 54.8 46.11 77.04 Favored Glycine 0 N--CA 1.514 3.842 0 N-CA-C 109.416 -1.474 . . . . 0.0 109.416 -178.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 10.6 ttmt -122.42 -57.18 1.77 Allowed 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.867 -0.784 . . . . 0.0 111.228 -177.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -85.62 -22.58 27.91 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 121.636 -0.665 . . . . 0.0 111.45 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.643 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 74.8 mt 61.54 78.26 0.3 Allowed 'General case' 0 N--CA 1.507 2.395 0 CA-C-O 121.895 0.855 . . . . 0.0 109.651 -179.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -121.23 -62.93 1.38 Allowed 'General case' 0 N--CA 1.503 2.197 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.66 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.9 m -136.43 -67.46 0.51 Allowed 'General case' 0 N--CA 1.506 2.346 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -69.33 -30.44 68.49 Favored 'General case' 0 N--CA 1.509 2.505 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.643 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 1.2 mt-10 -79.43 -41.35 27.8 Favored 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 178.165 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 mtt180 -61.92 -54.91 35.38 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.915 -0.49 . . . . 0.0 111.255 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.3 p -47.33 -39.08 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.021 0 CA-C-N 118.317 0.508 . . . . 0.0 110.714 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -68.89 -43.81 74.53 Favored 'General case' 0 N--CA 1.505 2.325 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 178.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.579 ' CE3' HD23 ' A' ' 24' ' ' LEU . 1.1 t90 -56.31 -46.59 79.78 Favored 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 178.112 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.579 HD23 ' CE3' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -56.59 -42.55 78.9 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 122.109 -0.369 . . . . 0.0 110.095 -179.319 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.7 mtt-85 -59.7 -43.92 93.9 Favored 'General case' 0 N--CA 1.507 2.409 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -41.08 69.92 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.83 -0.544 . . . . 0.0 109.737 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.47 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -63.39 -37.45 87.31 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.975 -0.453 . . . . 0.0 110.548 179.403 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.0 mt -67.35 -44.71 78.37 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -80.2 -6.08 57.21 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.839 -0.538 . . . . 0.0 111.643 179.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.03 -56.29 23.44 Favored 'General case' 0 N--CA 1.511 2.6 0 CA-C-N 119.357 0.981 . . . . 0.0 109.618 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.1 p -71.51 -31.67 43.52 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.416 0 O-C-N 121.916 -0.49 . . . . 0.0 109.853 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -61.04 -49.1 78.77 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.749 -0.595 . . . . 0.0 109.613 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 24.0 m-80 -77.31 -44.39 29.76 Favored 'General case' 0 N--CA 1.503 2.224 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -102.26 84.18 2.44 Favored 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.5 t -85.21 -54.1 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.406 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 68.69 164.15 0.23 Allowed 'General case' 0 N--CA 1.515 2.809 0 CA-C-O 121.443 0.639 . . . . 0.0 111.373 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -133.16 103.39 5.98 Favored 'General case' 0 N--CA 1.502 2.139 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.35 -71.01 2.88 Favored Glycine 0 N--CA 1.503 3.118 0 N-CA-C 108.853 -1.699 . . . . 0.0 108.853 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.12 0 CA-C-O 117.751 -1.118 . . . . 0.0 109.549 179.064 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.9 t . . . . . 0 N--CA 1.501 2.113 0 CA-C-O 120.96 0.409 . . . . 0.0 110.458 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.3 p -90.66 -37.39 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.302 0 O-C-N 121.767 -0.583 . . . . 0.0 109.675 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 12.3 p -134.32 110.21 9.33 Favored 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -140.77 39.11 1.83 Allowed 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.759 -0.588 . . . . 0.0 110.588 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.6 tp -100.87 28.21 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.447 0 O-C-N 121.274 -0.891 . . . . 0.0 110.155 179.031 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 -74.55 -46.58 38.08 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 120.963 -1.086 . . . . 0.0 109.796 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.64 -47.09 85.26 Favored 'General case' 0 N--CA 1.507 2.416 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 179.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -61.86 -42.02 98.55 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.981 -0.45 . . . . 0.0 109.975 179.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.489 ' HA ' ' HD2' ' A' ' 13' ' ' LYS . 6.0 m170 -64.93 -36.06 83.15 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.849 -0.532 . . . . 0.0 110.222 178.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 24.7 m-80 -94.11 45.65 1.15 Allowed 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.7 -0.625 . . . . 0.0 109.681 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -150.96 72.26 1.06 Allowed 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.394 -0.816 . . . . 0.0 108.982 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 66.02 58.34 9.12 Favored Glycine 0 N--CA 1.507 3.395 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 -179.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.489 ' HD2' ' HA ' ' A' ' 9' ' ' HIS . 0.4 OUTLIER -59.73 -47.83 84.1 Favored 'General case' 0 N--CA 1.511 2.61 0 CA-C-N 117.777 0.789 . . . . 0.0 109.66 179.823 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 20.1 t-80 -107.72 48.02 0.87 Allowed 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 177.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.717 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 2.9 tp -164.83 83.08 0.39 Allowed 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -129.52 -60.43 1.05 Allowed 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.97 -0.456 . . . . 0.0 110.206 -178.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 27.4 t -131.34 -72.47 0.55 Allowed 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.701 -0.625 . . . . 0.0 109.756 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -27.87 65.51 Favored 'General case' 0 N--CA 1.516 2.831 0 CA-C-N 118.77 0.714 . . . . 0.0 110.653 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.717 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 1.2 mp0 -84.25 -38.18 20.83 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 178.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.472 ' HA ' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.7 -52.73 63.1 Favored 'General case' 0 N--CA 1.504 2.236 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.529 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.3 p -58.36 -38.06 67.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.405 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -60.25 -38.1 82.44 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.841 -0.537 . . . . 0.0 109.701 178.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.509 ' CE3' HD23 ' A' ' 24' ' ' LEU . 4.8 t90 -56.24 -40.92 74.91 Favored 'General case' 0 N--CA 1.51 2.529 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 177.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.509 HD23 ' CE3' ' A' ' 23' ' ' TRP . 2.2 mm? -68.49 -42.12 79.11 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -43.58 90.11 Favored 'General case' 0 N--CA 1.513 2.676 0 O-C-N 121.844 -0.535 . . . . 0.0 109.614 178.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.59 -27.16 68.21 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 122.043 -0.411 . . . . 0.0 110.009 178.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.532 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -84.94 -39.74 17.8 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.702 -0.624 . . . . 0.0 109.789 179.095 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.83 -38.48 79.86 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.666 -0.646 . . . . 0.0 110.599 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -57.35 -25.13 58.94 Favored 'General case' 0 N--CA 1.513 2.72 0 O-C-N 121.854 -0.529 . . . . 0.0 111.558 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -58.33 -58.42 8.56 Favored 'General case' 0 N--CA 1.509 2.51 0 CA-C-N 118.85 0.75 . . . . 0.0 109.013 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.3 p -73.94 -28.24 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.514 0 O-C-N 122.015 -0.428 . . . . 0.0 110.004 178.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -64.04 -25.36 68.08 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.618 -0.676 . . . . 0.0 110.753 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -88.36 48.84 1.69 Allowed 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.434 -0.791 . . . . 0.0 110.351 179.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -132.2 60.54 1.68 Allowed 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 179.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 40.0 t -123.25 -63.27 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.305 0 O-C-N 121.599 -0.688 . . . . 0.0 109.266 -179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 57.92 38.76 27.03 Favored 'General case' 0 N--CA 1.514 2.73 0 CA-C-O 121.058 0.456 . . . . 0.0 111.415 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.1 pp -165.95 156.81 13.28 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.26 -0.9 . . . . 0.0 110.352 179.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.29 -73.89 1.66 Allowed Glycine 0 N--CA 1.502 3.063 0 N-CA-C 109.392 -1.483 . . . . 0.0 109.392 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.502 2.157 0 CA-C-O 118.694 -0.67 . . . . 0.0 109.829 179.445 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 67.8 m . . . . . 0 N--CA 1.498 1.93 0 CA-C-O 121.449 0.642 . . . . 0.0 109.699 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 2.0 m -143.44 -53.19 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.582 0 O-C-N 121.839 -0.538 . . . . 0.0 109.84 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 7.4 t -162.17 75.15 0.44 Allowed 'General case' 0 N--CA 1.504 2.244 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -111.26 -4.36 14.99 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.708 -0.62 . . . . 0.0 111.622 -179.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.1 mt 73.63 -63.17 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.519 3.01 0 CA-C-N 119.158 0.89 . . . . 0.0 109.685 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -67.35 -36.45 81.44 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.707 -0.62 . . . . 0.0 110.065 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -61.9 -46.6 88.68 Favored 'General case' 0 N--CA 1.506 2.35 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.86 -40.06 91.31 Favored 'General case' 0 N--CA 1.509 2.497 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.117 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -58.72 -44.65 90.45 Favored 'General case' 0 N--CA 1.509 2.5 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 178.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.5 m-80 -98.02 66.98 1.89 Allowed 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.9 tp -153.12 73.98 1.01 Allowed 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.49 -0.756 . . . . 0.0 110.288 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -91.48 73.88 1.62 Allowed Glycine 0 N--CA 1.505 3.247 0 N-CA-C 108.429 -1.868 . . . . 0.0 108.429 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.0 mttp 69.2 -75.68 0.07 Allowed 'General case' 0 N--CA 1.516 2.869 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 -178.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 29.8 p80 -119.66 11.55 12.02 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.803 -0.561 . . . . 0.0 110.308 177.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.602 ' HA ' ' HG3' ' A' ' 19' ' ' GLU . 1.5 mp -94.5 89.87 5.99 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.307 -0.871 . . . . 0.0 109.245 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.1 m-80 -82.87 -60.59 2.12 Favored 'General case' 0 N--CA 1.503 2.191 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.511 -178.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 17.1 p -149.66 -74.84 0.16 Allowed 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.195 -0.941 . . . . 0.0 111.301 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 17.7 ptp -62.54 -38.38 89.77 Favored 'General case' 0 N--CA 1.517 2.909 0 CA-C-N 118.866 0.757 . . . . 0.0 110.892 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.602 ' HG3' ' HA ' ' A' ' 15' ' ' LEU . 1.2 pm0 -70.76 -25.08 62.75 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.815 -0.553 . . . . 0.0 110.219 178.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.463 ' HG2' HD22 ' A' ' 24' ' ' LEU . 33.7 ttp85 -84.26 -57.36 3.2 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.531 -0.73 . . . . 0.0 109.694 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.3 p -49.43 -42.2 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.808 -0.558 . . . . 0.0 110.727 179.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.84 -40.2 69.22 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.408 -0.807 . . . . 0.0 109.369 178.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.478 ' CH2' ' HD2' ' A' ' 27' ' ' LYS . 2.2 t90 -52.61 -48.16 66.49 Favored 'General case' 0 N--CA 1.517 2.878 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 176.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.565 ' N ' HD21 ' A' ' 24' ' ' LEU . 3.7 mm? -74.68 -32.75 62.3 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.089 -178.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.7 mtp85 -67.96 -51.94 41.69 Favored 'General case' 0 N--CA 1.51 2.526 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.68 -48.46 63.88 Favored 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.478 ' HD2' ' CH2' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -56.02 -41.89 75.63 Favored 'General case' 0 N--CA 1.512 2.641 0 CA-C-N 118.1 0.409 . . . . 0.0 110.663 179.902 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.0 tt -63.55 -44.54 93.88 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.874 -0.516 . . . . 0.0 109.629 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -95.93 24.41 5.52 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.784 -0.572 . . . . 0.0 111.311 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.65 -51.12 7.55 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 120.998 -1.064 . . . . 0.0 108.339 178.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.463 HG23 ' HA3' ' A' ' 38' ' ' GLY . 3.4 t -99.58 -35.12 4.56 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.322 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 178.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 -61.76 -48.32 81.22 Favored 'General case' 0 N--CA 1.512 2.636 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -91.97 56.4 2.88 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 177.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -164.26 -57.7 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -179.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.2 p -136.26 -53.69 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.205 0 O-C-N 122.036 -0.415 . . . . 0.0 110.303 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -179.58 -65.86 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.693 0 CA-C-N 119.225 0.921 . . . . 0.0 110.741 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -162.49 139.58 8.02 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.624 -0.673 . . . . 0.0 110.044 -178.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.463 ' HA3' HG23 ' A' ' 31' ' ' VAL . . . -125.28 63.14 0.58 Allowed Glycine 0 N--CA 1.505 3.246 0 N-CA-C 109.664 -1.375 . . . . 0.0 109.664 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.506 2.33 0 CA-C-O 117.732 -1.127 . . . . 0.0 110.043 -179.89 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 75.4 m . . . . . 0 N--CA 1.498 1.973 0 CA-C-O 121.393 0.616 . . . . 0.0 109.569 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.1 p -164.53 -47.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.511 0 O-C-N 121.86 -0.525 . . . . 0.0 110.255 -179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.1 t -144.07 74.72 1.43 Allowed 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -126.21 37.67 4.28 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.764 -0.585 . . . . 0.0 109.715 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.488 HG13 ' HB2' ' A' ' 9' ' ' HIS . 18.7 pt -73.5 -40.33 55.5 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.575 0 O-C-N 121.342 -0.849 . . . . 0.0 109.66 179.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 61.74 -77.43 0.03 OUTLIER 'General case' 0 N--CA 1.517 2.875 0 C-N-CA 123.167 0.587 . . . . 0.0 112.191 178.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.1 tt -59.68 -54.36 47.3 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.635 -0.666 . . . . 0.0 110.285 -179.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.475 ' HB2' ' HB ' ' A' ' 5' ' ' ILE . 6.0 mtt -59.57 -35.43 74.26 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 122.008 -0.433 . . . . 0.0 110.501 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.488 ' HB2' HG13 ' A' ' 5' ' ' ILE . 38.2 t-80 -65.67 -47.8 74.24 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.702 -0.624 . . . . 0.0 109.526 178.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -87.7 14.34 8.72 Favored 'General case' 0 N--CA 1.507 2.404 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.0 tp -97.82 52.84 1.09 Allowed 'General case' 0 N--CA 1.506 2.344 0 O-C-N 120.718 -1.239 . . . . 0.0 109.669 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 76.68 -82.86 1.05 Allowed Glycine 0 N--CA 1.502 3.039 0 N-CA-C 109.156 -1.578 . . . . 0.0 109.156 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.42 -95.35 0.05 Allowed 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 123.021 0.528 . . . . 0.0 110.962 179.129 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.69 10.54 2.24 Favored 'General case' 0 N--CA 1.508 2.434 0 CA-C-N 119.426 1.012 . . . . 0.0 111.784 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.658 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 5.7 mp 52.86 64.86 1.7 Allowed 'General case' 0 N--CA 1.508 2.432 0 CA-C-O 122.483 1.135 . . . . 0.0 109.737 -179.346 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -85.69 -52.42 5.8 Favored 'General case' 0 N--CA 1.502 2.129 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.079 -178.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -156.52 -59.05 0.09 Allowed 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.881 -0.512 . . . . 0.0 110.188 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -28.34 69.55 Favored 'General case' 0 N--CA 1.514 2.748 0 O-C-N 122.0 -0.438 . . . . 0.0 111.746 -179.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.658 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 1.5 mp0 -87.62 -48.13 8.14 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.474 -0.766 . . . . 0.0 109.607 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.449 ' HA ' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -72.59 -20.18 61.34 Favored 'General case' 0 N--CA 1.512 2.642 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -179.442 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.7 p -66.72 -40.84 87.0 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.534 0 CA-C-N 119.722 1.146 . . . . 0.0 108.147 177.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.414 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 23.3 mm-40 -74.81 -37.4 62.34 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.449 ' HB3' ' HA ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -61.3 -47.72 84.67 Favored 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 106.946 -1.502 . . . . 0.0 106.946 177.217 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -63.76 -30.56 71.64 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.724 -0.61 . . . . 0.0 111.381 177.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.414 ' HD2' ' HA ' ' A' ' 22' ' ' GLU . 0.2 OUTLIER -56.71 -40.17 75.17 Favored 'General case' 0 N--CA 1.51 2.566 0 CA-C-N 118.895 0.77 . . . . 0.0 109.189 179.295 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 13.1 ttpp -78.88 -41.5 29.66 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.43 ' HE2' ' CH2' ' A' ' 23' ' ' TRP . 25.6 tttm -51.45 -40.7 59.95 Favored 'General case' 0 N--CA 1.515 2.799 0 C-N-CA 122.443 0.297 . . . . 0.0 110.687 178.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.6 mt -58.69 -44.68 90.37 Favored 'General case' 0 N--CA 1.509 2.476 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -70.82 -39.07 73.24 Favored 'General case' 0 N--CA 1.504 2.261 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 178.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -59.77 -50.6 73.2 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.832 -0.543 . . . . 0.0 109.696 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 86.1 t -64.8 -36.3 77.27 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.541 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -60.71 -46.15 91.49 Favored 'General case' 0 N--CA 1.508 2.446 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -68.63 -37.27 79.58 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -74.74 -177.61 3.3 Favored 'General case' 0 N--CA 1.504 2.271 0 CA-C-O 121.208 0.528 . . . . 0.0 110.06 178.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 11.9 t -104.53 53.86 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.224 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 62.27 49.51 4.26 Favored 'General case' 0 N--CA 1.51 2.527 0 CA-C-O 121.561 0.696 . . . . 0.0 109.446 -178.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.4 mt -106.98 141.55 38.02 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.62 -0.675 . . . . 0.0 110.137 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.2 -60.98 0.32 Allowed Glycine 0 N--CA 1.503 3.155 0 N-CA-C 109.684 -1.366 . . . . 0.0 109.684 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.503 2.187 0 CA-C-O 117.611 -1.185 . . . . 0.0 109.804 179.533 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 38.6 m . . . . . 0 N--CA 1.5 2.049 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.9 p -84.3 -38.55 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.673 -0.642 . . . . 0.0 110.077 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 28.6 t -90.86 -62.16 1.51 Allowed 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 175.67 -50.72 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.365 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 5.6 tt 45.06 31.75 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.522 3.173 0 C-N-CA 123.637 0.775 . . . . 0.0 112.856 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -103.22 -45.1 5.0 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 121.015 -1.053 . . . . 0.0 108.99 178.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 79.1 mt -63.2 -29.82 71.08 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 122.077 -0.39 . . . . 0.0 110.267 178.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 44.6 mmm -58.04 -42.95 86.49 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.665 -0.647 . . . . 0.0 109.504 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 24.8 t60 -76.42 -49.05 17.7 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -134.4 101.4 4.98 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.402 ' CD2' ' HD2' ' A' ' 20' ' ' ARG . 1.9 tp -80.73 77.9 7.54 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 70.14 44.3 60.94 Favored Glycine 0 N--CA 1.504 3.219 0 N-CA-C 109.097 -1.601 . . . . 0.0 109.097 -178.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 67.73 -80.32 0.03 OUTLIER 'General case' 0 N--CA 1.511 2.587 0 CA-C-N 117.391 0.595 . . . . 0.0 109.801 -178.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 -163.79 100.74 0.89 Allowed 'General case' 0 N--CA 1.503 2.213 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.417 ' HB2' ' HB2' ' A' ' 20' ' ' ARG . 24.1 mt -134.5 -157.41 0.8 Allowed 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 -179.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -175.17 115.05 0.15 Allowed 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.255 -0.903 . . . . 0.0 110.955 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 71.6 m 46.12 -102.95 0.07 Allowed 'General case' 0 N--CA 1.52 3.054 0 C-N-CA 123.167 0.587 . . . . 0.0 112.357 177.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.537 ' HA ' ' CG1' ' A' ' 21' ' ' VAL . 50.3 mtp -63.47 -35.63 81.08 Favored 'General case' 0 N--CA 1.516 2.833 0 CA-C-N 119.488 1.04 . . . . 0.0 110.342 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.432 ' O ' ' HB3' ' A' ' 23' ' ' TRP . 1.7 mp0 -67.56 -20.84 65.45 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 178.132 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.465 ' HA ' ' CD1' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -114.15 39.28 2.78 Favored 'General case' 0 N--CA 1.503 2.2 0 CA-C-O 122.113 0.959 . . . . 0.0 110.487 179.238 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.537 ' CG1' ' HA ' ' A' ' 18' ' ' MET . 3.4 p -146.47 -51.26 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.515 2.776 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 176.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -68.04 -26.6 65.95 Favored 'General case' 0 N--CA 1.509 2.48 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 174.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.665 ' CH2' ' HE2' ' A' ' 27' ' ' LYS . 2.8 p-90 -56.09 -37.71 69.72 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 122.087 -0.383 . . . . 0.0 110.241 178.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.582 ' HG ' ' NE1' ' A' ' 23' ' ' TRP . 30.3 mt -77.65 -29.74 51.78 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 122.126 -0.359 . . . . 0.0 110.427 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.5 ttm105 -58.88 -43.49 90.91 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.885 -0.509 . . . . 0.0 110.114 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.06 -43.32 13.2 Favored 'General case' 0 N--CA 1.506 2.357 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 177.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.665 ' HE2' ' CH2' ' A' ' 23' ' ' TRP . 0.1 OUTLIER -52.1 -43.56 63.98 Favored 'General case' 0 N--CA 1.517 2.89 0 O-C-N 122.079 -0.388 . . . . 0.0 110.57 179.362 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.4 tp -69.05 -43.08 75.37 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.556 -0.715 . . . . 0.0 109.724 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 62.4 mm-40 -95.88 28.97 2.86 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.74 -0.6 . . . . 0.0 110.443 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.78 -57.2 3.42 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 178.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.1 t -63.16 -35.74 73.11 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.543 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.0 m-70 -62.74 -43.56 98.48 Favored 'General case' 0 N--CA 1.507 2.419 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 178.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -110.77 65.68 0.62 Allowed 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -133.46 130.29 38.4 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.552 -0.717 . . . . 0.0 109.862 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 78.5 t -132.16 -63.88 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -159.56 -59.94 0.07 Allowed 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.843 -0.535 . . . . 0.0 110.009 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 tt -90.69 112.55 24.35 Favored 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -115.36 59.62 0.42 Allowed Glycine 0 N--CA 1.503 3.102 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.505 2.294 0 CA-C-O 117.735 -1.126 . . . . 0.0 110.098 -179.771 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 30.7 p . . . . . 0 N--CA 1.503 2.206 0 CA-C-O 120.849 0.357 . . . . 0.0 110.221 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 3.0 m -128.02 100.44 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.417 0 CA-C-O 121.362 0.601 . . . . 0.0 109.449 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.7 t -104.58 93.21 4.65 Favored 'General case' 0 N--CA 1.502 2.16 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -171.43 -34.12 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.776 0 O-C-N 121.973 -0.454 . . . . 0.0 111.971 -179.475 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.7 mt 81.61 -49.2 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.526 3.33 0 CA-C-N 118.946 0.793 . . . . 0.0 110.65 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -27.4 63.74 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 121.533 -0.729 . . . . 0.0 111.8 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.01 -48.84 72.82 Favored 'General case' 0 N--CA 1.51 2.569 0 CA-C-N 118.74 0.7 . . . . 0.0 109.59 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.66 -41.37 38.46 Favored 'General case' 0 N--CA 1.502 2.129 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 177.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.409 ' C ' ' HB3' ' A' ' 13' ' ' LYS . 17.6 t-80 -84.46 70.76 10.73 Favored 'General case' 0 N--CA 1.5 2.072 0 CA-C-O 121.692 0.758 . . . . 0.0 109.627 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -159.44 -60.3 0.07 Allowed 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.511 -0.743 . . . . 0.0 109.609 179.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 13.8 tp -73.57 -49.61 25.46 Favored 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -117.44 38.23 3.04 Favored Glycine 0 N--CA 1.501 2.992 0 N-CA-C 109.986 -1.246 . . . . 0.0 109.986 178.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.409 ' HB3' ' C ' ' A' ' 9' ' ' HIS . 7.8 pttm -65.88 -43.09 89.33 Favored 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 118.037 0.919 . . . . 0.0 110.122 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 48.8 m-70 -126.93 35.57 4.58 Favored 'General case' 0 N--CA 1.505 2.288 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 20' ' ' ARG . 56.3 mt -141.57 120.05 12.39 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -86.76 69.98 10.34 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 122.051 -0.406 . . . . 0.0 110.673 -178.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 24.6 m 60.64 -79.08 0.02 OUTLIER 'General case' 0 N--CA 1.519 3.008 0 C-N-CA 123.217 0.607 . . . . 0.0 111.783 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 39.0 mmm -64.19 -34.97 79.29 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.552 -0.718 . . . . 0.0 110.107 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.04 -28.67 69.03 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.31 -0.869 . . . . 0.0 109.173 177.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.407 ' HA ' HD12 ' A' ' 15' ' ' LEU . 2.6 ttm-85 -66.37 -63.92 0.97 Allowed 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 178.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.9 p -53.16 -37.97 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 177.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.37 -40.73 85.78 Favored 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.318 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.53 ' CE3' HD23 ' A' ' 24' ' ' LEU . 3.4 t90 -55.35 -39.99 70.71 Favored 'General case' 0 N--CA 1.51 2.568 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.53 HD23 ' CE3' ' A' ' 23' ' ' TRP . 2.0 mm? -67.21 -47.82 69.7 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.72 -40.65 93.09 Favored 'General case' 0 N--CA 1.51 2.532 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.66 -41.24 98.23 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 178.047 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.452 ' HD3' ' HA ' ' A' ' 27' ' ' LYS . 2.0 tppm? -57.87 -42.81 85.32 Favored 'General case' 0 N--CA 1.503 2.213 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 179.245 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -70.34 -41.6 72.98 Favored 'General case' 0 N--CA 1.506 2.354 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -92.87 33.92 1.13 Allowed 'General case' 0 N--CA 1.501 2.124 0 O-C-N 122.04 -0.412 . . . . 0.0 110.231 178.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -94.68 -51.47 4.71 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 120.967 -1.083 . . . . 0.0 109.641 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.8 t -141.72 63.65 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.406 0 CA-C-O 121.807 0.813 . . . . 0.0 108.913 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -85.58 62.44 7.47 Favored 'General case' 0 N--CA 1.509 2.512 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 178.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 59.3 m-80 77.1 -58.8 0.49 Allowed 'General case' 0 N--CA 1.515 2.787 0 C-N-CA 123.567 0.747 . . . . 0.0 109.419 -177.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 63.13 4.15 1.5 Allowed 'General case' 0 N--CA 1.514 2.741 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 2.0 m -157.39 43.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.514 2.747 0 O-C-N 121.083 -1.01 . . . . 0.0 109.127 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -138.33 77.05 1.61 Allowed 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.295 -0.878 . . . . 0.0 109.851 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.7 mp 63.25 -83.01 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.778 0 C-N-CA 123.017 0.527 . . . . 0.0 110.819 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.32 -47.93 1.1 Allowed Glycine 0 N--CA 1.503 3.115 0 N-CA-C 110.04 -1.224 . . . . 0.0 110.04 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.504 2.248 0 CA-C-N 117.884 0.842 . . . . 0.0 110.085 -179.787 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.7 t . . . . . 0 N--CA 1.5 2.074 0 CA-C-O 120.822 0.344 . . . . 0.0 110.256 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 17.9 m -127.12 143.51 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 179.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.2 t 69.74 166.6 0.28 Allowed 'General case' 0 N--CA 1.515 2.786 0 CA-C-O 121.421 0.629 . . . . 0.0 110.937 -179.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -110.09 32.36 5.18 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.626 -0.671 . . . . 0.0 109.989 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 5.6 tp -60.8 -32.44 52.06 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.6 0 O-C-N 121.329 -0.857 . . . . 0.0 110.078 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -68.39 -45.96 71.31 Favored 'General case' 0 N--CA 1.51 2.528 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 178.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -67.4 -36.48 81.37 Favored 'General case' 0 N--CA 1.508 2.43 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 178.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.441 ' HB3' ' HA ' ' A' ' 16' ' ' ASN . 48.6 mtt -71.11 -31.99 68.47 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 122.037 -0.414 . . . . 0.0 110.575 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 -78.6 -45.35 21.86 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 179.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -66.62 -56.62 9.85 Favored 'General case' 0 N--CA 1.505 2.32 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.46 114.54 27.55 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 178.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 110.86 -55.55 0.5 Allowed Glycine 0 N--CA 1.501 3.028 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 70.89 -71.92 0.12 Allowed 'General case' 0 N--CA 1.513 2.691 0 C-N-CA 123.161 0.584 . . . . 0.0 110.529 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -114.76 52.23 0.86 Allowed 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.503 -0.748 . . . . 0.0 109.126 179.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.447 ' HB2' ' HB3' ' A' ' 19' ' ' GLU . 0.9 OUTLIER -132.5 -61.36 0.86 Allowed 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.525 -0.734 . . . . 0.0 109.586 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.441 ' HA ' ' HB3' ' A' ' 8' ' ' MET . 17.6 m120 61.69 92.87 0.05 Allowed 'General case' 0 N--CA 1.513 2.697 0 C-N-CA 122.852 0.461 . . . . 0.0 110.093 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.0 m 81.16 -48.15 0.26 Allowed 'General case' 0 N--CA 1.521 3.086 0 C-N-CA 123.791 0.836 . . . . 0.0 109.991 -178.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.564 ' HA ' ' CG1' ' A' ' 21' ' ' VAL . 22.5 mmm -66.6 -20.53 66.02 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.555 -0.716 . . . . 0.0 111.357 179.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.447 ' HB3' ' HB2' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -66.87 -8.68 30.81 Favored 'General case' 0 N--CA 1.514 2.73 0 CA-C-N 119.406 1.003 . . . . 0.0 110.773 177.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -128.48 29.59 5.28 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.354 -0.841 . . . . 0.0 109.851 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.564 ' CG1' ' HA ' ' A' ' 18' ' ' MET . 3.4 p -157.21 -59.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.5 0 O-C-N 120.998 -1.064 . . . . 0.0 108.434 179.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.0 -32.17 61.58 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 107.362 -1.348 . . . . 0.0 107.362 175.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.48 ' CE3' HD23 ' A' ' 24' ' ' LEU . 8.4 t90 -50.72 -43.41 57.92 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 177.124 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.48 HD23 ' CE3' ' A' ' 23' ' ' TRP . 2.9 mm? -62.85 -44.81 95.14 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -178.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.83 -32.78 74.64 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.992 -0.442 . . . . 0.0 110.147 178.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.0 mtmm -75.08 -44.29 48.31 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.81 -42.14 83.64 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 21.0 mt -68.42 -34.44 76.01 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 122.011 -0.43 . . . . 0.0 110.294 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.38 4.96 18.96 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.709 -0.619 . . . . 0.0 112.227 179.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.25 -54.94 41.15 Favored 'General case' 0 N--CA 1.511 2.585 0 CA-C-N 119.463 1.029 . . . . 0.0 110.498 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 47.1 t -67.61 -39.97 83.27 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.715 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 38.1 t-80 -60.29 -35.87 76.56 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 122.003 -0.435 . . . . 0.0 110.61 179.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -90.33 -23.5 21.12 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 121.621 -0.674 . . . . 0.0 111.195 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -77.84 86.06 4.1 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.47 -0.769 . . . . 0.0 111.078 -178.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.0 t 50.15 51.1 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.517 2.918 0 CA-C-O 121.37 0.605 . . . . 0.0 110.98 178.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -135.72 -58.05 0.77 Allowed 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.324 -0.86 . . . . 0.0 109.484 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.7 tt -149.91 -62.33 0.21 Allowed 'General case' 0 N--CA 1.503 2.212 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 96.97 82.87 1.66 Allowed Glycine 0 N--CA 1.5 2.943 0 N-CA-C 110.229 -1.148 . . . . 0.0 110.229 179.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.511 2.576 0 CA-C-O 118.716 -0.659 . . . . 0.0 109.864 179.374 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.604 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 96.1 mt . . . . . 0 N--CA 1.516 2.854 0 CA-C-O 121.365 0.602 . . . . 0.0 110.97 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -142.16 -63.57 0.43 Allowed 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.863 -0.523 . . . . 0.0 110.645 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.2 p -107.96 -88.1 0.48 Allowed 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.76 -0.588 . . . . 0.0 109.726 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -72.22 -27.55 62.6 Favored 'General case' 0 N--CA 1.51 2.559 0 CA-C-N 118.958 0.799 . . . . 0.0 110.406 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.604 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 23.5 mt-10 -71.73 -46.38 58.75 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.446 -0.784 . . . . 0.0 109.068 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -61.59 -57.56 11.56 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 122.028 -0.42 . . . . 0.0 110.791 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.9 p -47.97 -38.44 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.788 0 CA-C-N 117.903 0.32 . . . . 0.0 110.809 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.476 ' HA ' ' HD3' ' A' ' 25' ' ' ARG . 0.4 OUTLIER -63.12 -43.15 99.2 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.564 -0.71 . . . . 0.0 109.252 178.278 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.46 ' CE3' HD22 ' A' ' 24' ' ' LEU . 4.6 t90 -62.96 -43.8 97.8 Favored 'General case' 0 N--CA 1.504 2.268 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.618 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.46 HD22 ' CE3' ' A' ' 23' ' ' TRP . 1.2 mm? -65.49 -38.62 90.29 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.989 -0.444 . . . . 0.0 110.093 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.674 ' HA ' HD12 ' A' ' 28' ' ' LEU . 22.1 mtp180 -58.55 -43.7 89.38 Favored 'General case' 0 N--CA 1.508 2.445 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 178.83 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.508 ' HA ' ' HE2' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -66.43 -40.43 89.49 Favored 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.655 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.456 ' HD3' ' HA ' ' A' ' 27' ' ' LYS . 1.5 tppm? -56.02 -36.2 67.71 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 122.243 -0.286 . . . . 0.0 110.741 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.674 HD12 ' HA ' ' A' ' 25' ' ' ARG . 5.9 mt -60.43 -40.36 90.81 Favored 'General case' 0 N--CA 1.511 2.602 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 178.224 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -69.92 -37.83 76.06 Favored 'General case' 0 N--CA 1.508 2.434 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 . . . . . 0 N--CA 1.509 2.486 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.357 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.742 HD22 ' HB2' ' A' ' 19' ' ' GLU . 1.6 tm? . . . . . 0 N--CA 1.499 2.002 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.652 ' N ' HD13 ' A' ' 15' ' ' LEU . 20.8 t-20 -158.16 -63.55 0.09 Allowed 'General case' 0 N--CA 1.517 2.894 0 O-C-N 121.952 -0.467 . . . . 0.0 110.491 177.132 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.8 p -143.22 -63.48 0.4 Allowed 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.646 -0.659 . . . . 0.0 109.744 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 3.8 tpt -66.19 -27.08 67.72 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.846 -0.534 . . . . 0.0 109.799 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.742 ' HB2' HD22 ' A' ' 15' ' ' LEU . 2.2 mp0 -79.63 -32.02 41.65 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.171 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.708 ' HB3' HD11 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -99.29 32.32 2.78 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.549 -0.72 . . . . 0.0 112.434 -179.644 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 2.3 p -121.95 -54.57 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.136 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 176.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.41 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . 9.5 tp10 -68.34 -35.74 78.22 Favored 'General case' 0 N--CA 1.507 2.415 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 176.164 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.77 ' CE3' HD13 ' A' ' 24' ' ' LEU . 0.6 OUTLIER -49.88 -50.07 47.18 Favored 'General case' 0 N--CA 1.513 2.72 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 176.493 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.77 HD13 ' CE3' ' A' ' 23' ' ' TRP . 2.5 mm? -76.85 -37.37 55.73 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.421 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.41 ' HB2' ' HA ' ' A' ' 22' ' ' GLU . 0.1 OUTLIER -63.23 -30.81 71.88 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.805 -0.56 . . . . 0.0 110.049 178.183 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.41 44.68 1.09 Allowed 'General case' 0 N--CA 1.5 2.054 0 CA-C-O 122.147 0.975 . . . . 0.0 108.791 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.458 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 0.1 OUTLIER -145.42 -56.22 0.31 Allowed 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 179.311 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mt -76.69 -39.06 53.23 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -57.74 -30.71 65.79 Favored 'General case' 0 N--CA 1.514 2.74 0 O-C-N 121.369 -0.832 . . . . 0.0 110.442 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 . . . . . 0 N--CA 1.502 2.17 0 O-C-N 121.836 -0.54 . . . . 0.0 110.098 179.214 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.68 HD23 ' HB3' ' A' ' 19' ' ' GLU . 36.5 mt . . . . . 0 N--CA 1.499 1.994 0 CA-C-O 122.209 1.004 . . . . 0.0 108.587 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -105.96 -49.3 3.42 Favored 'General case' 0 N--CA 1.506 2.327 0 CA-C-N 115.397 -0.82 . . . . 0.0 108.883 -179.458 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.28 151.07 22.43 Favored 'General case' 0 N--CA 1.5 2.059 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 178.685 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.493 ' CA ' HG12 ' A' ' 21' ' ' VAL . 0.2 OUTLIER 74.69 -65.58 0.34 Allowed 'General case' 0 N--CA 1.518 2.968 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -177.852 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.68 ' HB3' HD23 ' A' ' 15' ' ' LEU . 16.5 mt-10 -59.17 -35.81 74.2 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.789 -0.57 . . . . 0.0 109.789 177.124 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.485 ' HA ' ' HD1' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -100.0 -29.71 12.39 Favored 'General case' 0 N--CA 1.506 2.342 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -178.617 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.493 HG12 ' CA ' ' A' ' 18' ' ' MET . 7.8 p -61.44 -44.02 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.503 0 CA-C-N 119.979 1.263 . . . . 0.0 108.069 178.138 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.419 ' N ' HG13 ' A' ' 21' ' ' VAL . 0.7 OUTLIER -71.42 -37.29 71.48 Favored 'General case' 0 N--CA 1.506 2.347 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 177.403 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.485 ' HD1' ' HA ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -60.13 -45.57 92.57 Favored 'General case' 0 N--CA 1.508 2.459 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.226 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.428 HD13 ' HD2' ' A' ' 27' ' ' LYS . 2.6 mm? -59.76 -28.44 67.4 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.742 -0.599 . . . . 0.0 111.917 178.105 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.1 -45.49 93.25 Favored 'General case' 0 N--CA 1.513 2.676 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.467 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.498 ' HE3' ' HB2' ' A' ' 30' ' ' ASP . 3.9 tptt -68.42 -37.2 80.08 Favored 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.071 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.428 ' HD2' HD13 ' A' ' 24' ' ' LEU . 33.0 tttm -56.78 -41.24 77.31 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.905 -0.497 . . . . 0.0 110.6 178.604 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 28' ' ' LEU . 2.5 mm? -71.73 -55.77 7.04 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.581 -0.699 . . . . 0.0 110.105 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -62.58 -19.79 64.06 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 121.378 -0.826 . . . . 0.0 112.289 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.498 ' HB2' ' HE3' ' A' ' 26' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.5 2.025 0 CA-C-N 119.257 0.935 . . . . 0.0 110.362 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.667 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 74.8 mt . . . . . 0 N--CA 1.507 2.395 0 CA-C-O 121.895 0.855 . . . . 0.0 109.651 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -121.23 -62.93 1.38 Allowed 'General case' 0 N--CA 1.503 2.197 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.66 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.9 m -136.43 -67.46 0.51 Allowed 'General case' 0 N--CA 1.506 2.346 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -69.33 -30.44 68.49 Favored 'General case' 0 N--CA 1.509 2.505 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.31 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.667 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 1.2 mt-10 -79.43 -41.35 27.8 Favored 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 178.165 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 mtt180 -61.92 -54.91 35.38 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.915 -0.49 . . . . 0.0 111.255 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.3 p -47.33 -39.08 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.021 0 CA-C-N 118.317 0.508 . . . . 0.0 110.714 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -68.89 -43.81 74.53 Favored 'General case' 0 N--CA 1.505 2.325 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 178.005 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.541 ' CE3' HD22 ' A' ' 24' ' ' LEU . 1.1 t90 -56.31 -46.59 79.78 Favored 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 178.112 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.541 HD22 ' CE3' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -56.59 -42.55 78.9 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 122.109 -0.369 . . . . 0.0 110.095 -179.319 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.7 mtt-85 -59.7 -43.92 93.9 Favored 'General case' 0 N--CA 1.507 2.409 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -41.08 69.92 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.83 -0.544 . . . . 0.0 109.737 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.498 ' HA ' ' HE2' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -63.39 -37.45 87.31 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.975 -0.453 . . . . 0.0 110.548 179.403 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.0 mt -67.35 -44.71 78.37 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.003 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -80.2 -6.08 57.21 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.839 -0.538 . . . . 0.0 111.643 179.091 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.511 2.6 0 CA-C-N 119.357 0.981 . . . . 0.0 109.618 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.741 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 2.9 tp . . . . . 0 N--CA 1.502 2.166 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -129.52 -60.43 1.05 Allowed 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.97 -0.456 . . . . 0.0 110.206 -178.147 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.546 ' O ' HG12 ' A' ' 21' ' ' VAL . 27.4 t -131.34 -72.47 0.55 Allowed 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.701 -0.625 . . . . 0.0 109.756 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -27.87 65.51 Favored 'General case' 0 N--CA 1.516 2.831 0 CA-C-N 118.77 0.714 . . . . 0.0 110.653 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.741 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 1.2 mp0 -84.25 -38.18 20.83 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 178.093 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.508 ' HA ' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.7 -52.73 63.1 Favored 'General case' 0 N--CA 1.504 2.236 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.529 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.546 HG12 ' O ' ' A' ' 17' ' ' SER . 7.3 p -58.36 -38.06 67.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.405 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.632 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -60.25 -38.1 82.44 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.841 -0.537 . . . . 0.0 109.701 178.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.459 ' CZ3' HD11 ' A' ' 24' ' ' LEU . 4.8 t90 -56.24 -40.92 74.91 Favored 'General case' 0 N--CA 1.51 2.529 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 177.738 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.459 HD11 ' CZ3' ' A' ' 23' ' ' TRP . 2.2 mm? -68.49 -42.12 79.11 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.4 ' HD2' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -65.41 -43.58 90.11 Favored 'General case' 0 N--CA 1.513 2.676 0 O-C-N 121.844 -0.535 . . . . 0.0 109.614 178.905 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.59 -27.16 68.21 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 122.043 -0.411 . . . . 0.0 110.009 178.364 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.539 ' HA ' ' HE2' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -84.94 -39.74 17.8 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.702 -0.624 . . . . 0.0 109.789 179.095 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.83 -38.48 79.86 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.666 -0.646 . . . . 0.0 110.599 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -57.35 -25.13 58.94 Favored 'General case' 0 N--CA 1.513 2.72 0 O-C-N 121.854 -0.529 . . . . 0.0 111.558 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 . . . . . 0 N--CA 1.509 2.51 0 CA-C-N 118.85 0.75 . . . . 0.0 109.013 178.837 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.754 HD23 ' HG3' ' A' ' 20' ' ' ARG . 1.5 mp . . . . . 0 N--CA 1.496 1.835 0 CA-C-O 121.599 0.714 . . . . 0.0 109.245 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.1 m-80 -82.87 -60.59 2.12 Favored 'General case' 0 N--CA 1.503 2.191 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.511 -178.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.484 ' O ' HG12 ' A' ' 21' ' ' VAL . 17.1 p -149.66 -74.84 0.16 Allowed 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.195 -0.941 . . . . 0.0 111.301 -178.551 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 17.7 ptp -62.54 -38.38 89.77 Favored 'General case' 0 N--CA 1.517 2.909 0 CA-C-N 118.866 0.757 . . . . 0.0 110.892 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.643 ' HG3' ' HA ' ' A' ' 15' ' ' LEU . 1.2 pm0 -70.76 -25.08 62.75 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.815 -0.553 . . . . 0.0 110.219 178.321 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.754 ' HG3' HD23 ' A' ' 15' ' ' LEU . 33.7 ttp85 -84.26 -57.36 3.2 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.531 -0.73 . . . . 0.0 109.694 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.616 HG22 ' HD3' ' A' ' 25' ' ' ARG . 7.3 p -49.43 -42.2 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.808 -0.558 . . . . 0.0 110.727 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.405 ' N ' HG13 ' A' ' 21' ' ' VAL . 0.5 OUTLIER -71.84 -40.2 69.22 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.408 -0.807 . . . . 0.0 109.369 178.331 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.795 ' CZ3' HD13 ' A' ' 24' ' ' LEU . 2.2 t90 -52.61 -48.16 66.49 Favored 'General case' 0 N--CA 1.517 2.878 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 176.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.795 HD13 ' CZ3' ' A' ' 23' ' ' TRP . 3.7 mm? -74.68 -32.75 62.3 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.089 -178.222 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.616 ' HD3' HG22 ' A' ' 21' ' ' VAL . 4.7 mtp85 -67.96 -51.94 41.69 Favored 'General case' 0 N--CA 1.51 2.526 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.68 -48.46 63.88 Favored 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.494 ' HD2' ' CH2' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -56.02 -41.89 75.63 Favored 'General case' 0 N--CA 1.512 2.641 0 CA-C-N 118.1 0.409 . . . . 0.0 110.663 179.902 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.0 tt -63.55 -44.54 93.88 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.874 -0.516 . . . . 0.0 109.629 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -95.93 24.41 5.52 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.784 -0.572 . . . . 0.0 111.311 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.502 2.127 0 O-C-N 120.998 -1.064 . . . . 0.0 108.339 178.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.682 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 5.7 mp . . . . . 0 N--CA 1.508 2.432 0 CA-C-O 122.483 1.135 . . . . 0.0 109.737 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -85.69 -52.42 5.8 Favored 'General case' 0 N--CA 1.502 2.129 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.079 -178.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -156.52 -59.05 0.09 Allowed 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.881 -0.512 . . . . 0.0 110.188 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -28.34 69.55 Favored 'General case' 0 N--CA 1.514 2.748 0 O-C-N 122.0 -0.438 . . . . 0.0 111.746 -179.728 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.682 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 1.5 mp0 -87.62 -48.13 8.14 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.474 -0.766 . . . . 0.0 109.607 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.474 ' HA ' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -72.59 -20.18 61.34 Favored 'General case' 0 N--CA 1.512 2.642 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -179.442 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.7 p -66.72 -40.84 87.0 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.534 0 CA-C-N 119.722 1.146 . . . . 0.0 108.147 177.278 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.425 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 23.3 mm-40 -74.81 -37.4 62.34 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.612 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.57 ' CD1' HD23 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.3 -47.72 84.67 Favored 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 106.946 -1.502 . . . . 0.0 106.946 177.217 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.456 HD13 ' HD2' ' A' ' 27' ' ' LYS . 2.8 mm? -63.76 -30.56 71.64 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.724 -0.61 . . . . 0.0 111.381 177.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.425 ' HD2' ' HA ' ' A' ' 22' ' ' GLU . 0.2 OUTLIER -56.71 -40.17 75.17 Favored 'General case' 0 N--CA 1.51 2.566 0 CA-C-N 118.895 0.77 . . . . 0.0 109.189 179.295 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.413 ' N ' ' HG2' ' A' ' 25' ' ' ARG . 13.1 ttpp -78.88 -41.5 29.66 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.217 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.456 ' HD2' HD13 ' A' ' 24' ' ' LEU . 25.6 tttm -51.45 -40.7 59.95 Favored 'General case' 0 N--CA 1.515 2.799 0 C-N-CA 122.443 0.297 . . . . 0.0 110.687 178.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.6 mt -58.69 -44.68 90.37 Favored 'General case' 0 N--CA 1.509 2.476 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.204 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -70.82 -39.07 73.24 Favored 'General case' 0 N--CA 1.504 2.261 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 178.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 . . . . . 0 N--CA 1.51 2.554 0 O-C-N 121.832 -0.543 . . . . 0.0 109.696 179.462 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.428 ' HB2' ' HB2' ' A' ' 20' ' ' ARG . 24.1 mt . . . . . 0 N--CA 1.496 1.861 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -175.17 115.05 0.15 Allowed 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.255 -0.903 . . . . 0.0 110.955 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.454 ' O ' HG12 ' A' ' 21' ' ' VAL . 71.6 m 46.12 -102.95 0.07 Allowed 'General case' 0 N--CA 1.52 3.054 0 C-N-CA 123.167 0.587 . . . . 0.0 112.357 177.836 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.546 ' HA ' ' CG1' ' A' ' 21' ' ' VAL . 50.3 mtp -63.47 -35.63 81.08 Favored 'General case' 0 N--CA 1.516 2.833 0 CA-C-N 119.488 1.04 . . . . 0.0 110.342 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' A' ' 23' ' ' TRP . 1.7 mp0 -67.56 -20.84 65.45 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 178.132 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HA ' ' CD1' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -114.15 39.28 2.78 Favored 'General case' 0 N--CA 1.503 2.2 0 CA-C-O 122.113 0.959 . . . . 0.0 110.487 179.238 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.546 ' CG1' ' HA ' ' A' ' 18' ' ' MET . 3.4 p -146.47 -51.26 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.515 2.776 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 176.155 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -68.04 -26.6 65.95 Favored 'General case' 0 N--CA 1.509 2.48 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 174.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.687 ' CH2' ' HE2' ' A' ' 27' ' ' LYS . 2.8 p-90 -56.09 -37.71 69.72 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 122.087 -0.383 . . . . 0.0 110.241 178.54 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.949 HD23 ' HD2' ' A' ' 27' ' ' LYS . 30.3 mt -77.65 -29.74 51.78 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 122.126 -0.359 . . . . 0.0 110.427 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.5 ttm105 -58.88 -43.49 90.91 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.885 -0.509 . . . . 0.0 110.114 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.06 -43.32 13.2 Favored 'General case' 0 N--CA 1.506 2.357 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 177.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.949 ' HD2' HD23 ' A' ' 24' ' ' LEU . 0.1 OUTLIER -52.1 -43.56 63.98 Favored 'General case' 0 N--CA 1.517 2.89 0 O-C-N 122.079 -0.388 . . . . 0.0 110.57 179.362 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.4 tp -69.05 -43.08 75.37 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.556 -0.715 . . . . 0.0 109.724 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 62.4 mm-40 -95.88 28.97 2.86 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.74 -0.6 . . . . 0.0 110.443 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.496 1.874 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.843 HD13 ' HA ' ' A' ' 20' ' ' ARG . 56.3 mt . . . . . 0 N--CA 1.497 1.894 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -86.76 69.98 10.34 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 122.051 -0.406 . . . . 0.0 110.673 -178.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 24.6 m 60.64 -79.08 0.02 OUTLIER 'General case' 0 N--CA 1.519 3.008 0 C-N-CA 123.217 0.607 . . . . 0.0 111.783 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 39.0 mmm -64.19 -34.97 79.29 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.552 -0.718 . . . . 0.0 110.107 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.469 ' O ' HD22 ' A' ' 15' ' ' LEU . 0.4 OUTLIER -66.04 -28.67 69.03 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.31 -0.869 . . . . 0.0 109.173 177.567 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.843 ' HA ' HD13 ' A' ' 15' ' ' LEU . 2.6 ttm-85 -66.37 -63.92 0.97 Allowed 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 178.479 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.9 p -53.16 -37.97 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 177.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.37 -40.73 85.78 Favored 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.318 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.436 ' CE3' HD22 ' A' ' 24' ' ' LEU . 3.4 t90 -55.35 -39.99 70.71 Favored 'General case' 0 N--CA 1.51 2.568 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.436 HD22 ' CE3' ' A' ' 23' ' ' TRP . 2.0 mm? -67.21 -47.82 69.7 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.72 -40.65 93.09 Favored 'General case' 0 N--CA 1.51 2.532 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.662 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.66 -41.24 98.23 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 178.047 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.464 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 2.0 tppm? -57.87 -42.81 85.32 Favored 'General case' 0 N--CA 1.503 2.213 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 179.245 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.471 HD13 ' HA ' ' A' ' 28' ' ' LEU . 4.2 mm? -70.34 -41.6 72.98 Favored 'General case' 0 N--CA 1.506 2.354 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -92.87 33.92 1.13 Allowed 'General case' 0 N--CA 1.501 2.124 0 O-C-N 122.04 -0.412 . . . . 0.0 110.231 178.821 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.505 2.309 0 O-C-N 120.967 -1.083 . . . . 0.0 109.641 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.484 ' HB2' ' HB3' ' A' ' 19' ' ' GLU . 0.9 OUTLIER . . . . . 0 N--CA 1.504 2.24 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.6 m120 61.69 92.87 0.05 Allowed 'General case' 0 N--CA 1.513 2.697 0 C-N-CA 122.852 0.461 . . . . 0.0 110.093 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.446 ' O ' HG12 ' A' ' 21' ' ' VAL . 16.0 m 81.16 -48.15 0.26 Allowed 'General case' 0 N--CA 1.521 3.086 0 C-N-CA 123.791 0.836 . . . . 0.0 109.991 -178.429 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' MET . . . . . 0.575 ' HA ' ' CG1' ' A' ' 21' ' ' VAL . 22.5 mmm -66.6 -20.53 66.02 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.555 -0.716 . . . . 0.0 111.357 179.376 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.484 ' HB3' ' HB2' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -66.87 -8.68 30.81 Favored 'General case' 0 N--CA 1.514 2.73 0 CA-C-N 119.406 1.003 . . . . 0.0 110.773 177.948 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -128.48 29.59 5.28 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.354 -0.841 . . . . 0.0 109.851 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.575 ' CG1' ' HA ' ' A' ' 18' ' ' MET . 3.4 p -157.21 -59.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.5 0 O-C-N 120.998 -1.064 . . . . 0.0 108.434 179.269 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.537 ' H ' HG13 ' A' ' 21' ' ' VAL . 0.9 OUTLIER -75.0 -32.17 61.58 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 107.362 -1.348 . . . . 0.0 107.362 175.602 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 8.4 t90 -50.72 -43.41 57.92 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.499 HD22 ' N ' ' A' ' 24' ' ' LEU . 2.9 mm? -62.85 -44.81 95.14 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -178.262 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.83 -32.78 74.64 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.992 -0.442 . . . . 0.0 110.147 178.068 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.0 mtmm -75.08 -44.29 48.31 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.81 -42.14 83.64 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.309 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 21.0 mt -68.42 -34.44 76.01 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 122.011 -0.43 . . . . 0.0 110.294 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.38 4.96 18.96 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.709 -0.619 . . . . 0.0 112.227 179.812 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.511 2.585 0 CA-C-N 119.463 1.029 . . . . 0.0 110.498 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.8 p . . . . . 0 N--CA 1.501 2.107 0 CA-C-O 120.77 0.319 . . . . 0.0 110.279 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.731 HG11 HD12 ' A' ' 5' ' ' ILE . 47.9 t -122.06 120.07 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.264 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 90.8 p -104.56 144.98 30.95 Favored 'General case' 0 N--CA 1.503 2.207 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.432 ' HB3' ' HB3' ' A' ' 7' ' ' LEU . 5.2 mp0 59.07 37.19 24.36 Favored 'General case' 0 N--CA 1.517 2.875 0 CA-C-O 120.889 0.375 . . . . 0.0 110.789 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.731 HD12 HG11 ' A' ' 2' ' ' VAL . 2.7 tt -61.85 -42.3 94.05 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.525 0 O-C-N 121.189 -0.944 . . . . 0.0 110.242 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -72.81 -34.77 67.09 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.618 -0.676 . . . . 0.0 109.676 178.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.432 ' HB3' ' HB3' ' A' ' 4' ' ' GLU . 2.8 tt -54.24 -49.4 69.59 Favored 'General case' 0 N--CA 1.51 2.547 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 178.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.4 mpp? -67.66 -37.85 82.95 Favored 'General case' 0 N--CA 1.506 2.335 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 63.3 m170 -61.53 -28.27 69.2 Favored 'General case' 0 N--CA 1.515 2.799 0 O-C-N 121.746 -0.596 . . . . 0.0 110.85 178.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -74.36 -37.06 63.61 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.558 -0.714 . . . . 0.0 110.633 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.579 ' HA ' ' HG2' ' A' ' 19' ' ' GLU . 0.7 OUTLIER 33.56 58.63 0.53 Allowed 'General case' 0 N--CA 1.526 3.337 0 C-N-CA 123.964 0.906 . . . . 0.0 112.689 -179.497 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 129.8 -34.36 2.77 Favored Glycine 0 N--CA 1.505 3.235 0 N-CA-C 110.201 -1.16 . . . . 0.0 110.201 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.5 mtmt -77.95 -26.56 48.89 Favored 'General case' 0 N--CA 1.51 2.569 0 CA-C-N 118.055 0.927 . . . . 0.0 111.207 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -94.96 -45.87 7.08 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.436 -0.79 . . . . 0.0 110.542 -179.175 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.604 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 96.1 mt 57.22 86.6 0.07 Allowed 'General case' 0 N--CA 1.516 2.854 0 CA-C-O 121.365 0.602 . . . . 0.0 110.97 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -142.16 -63.57 0.43 Allowed 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.863 -0.523 . . . . 0.0 110.645 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.2 p -107.96 -88.1 0.48 Allowed 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.76 -0.588 . . . . 0.0 109.726 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -72.22 -27.55 62.6 Favored 'General case' 0 N--CA 1.51 2.559 0 CA-C-N 118.958 0.799 . . . . 0.0 110.406 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.604 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 23.5 mt-10 -71.73 -46.38 58.75 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.446 -0.784 . . . . 0.0 109.068 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -61.59 -57.56 11.56 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 122.028 -0.42 . . . . 0.0 110.791 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.9 p -47.97 -38.44 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.788 0 CA-C-N 117.903 0.32 . . . . 0.0 110.809 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.476 ' HA ' ' HD3' ' A' ' 25' ' ' ARG . 0.4 OUTLIER -63.12 -43.15 99.2 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.564 -0.71 . . . . 0.0 109.252 178.278 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.46 ' CE3' HD22 ' A' ' 24' ' ' LEU . 4.6 t90 -62.96 -43.8 97.8 Favored 'General case' 0 N--CA 1.504 2.268 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.618 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.46 HD22 ' CE3' ' A' ' 23' ' ' TRP . 1.2 mm? -65.49 -38.62 90.29 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.989 -0.444 . . . . 0.0 110.093 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.674 ' HA ' HD12 ' A' ' 28' ' ' LEU . 22.1 mtp180 -58.55 -43.7 89.38 Favored 'General case' 0 N--CA 1.508 2.445 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 178.83 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.508 ' HA ' ' HE2' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -66.43 -40.43 89.49 Favored 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.655 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.456 ' HD3' ' HA ' ' A' ' 27' ' ' LYS . 1.5 tppm? -56.02 -36.2 67.71 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 122.243 -0.286 . . . . 0.0 110.741 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.674 HD12 ' HA ' ' A' ' 25' ' ' ARG . 5.9 mt -60.43 -40.36 90.81 Favored 'General case' 0 N--CA 1.511 2.602 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 178.224 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -69.92 -37.83 76.06 Favored 'General case' 0 N--CA 1.508 2.434 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -63.25 -49.31 74.62 Favored 'General case' 0 N--CA 1.509 2.486 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 74.0 t -60.57 -40.83 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.662 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 16.0 t60 -55.76 -46.19 77.93 Favored 'General case' 0 N--CA 1.508 2.429 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 178.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -103.51 44.28 1.03 Allowed 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -110.58 -59.13 1.99 Allowed 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.265 -0.897 . . . . 0.0 109.614 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.2 m -127.01 -43.19 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.638 0 O-C-N 122.017 -0.427 . . . . 0.0 110.198 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -142.88 137.72 29.73 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.8 mt -83.66 81.04 8.92 Favored 'General case' 0 N--CA 1.504 2.251 0 CA-C-O 121.522 0.677 . . . . 0.0 110.303 -179.1 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -107.25 -59.93 0.57 Allowed Glycine 0 N--CA 1.5 2.916 0 N-CA-C 108.77 -1.732 . . . . 0.0 108.77 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.504 2.227 0 CA-C-O 117.834 -1.079 . . . . 0.0 110.178 179.388 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 67.2 m . . . . . 0 N--CA 1.5 2.027 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 6.4 m -93.44 70.52 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.542 0 CA-C-O 121.831 0.824 . . . . 0.0 109.185 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 12.1 p -135.86 -54.84 0.77 Allowed 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.65 -0.656 . . . . 0.0 109.924 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.88 -42.95 13.65 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.886 -0.509 . . . . 0.0 109.989 179.293 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.0 mp 48.1 51.68 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.517 2.912 0 CA-C-O 121.636 0.731 . . . . 0.0 110.739 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.2 -45.06 0.38 Allowed 'General case' 0 N--CA 1.514 2.731 0 O-C-N 121.421 -0.799 . . . . 0.0 110.757 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.77 -41.61 97.93 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.498 -0.751 . . . . 0.0 109.331 178.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 15.6 ttt -62.94 -39.78 95.66 Favored 'General case' 0 N--CA 1.508 2.47 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 63.7 t-80 -62.41 -44.72 95.77 Favored 'General case' 0 N--CA 1.506 2.338 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -103.0 49.08 0.84 Allowed 'General case' 0 N--CA 1.502 2.127 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 tp -99.51 98.63 9.5 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.465 -0.772 . . . . 0.0 109.436 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.685 ' CA ' ' HB2' ' A' ' 16' ' ' ASN . . . -133.82 -62.94 0.07 OUTLIER Glycine 0 N--CA 1.503 3.153 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.0 mptt 73.18 -67.13 0.28 Allowed 'General case' 0 N--CA 1.515 2.793 0 N-CA-C 106.284 -1.747 . . . . 0.0 106.284 -176.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -95.87 -33.68 12.13 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 175.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.742 HD22 ' HB2' ' A' ' 19' ' ' GLU . 1.6 tm? -162.04 127.01 3.38 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.385 -0.822 . . . . 0.0 112.546 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.685 ' HB2' ' CA ' ' A' ' 12' ' ' GLY . 20.8 t-20 -158.16 -63.55 0.09 Allowed 'General case' 0 N--CA 1.517 2.894 0 O-C-N 121.952 -0.467 . . . . 0.0 110.491 177.132 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.8 p -143.22 -63.48 0.4 Allowed 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.646 -0.659 . . . . 0.0 109.744 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 3.8 tpt -66.19 -27.08 67.72 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.846 -0.534 . . . . 0.0 109.799 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.742 ' HB2' HD22 ' A' ' 15' ' ' LEU . 2.2 mp0 -79.63 -32.02 41.65 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.171 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.708 ' HB3' HD11 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -99.29 32.32 2.78 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.549 -0.72 . . . . 0.0 112.434 -179.644 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 2.3 p -121.95 -54.57 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.136 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 176.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.41 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . 9.5 tp10 -68.34 -35.74 78.22 Favored 'General case' 0 N--CA 1.507 2.415 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 176.164 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.77 ' CE3' HD13 ' A' ' 24' ' ' LEU . 0.6 OUTLIER -49.88 -50.07 47.18 Favored 'General case' 0 N--CA 1.513 2.72 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 176.493 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.77 HD13 ' CE3' ' A' ' 23' ' ' TRP . 2.5 mm? -76.85 -37.37 55.73 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.421 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.41 ' HB2' ' HA ' ' A' ' 22' ' ' GLU . 0.1 OUTLIER -63.23 -30.81 71.88 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.805 -0.56 . . . . 0.0 110.049 178.183 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.41 44.68 1.09 Allowed 'General case' 0 N--CA 1.5 2.054 0 CA-C-O 122.147 0.975 . . . . 0.0 108.791 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.458 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 0.1 OUTLIER -145.42 -56.22 0.31 Allowed 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 179.311 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mt -76.69 -39.06 53.23 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -57.74 -30.71 65.79 Favored 'General case' 0 N--CA 1.514 2.74 0 O-C-N 121.369 -0.832 . . . . 0.0 110.442 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -68.72 -43.51 75.8 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.836 -0.54 . . . . 0.0 110.098 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 98.0 t -121.42 -89.11 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.206 0 O-C-N 121.666 -0.647 . . . . 0.0 109.769 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 60.3 t60 43.59 54.98 5.2 Favored 'General case' 0 N--CA 1.52 3.072 0 CA-C-N 118.953 0.797 . . . . 0.0 110.663 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 57.7 60.19 2.91 Favored 'General case' 0 N--CA 1.507 2.42 0 CA-C-O 121.482 0.658 . . . . 0.0 110.068 -179.001 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 43.6 p90 -65.01 -27.29 68.72 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 121.608 -0.683 . . . . 0.0 110.727 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 8.3 p -66.28 -32.89 60.13 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.458 0 O-C-N 121.614 -0.679 . . . . 0.0 110.657 179.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -140.06 97.64 3.28 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.756 -0.59 . . . . 0.0 109.44 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.435 ' CD2' ' HB3' ' A' ' 39' ' ' ALA . 1.3 tt -80.22 122.29 26.67 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.849 -0.532 . . . . 0.0 109.629 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -101.17 63.27 0.55 Allowed Glycine 0 N--CA 1.503 3.155 0 N-CA-C 109.899 -1.28 . . . . 0.0 109.899 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.435 ' HB3' ' CD2' ' A' ' 37' ' ' LEU . . . . . . . . 0 N--CA 1.507 2.406 0 CA-C-O 117.729 -1.129 . . . . 0.0 110.059 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 55.8 m . . . . . 0 N--CA 1.501 2.087 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 24.5 t 74.58 -55.46 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.521 3.097 0 C-N-CA 123.41 0.684 . . . . 0.0 111.256 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.1 p -53.78 -48.49 69.72 Favored 'General case' 0 N--CA 1.514 2.768 0 O-C-N 121.483 -0.761 . . . . 0.0 111.925 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.06 -35.38 80.04 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 121.822 -0.549 . . . . 0.0 111.686 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 7.9 tp -84.28 -21.94 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.394 0 O-C-N 121.397 -0.814 . . . . 0.0 110.507 179.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -63.18 -50.57 69.79 Favored 'General case' 0 N--CA 1.51 2.541 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 178.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.5 pp -68.32 -34.83 76.82 Favored 'General case' 0 N--CA 1.509 2.502 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 177.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.11 -32.38 74.05 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.783 -0.573 . . . . 0.0 109.949 178.211 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -57.69 -35.91 71.25 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.758 -0.589 . . . . 0.0 110.227 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 38.0 m-80 -92.04 51.42 1.81 Allowed 'General case' 0 N--CA 1.507 2.381 0 CA-C-O 121.395 0.617 . . . . 0.0 109.488 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -176.67 -56.07 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.527 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.6 91.18 0.1 Allowed Glycine 0 N--CA 1.499 2.898 0 N-CA-C 108.298 -1.921 . . . . 0.0 108.298 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.74 97.29 0.07 Allowed 'General case' 0 N--CA 1.511 2.578 0 CA-C-N 117.43 0.615 . . . . 0.0 110.521 -178.573 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 10.2 t-80 48.71 40.42 15.88 Favored 'General case' 0 N--CA 1.509 2.52 0 CA-C-O 121.166 0.508 . . . . 0.0 111.3 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.68 HD23 ' HB3' ' A' ' 19' ' ' GLU . 36.5 mt -96.12 72.95 2.93 Favored 'General case' 0 N--CA 1.499 1.994 0 CA-C-O 122.209 1.004 . . . . 0.0 108.587 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -105.96 -49.3 3.42 Favored 'General case' 0 N--CA 1.506 2.327 0 CA-C-N 115.397 -0.82 . . . . 0.0 108.883 -179.458 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.28 151.07 22.43 Favored 'General case' 0 N--CA 1.5 2.059 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 178.685 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.493 ' CA ' HG12 ' A' ' 21' ' ' VAL . 0.2 OUTLIER 74.69 -65.58 0.34 Allowed 'General case' 0 N--CA 1.518 2.968 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -177.852 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.68 ' HB3' HD23 ' A' ' 15' ' ' LEU . 16.5 mt-10 -59.17 -35.81 74.2 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.789 -0.57 . . . . 0.0 109.789 177.124 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.485 ' HA ' ' HD1' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -100.0 -29.71 12.39 Favored 'General case' 0 N--CA 1.506 2.342 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -178.617 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.493 HG12 ' CA ' ' A' ' 18' ' ' MET . 7.8 p -61.44 -44.02 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.503 0 CA-C-N 119.979 1.263 . . . . 0.0 108.069 178.138 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.419 ' N ' HG13 ' A' ' 21' ' ' VAL . 0.7 OUTLIER -71.42 -37.29 71.48 Favored 'General case' 0 N--CA 1.506 2.347 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 177.403 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.485 ' HD1' ' HA ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -60.13 -45.57 92.57 Favored 'General case' 0 N--CA 1.508 2.459 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.226 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.428 HD13 ' HD2' ' A' ' 27' ' ' LYS . 2.6 mm? -59.76 -28.44 67.4 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.742 -0.599 . . . . 0.0 111.917 178.105 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.1 -45.49 93.25 Favored 'General case' 0 N--CA 1.513 2.676 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.467 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.498 ' HE3' ' HB2' ' A' ' 30' ' ' ASP . 3.9 tptt -68.42 -37.2 80.08 Favored 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.071 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.428 ' HD2' HD13 ' A' ' 24' ' ' LEU . 33.0 tttm -56.78 -41.24 77.31 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.905 -0.497 . . . . 0.0 110.6 178.604 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.43 ' O ' ' HB3' ' A' ' 32' ' ' HIS . 2.5 mm? -71.73 -55.77 7.04 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.581 -0.699 . . . . 0.0 110.105 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -62.58 -19.79 64.06 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 121.378 -0.826 . . . . 0.0 112.289 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.498 ' HB2' ' HE3' ' A' ' 26' ' ' LYS . 0.9 OUTLIER -100.6 -59.43 1.7 Allowed 'General case' 0 N--CA 1.5 2.025 0 CA-C-N 119.257 0.935 . . . . 0.0 110.362 -179.731 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 32.9 t -67.47 -52.63 39.64 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.661 0 O-C-N 121.712 -0.618 . . . . 0.0 110.153 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.43 ' HB3' ' O ' ' A' ' 28' ' ' LEU . 49.3 t-80 -69.59 -41.86 75.22 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.79 -0.569 . . . . 0.0 110.394 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -111.01 58.87 0.61 Allowed 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.712 -0.618 . . . . 0.0 110.196 -179.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -83.41 -59.25 2.51 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.32 -0.862 . . . . 0.0 109.234 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.414 ' O ' ' HB3' ' A' ' 36' ' ' ALA . 7.6 p -109.1 -35.94 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.314 0 O-C-N 121.958 -0.464 . . . . 0.0 110.602 179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.414 ' HB3' ' O ' ' A' ' 35' ' ' VAL . . . 74.62 -63.44 0.42 Allowed 'General case' 0 N--CA 1.514 2.762 0 C-N-CA 123.051 0.54 . . . . 0.0 110.22 -179.27 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -138.87 -44.25 0.47 Allowed 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.671 -0.643 . . . . 0.0 110.958 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 80.45 54.43 3.75 Favored Glycine 0 N--CA 1.501 3.012 0 N-CA-C 109.957 -1.257 . . . . 0.0 109.957 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.504 2.267 0 CA-C-O 117.795 -1.097 . . . . 0.0 110.172 -179.843 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.501 2.096 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 28.4 m -71.54 -35.8 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.754 0 O-C-N 121.905 -0.497 . . . . 0.0 110.306 179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.0 t -113.46 177.92 4.46 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.629 -0.669 . . . . 0.0 110.228 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.06 -17.67 58.59 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.618 -0.676 . . . . 0.0 110.802 179.198 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.535 ' HB ' ' HB2' ' A' ' 9' ' ' HIS . 25.5 mm 82.22 -56.6 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.516 2.867 0 CA-C-N 118.657 0.662 . . . . 0.0 109.385 -179.54 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.4 mm-40 65.13 -66.53 0.14 Allowed 'General case' 0 N--CA 1.517 2.911 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 178.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.422 HD13 ' HA ' ' A' ' 7' ' ' LEU . 2.6 mm? -66.24 -61.84 1.8 Allowed 'General case' 0 N--CA 1.513 2.688 0 CA-C-N 119.173 0.897 . . . . 0.0 110.037 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.424 ' HB2' ' CG2' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -68.23 -22.81 64.76 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.888 -0.508 . . . . 0.0 110.653 178.957 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.535 ' HB2' ' HB ' ' A' ' 5' ' ' ILE . 14.0 t-160 -77.4 -50.45 12.7 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.508 -0.745 . . . . 0.0 109.506 178.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -122.01 97.88 5.68 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.833 -0.542 . . . . 0.0 109.978 -178.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -132.03 118.42 19.66 Favored 'General case' 0 N--CA 1.51 2.57 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.279 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 54.8 46.11 77.04 Favored Glycine 0 N--CA 1.514 3.842 0 N-CA-C 109.416 -1.474 . . . . 0.0 109.416 -178.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 10.6 ttmt -122.42 -57.18 1.77 Allowed 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.867 -0.784 . . . . 0.0 111.228 -177.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -85.62 -22.58 27.91 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 121.636 -0.665 . . . . 0.0 111.45 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.667 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 74.8 mt 61.54 78.26 0.3 Allowed 'General case' 0 N--CA 1.507 2.395 0 CA-C-O 121.895 0.855 . . . . 0.0 109.651 -179.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -121.23 -62.93 1.38 Allowed 'General case' 0 N--CA 1.503 2.197 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.66 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.9 m -136.43 -67.46 0.51 Allowed 'General case' 0 N--CA 1.506 2.346 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -69.33 -30.44 68.49 Favored 'General case' 0 N--CA 1.509 2.505 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.31 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.667 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 1.2 mt-10 -79.43 -41.35 27.8 Favored 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 178.165 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 mtt180 -61.92 -54.91 35.38 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.915 -0.49 . . . . 0.0 111.255 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.3 p -47.33 -39.08 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.021 0 CA-C-N 118.317 0.508 . . . . 0.0 110.714 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -68.89 -43.81 74.53 Favored 'General case' 0 N--CA 1.505 2.325 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 178.005 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.541 ' CE3' HD22 ' A' ' 24' ' ' LEU . 1.1 t90 -56.31 -46.59 79.78 Favored 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 178.112 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.541 HD22 ' CE3' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -56.59 -42.55 78.9 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 122.109 -0.369 . . . . 0.0 110.095 -179.319 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.7 mtt-85 -59.7 -43.92 93.9 Favored 'General case' 0 N--CA 1.507 2.409 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -41.08 69.92 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.83 -0.544 . . . . 0.0 109.737 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.498 ' HA ' ' HE2' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -63.39 -37.45 87.31 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.975 -0.453 . . . . 0.0 110.548 179.403 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.0 mt -67.35 -44.71 78.37 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.003 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -80.2 -6.08 57.21 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.839 -0.538 . . . . 0.0 111.643 179.091 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.03 -56.29 23.44 Favored 'General case' 0 N--CA 1.511 2.6 0 CA-C-N 119.357 0.981 . . . . 0.0 109.618 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.1 p -71.51 -31.67 43.52 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.416 0 O-C-N 121.916 -0.49 . . . . 0.0 109.853 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -61.04 -49.1 78.77 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.749 -0.595 . . . . 0.0 109.613 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 24.0 m-80 -77.31 -44.39 29.76 Favored 'General case' 0 N--CA 1.503 2.224 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -102.26 84.18 2.44 Favored 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.5 t -85.21 -54.1 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.406 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 68.69 164.15 0.23 Allowed 'General case' 0 N--CA 1.515 2.809 0 CA-C-O 121.443 0.639 . . . . 0.0 111.373 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -133.16 103.39 5.98 Favored 'General case' 0 N--CA 1.502 2.139 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.35 -71.01 2.88 Favored Glycine 0 N--CA 1.503 3.118 0 N-CA-C 108.853 -1.699 . . . . 0.0 108.853 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.12 0 CA-C-O 117.751 -1.118 . . . . 0.0 109.549 179.064 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.9 t . . . . . 0 N--CA 1.501 2.113 0 CA-C-O 120.96 0.409 . . . . 0.0 110.458 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.3 p -90.66 -37.39 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.302 0 O-C-N 121.767 -0.583 . . . . 0.0 109.675 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 12.3 p -134.32 110.21 9.33 Favored 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -140.77 39.11 1.83 Allowed 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.759 -0.588 . . . . 0.0 110.588 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.6 tp -100.87 28.21 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.447 0 O-C-N 121.274 -0.891 . . . . 0.0 110.155 179.031 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 -74.55 -46.58 38.08 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 120.963 -1.086 . . . . 0.0 109.796 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.64 -47.09 85.26 Favored 'General case' 0 N--CA 1.507 2.416 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 179.286 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -61.86 -42.02 98.55 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.981 -0.45 . . . . 0.0 109.975 179.071 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.508 ' HA ' ' HD2' ' A' ' 13' ' ' LYS . 6.0 m170 -64.93 -36.06 83.15 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.849 -0.532 . . . . 0.0 110.222 178.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 24.7 m-80 -94.11 45.65 1.15 Allowed 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.7 -0.625 . . . . 0.0 109.681 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -150.96 72.26 1.06 Allowed 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.394 -0.816 . . . . 0.0 108.982 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 66.02 58.34 9.12 Favored Glycine 0 N--CA 1.507 3.395 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 -179.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.508 ' HD2' ' HA ' ' A' ' 9' ' ' HIS . 0.4 OUTLIER -59.73 -47.83 84.1 Favored 'General case' 0 N--CA 1.511 2.61 0 CA-C-N 117.777 0.789 . . . . 0.0 109.66 179.823 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 20.1 t-80 -107.72 48.02 0.87 Allowed 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 177.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.741 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 2.9 tp -164.83 83.08 0.39 Allowed 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -129.52 -60.43 1.05 Allowed 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.97 -0.456 . . . . 0.0 110.206 -178.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.546 ' O ' HG12 ' A' ' 21' ' ' VAL . 27.4 t -131.34 -72.47 0.55 Allowed 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.701 -0.625 . . . . 0.0 109.756 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -27.87 65.51 Favored 'General case' 0 N--CA 1.516 2.831 0 CA-C-N 118.77 0.714 . . . . 0.0 110.653 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.741 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 1.2 mp0 -84.25 -38.18 20.83 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 178.093 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.508 ' HA ' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.7 -52.73 63.1 Favored 'General case' 0 N--CA 1.504 2.236 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.529 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.546 HG12 ' O ' ' A' ' 17' ' ' SER . 7.3 p -58.36 -38.06 67.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.405 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.632 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -60.25 -38.1 82.44 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.841 -0.537 . . . . 0.0 109.701 178.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.459 ' CZ3' HD11 ' A' ' 24' ' ' LEU . 4.8 t90 -56.24 -40.92 74.91 Favored 'General case' 0 N--CA 1.51 2.529 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 177.738 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.459 HD11 ' CZ3' ' A' ' 23' ' ' TRP . 2.2 mm? -68.49 -42.12 79.11 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.4 ' HD2' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -65.41 -43.58 90.11 Favored 'General case' 0 N--CA 1.513 2.676 0 O-C-N 121.844 -0.535 . . . . 0.0 109.614 178.905 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.59 -27.16 68.21 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 122.043 -0.411 . . . . 0.0 110.009 178.364 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.539 ' HA ' ' HE2' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -84.94 -39.74 17.8 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.702 -0.624 . . . . 0.0 109.789 179.095 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.83 -38.48 79.86 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.666 -0.646 . . . . 0.0 110.599 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -57.35 -25.13 58.94 Favored 'General case' 0 N--CA 1.513 2.72 0 O-C-N 121.854 -0.529 . . . . 0.0 111.558 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -58.33 -58.42 8.56 Favored 'General case' 0 N--CA 1.509 2.51 0 CA-C-N 118.85 0.75 . . . . 0.0 109.013 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.3 p -73.94 -28.24 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.514 0 O-C-N 122.015 -0.428 . . . . 0.0 110.004 178.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -64.04 -25.36 68.08 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.618 -0.676 . . . . 0.0 110.753 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -88.36 48.84 1.69 Allowed 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.434 -0.791 . . . . 0.0 110.351 179.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -132.2 60.54 1.68 Allowed 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 179.072 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.738 HG12 ' HG ' ' A' ' 37' ' ' LEU . 40.0 t -123.25 -63.27 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.305 0 O-C-N 121.599 -0.688 . . . . 0.0 109.266 -179.154 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 57.92 38.76 27.03 Favored 'General case' 0 N--CA 1.514 2.73 0 CA-C-O 121.058 0.456 . . . . 0.0 111.415 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.738 ' HG ' HG12 ' A' ' 35' ' ' VAL . 2.1 pp -165.95 156.81 13.28 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.26 -0.9 . . . . 0.0 110.352 179.423 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.29 -73.89 1.66 Allowed Glycine 0 N--CA 1.502 3.063 0 N-CA-C 109.392 -1.483 . . . . 0.0 109.392 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.502 2.157 0 CA-C-O 118.694 -0.67 . . . . 0.0 109.829 179.445 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.452 ' HA ' HD22 ' A' ' 7' ' ' LEU . 67.8 m . . . . . 0 N--CA 1.498 1.93 0 CA-C-O 121.449 0.642 . . . . 0.0 109.699 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 2.0 m -143.44 -53.19 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.582 0 O-C-N 121.839 -0.538 . . . . 0.0 109.84 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 7.4 t -162.17 75.15 0.44 Allowed 'General case' 0 N--CA 1.504 2.244 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.406 ' OE2' HD13 ' A' ' 7' ' ' LEU . 2.5 mp0 -111.26 -4.36 14.99 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.708 -0.62 . . . . 0.0 111.622 -179.066 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.1 mt 73.63 -63.17 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.519 3.01 0 CA-C-N 119.158 0.89 . . . . 0.0 109.685 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -67.35 -36.45 81.44 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.707 -0.62 . . . . 0.0 110.065 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.452 HD22 ' HA ' ' A' ' 1' ' ' SER . 0.8 OUTLIER -61.9 -46.6 88.68 Favored 'General case' 0 N--CA 1.506 2.35 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.519 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.86 -40.06 91.31 Favored 'General case' 0 N--CA 1.509 2.497 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.117 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -58.72 -44.65 90.45 Favored 'General case' 0 N--CA 1.509 2.5 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 178.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.5 m-80 -98.02 66.98 1.89 Allowed 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.9 tp -153.12 73.98 1.01 Allowed 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.49 -0.756 . . . . 0.0 110.288 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -91.48 73.88 1.62 Allowed Glycine 0 N--CA 1.505 3.247 0 N-CA-C 108.429 -1.868 . . . . 0.0 108.429 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.0 mttp 69.2 -75.68 0.07 Allowed 'General case' 0 N--CA 1.516 2.869 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 -178.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 29.8 p80 -119.66 11.55 12.02 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.803 -0.561 . . . . 0.0 110.308 177.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.754 HD23 ' HG3' ' A' ' 20' ' ' ARG . 1.5 mp -94.5 89.87 5.99 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.307 -0.871 . . . . 0.0 109.245 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.1 m-80 -82.87 -60.59 2.12 Favored 'General case' 0 N--CA 1.503 2.191 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.511 -178.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.484 ' O ' HG12 ' A' ' 21' ' ' VAL . 17.1 p -149.66 -74.84 0.16 Allowed 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.195 -0.941 . . . . 0.0 111.301 -178.551 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 17.7 ptp -62.54 -38.38 89.77 Favored 'General case' 0 N--CA 1.517 2.909 0 CA-C-N 118.866 0.757 . . . . 0.0 110.892 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.643 ' HG3' ' HA ' ' A' ' 15' ' ' LEU . 1.2 pm0 -70.76 -25.08 62.75 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.815 -0.553 . . . . 0.0 110.219 178.321 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.754 ' HG3' HD23 ' A' ' 15' ' ' LEU . 33.7 ttp85 -84.26 -57.36 3.2 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.531 -0.73 . . . . 0.0 109.694 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.616 HG22 ' HD3' ' A' ' 25' ' ' ARG . 7.3 p -49.43 -42.2 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.808 -0.558 . . . . 0.0 110.727 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.405 ' N ' HG13 ' A' ' 21' ' ' VAL . 0.5 OUTLIER -71.84 -40.2 69.22 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.408 -0.807 . . . . 0.0 109.369 178.331 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.795 ' CZ3' HD13 ' A' ' 24' ' ' LEU . 2.2 t90 -52.61 -48.16 66.49 Favored 'General case' 0 N--CA 1.517 2.878 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 176.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.795 HD13 ' CZ3' ' A' ' 23' ' ' TRP . 3.7 mm? -74.68 -32.75 62.3 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.089 -178.222 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.616 ' HD3' HG22 ' A' ' 21' ' ' VAL . 4.7 mtp85 -67.96 -51.94 41.69 Favored 'General case' 0 N--CA 1.51 2.526 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.68 -48.46 63.88 Favored 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.494 ' HD2' ' CH2' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -56.02 -41.89 75.63 Favored 'General case' 0 N--CA 1.512 2.641 0 CA-C-N 118.1 0.409 . . . . 0.0 110.663 179.902 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.0 tt -63.55 -44.54 93.88 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.874 -0.516 . . . . 0.0 109.629 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -95.93 24.41 5.52 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.784 -0.572 . . . . 0.0 111.311 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.65 -51.12 7.55 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 120.998 -1.064 . . . . 0.0 108.339 178.63 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.492 HG21 ' HA3' ' A' ' 38' ' ' GLY . 3.4 t -99.58 -35.12 4.56 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.322 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 178.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 -61.76 -48.32 81.22 Favored 'General case' 0 N--CA 1.512 2.636 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -91.97 56.4 2.88 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 177.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -164.26 -57.7 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -179.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.2 p -136.26 -53.69 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.205 0 O-C-N 122.036 -0.415 . . . . 0.0 110.303 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -179.58 -65.86 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.693 0 CA-C-N 119.225 0.921 . . . . 0.0 110.741 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -162.49 139.58 8.02 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.624 -0.673 . . . . 0.0 110.044 -178.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.492 ' HA3' HG21 ' A' ' 31' ' ' VAL . . . -125.28 63.14 0.58 Allowed Glycine 0 N--CA 1.505 3.246 0 N-CA-C 109.664 -1.375 . . . . 0.0 109.664 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.506 2.33 0 CA-C-O 117.732 -1.127 . . . . 0.0 110.043 -179.89 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 75.4 m . . . . . 0 N--CA 1.498 1.973 0 CA-C-O 121.393 0.616 . . . . 0.0 109.569 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.1 p -164.53 -47.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.511 0 O-C-N 121.86 -0.525 . . . . 0.0 110.255 -179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.1 t -144.07 74.72 1.43 Allowed 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -126.21 37.67 4.28 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.764 -0.585 . . . . 0.0 109.715 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.507 HG13 ' HB2' ' A' ' 9' ' ' HIS . 18.7 pt -73.5 -40.33 55.5 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.575 0 O-C-N 121.342 -0.849 . . . . 0.0 109.66 179.236 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 61.74 -77.43 0.03 OUTLIER 'General case' 0 N--CA 1.517 2.875 0 C-N-CA 123.167 0.587 . . . . 0.0 112.191 178.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.1 tt -59.68 -54.36 47.3 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.635 -0.666 . . . . 0.0 110.285 -179.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.498 ' HB2' ' HB ' ' A' ' 5' ' ' ILE . 6.0 mtt -59.57 -35.43 74.26 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 122.008 -0.433 . . . . 0.0 110.501 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.507 ' HB2' HG13 ' A' ' 5' ' ' ILE . 38.2 t-80 -65.67 -47.8 74.24 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.702 -0.624 . . . . 0.0 109.526 178.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -87.7 14.34 8.72 Favored 'General case' 0 N--CA 1.507 2.404 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.0 tp -97.82 52.84 1.09 Allowed 'General case' 0 N--CA 1.506 2.344 0 O-C-N 120.718 -1.239 . . . . 0.0 109.669 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 76.68 -82.86 1.05 Allowed Glycine 0 N--CA 1.502 3.039 0 N-CA-C 109.156 -1.578 . . . . 0.0 109.156 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.42 -95.35 0.05 Allowed 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 123.021 0.528 . . . . 0.0 110.962 179.129 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.69 10.54 2.24 Favored 'General case' 0 N--CA 1.508 2.434 0 CA-C-N 119.426 1.012 . . . . 0.0 111.784 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.682 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 5.7 mp 52.86 64.86 1.7 Allowed 'General case' 0 N--CA 1.508 2.432 0 CA-C-O 122.483 1.135 . . . . 0.0 109.737 -179.346 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -85.69 -52.42 5.8 Favored 'General case' 0 N--CA 1.502 2.129 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.079 -178.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -156.52 -59.05 0.09 Allowed 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.881 -0.512 . . . . 0.0 110.188 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -28.34 69.55 Favored 'General case' 0 N--CA 1.514 2.748 0 O-C-N 122.0 -0.438 . . . . 0.0 111.746 -179.728 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.682 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 1.5 mp0 -87.62 -48.13 8.14 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.474 -0.766 . . . . 0.0 109.607 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.474 ' HA ' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -72.59 -20.18 61.34 Favored 'General case' 0 N--CA 1.512 2.642 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -179.442 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.7 p -66.72 -40.84 87.0 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.534 0 CA-C-N 119.722 1.146 . . . . 0.0 108.147 177.278 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.425 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 23.3 mm-40 -74.81 -37.4 62.34 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.612 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.57 ' CD1' HD23 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.3 -47.72 84.67 Favored 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 106.946 -1.502 . . . . 0.0 106.946 177.217 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.456 HD13 ' HD2' ' A' ' 27' ' ' LYS . 2.8 mm? -63.76 -30.56 71.64 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.724 -0.61 . . . . 0.0 111.381 177.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.425 ' HD2' ' HA ' ' A' ' 22' ' ' GLU . 0.2 OUTLIER -56.71 -40.17 75.17 Favored 'General case' 0 N--CA 1.51 2.566 0 CA-C-N 118.895 0.77 . . . . 0.0 109.189 179.295 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.413 ' N ' ' HG2' ' A' ' 25' ' ' ARG . 13.1 ttpp -78.88 -41.5 29.66 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.217 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.456 ' HD2' HD13 ' A' ' 24' ' ' LEU . 25.6 tttm -51.45 -40.7 59.95 Favored 'General case' 0 N--CA 1.515 2.799 0 C-N-CA 122.443 0.297 . . . . 0.0 110.687 178.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.6 mt -58.69 -44.68 90.37 Favored 'General case' 0 N--CA 1.509 2.476 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -70.82 -39.07 73.24 Favored 'General case' 0 N--CA 1.504 2.261 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 178.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -59.77 -50.6 73.2 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.832 -0.543 . . . . 0.0 109.696 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 86.1 t -64.8 -36.3 77.27 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.541 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -60.71 -46.15 91.49 Favored 'General case' 0 N--CA 1.508 2.446 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -68.63 -37.27 79.58 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -74.74 -177.61 3.3 Favored 'General case' 0 N--CA 1.504 2.271 0 CA-C-O 121.208 0.528 . . . . 0.0 110.06 178.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 11.9 t -104.53 53.86 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.224 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 62.27 49.51 4.26 Favored 'General case' 0 N--CA 1.51 2.527 0 CA-C-O 121.561 0.696 . . . . 0.0 109.446 -178.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.4 mt -106.98 141.55 38.02 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.62 -0.675 . . . . 0.0 110.137 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.2 -60.98 0.32 Allowed Glycine 0 N--CA 1.503 3.155 0 N-CA-C 109.684 -1.366 . . . . 0.0 109.684 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.503 2.187 0 CA-C-O 117.611 -1.185 . . . . 0.0 109.804 179.533 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 38.6 m . . . . . 0 N--CA 1.5 2.049 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.9 p -84.3 -38.55 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.673 -0.642 . . . . 0.0 110.077 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 28.6 t -90.86 -62.16 1.51 Allowed 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.18 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 175.67 -50.72 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.365 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 5.6 tt 45.06 31.75 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.522 3.173 0 C-N-CA 123.637 0.775 . . . . 0.0 112.856 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -103.22 -45.1 5.0 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 121.015 -1.053 . . . . 0.0 108.99 178.538 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.846 ' HB3' HD12 ' A' ' 11' ' ' LEU . 79.1 mt -63.2 -29.82 71.08 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 122.077 -0.39 . . . . 0.0 110.267 178.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 44.6 mmm -58.04 -42.95 86.49 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.665 -0.647 . . . . 0.0 109.504 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 24.8 t60 -76.42 -49.05 17.7 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -134.4 101.4 4.98 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.846 HD12 ' HB3' ' A' ' 7' ' ' LEU . 1.9 tp -80.73 77.9 7.54 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 70.14 44.3 60.94 Favored Glycine 0 N--CA 1.504 3.219 0 N-CA-C 109.097 -1.601 . . . . 0.0 109.097 -178.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 67.73 -80.32 0.03 OUTLIER 'General case' 0 N--CA 1.511 2.587 0 CA-C-N 117.391 0.595 . . . . 0.0 109.801 -178.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 -163.79 100.74 0.89 Allowed 'General case' 0 N--CA 1.503 2.213 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.428 ' HB2' ' HB2' ' A' ' 20' ' ' ARG . 24.1 mt -134.5 -157.41 0.8 Allowed 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 -179.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -175.17 115.05 0.15 Allowed 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.255 -0.903 . . . . 0.0 110.955 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.454 ' O ' HG12 ' A' ' 21' ' ' VAL . 71.6 m 46.12 -102.95 0.07 Allowed 'General case' 0 N--CA 1.52 3.054 0 C-N-CA 123.167 0.587 . . . . 0.0 112.357 177.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.546 ' HA ' ' CG1' ' A' ' 21' ' ' VAL . 50.3 mtp -63.47 -35.63 81.08 Favored 'General case' 0 N--CA 1.516 2.833 0 CA-C-N 119.488 1.04 . . . . 0.0 110.342 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' A' ' 23' ' ' TRP . 1.7 mp0 -67.56 -20.84 65.45 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 178.132 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HA ' ' CD1' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -114.15 39.28 2.78 Favored 'General case' 0 N--CA 1.503 2.2 0 CA-C-O 122.113 0.959 . . . . 0.0 110.487 179.238 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.546 ' CG1' ' HA ' ' A' ' 18' ' ' MET . 3.4 p -146.47 -51.26 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.515 2.776 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 176.155 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -68.04 -26.6 65.95 Favored 'General case' 0 N--CA 1.509 2.48 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 174.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.687 ' CH2' ' HE2' ' A' ' 27' ' ' LYS . 2.8 p-90 -56.09 -37.71 69.72 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 122.087 -0.383 . . . . 0.0 110.241 178.54 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.949 HD23 ' HD2' ' A' ' 27' ' ' LYS . 30.3 mt -77.65 -29.74 51.78 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 122.126 -0.359 . . . . 0.0 110.427 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.5 ttm105 -58.88 -43.49 90.91 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.885 -0.509 . . . . 0.0 110.114 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.06 -43.32 13.2 Favored 'General case' 0 N--CA 1.506 2.357 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 177.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.949 ' HD2' HD23 ' A' ' 24' ' ' LEU . 0.1 OUTLIER -52.1 -43.56 63.98 Favored 'General case' 0 N--CA 1.517 2.89 0 O-C-N 122.079 -0.388 . . . . 0.0 110.57 179.362 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.4 tp -69.05 -43.08 75.37 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.556 -0.715 . . . . 0.0 109.724 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 62.4 mm-40 -95.88 28.97 2.86 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.74 -0.6 . . . . 0.0 110.443 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.78 -57.2 3.42 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 178.83 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.1 t -63.16 -35.74 73.11 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.543 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.0 m-70 -62.74 -43.56 98.48 Favored 'General case' 0 N--CA 1.507 2.419 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 178.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -110.77 65.68 0.62 Allowed 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -133.46 130.29 38.4 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.552 -0.717 . . . . 0.0 109.862 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 78.5 t -132.16 -63.88 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -159.56 -59.94 0.07 Allowed 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.843 -0.535 . . . . 0.0 110.009 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 tt -90.69 112.55 24.35 Favored 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -115.36 59.62 0.42 Allowed Glycine 0 N--CA 1.503 3.102 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.505 2.294 0 CA-C-O 117.735 -1.126 . . . . 0.0 110.098 -179.771 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 30.7 p . . . . . 0 N--CA 1.503 2.206 0 CA-C-O 120.849 0.357 . . . . 0.0 110.221 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 3.0 m -128.02 100.44 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.417 0 CA-C-O 121.362 0.601 . . . . 0.0 109.449 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.7 t -104.58 93.21 4.65 Favored 'General case' 0 N--CA 1.502 2.16 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -171.43 -34.12 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.776 0 O-C-N 121.973 -0.454 . . . . 0.0 111.971 -179.475 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.7 mt 81.61 -49.2 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.526 3.33 0 CA-C-N 118.946 0.793 . . . . 0.0 110.65 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -27.4 63.74 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 121.533 -0.729 . . . . 0.0 111.8 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.01 -48.84 72.82 Favored 'General case' 0 N--CA 1.51 2.569 0 CA-C-N 118.74 0.7 . . . . 0.0 109.59 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.66 -41.37 38.46 Favored 'General case' 0 N--CA 1.502 2.129 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 177.797 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.423 ' C ' ' HB3' ' A' ' 13' ' ' LYS . 17.6 t-80 -84.46 70.76 10.73 Favored 'General case' 0 N--CA 1.5 2.072 0 CA-C-O 121.692 0.758 . . . . 0.0 109.627 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -159.44 -60.3 0.07 Allowed 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.511 -0.743 . . . . 0.0 109.609 179.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 13.8 tp -73.57 -49.61 25.46 Favored 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -117.44 38.23 3.04 Favored Glycine 0 N--CA 1.501 2.992 0 N-CA-C 109.986 -1.246 . . . . 0.0 109.986 178.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.423 ' HB3' ' C ' ' A' ' 9' ' ' HIS . 7.8 pttm -65.88 -43.09 89.33 Favored 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 118.037 0.919 . . . . 0.0 110.122 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 48.8 m-70 -126.93 35.57 4.58 Favored 'General case' 0 N--CA 1.505 2.288 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.843 HD13 ' HA ' ' A' ' 20' ' ' ARG . 56.3 mt -141.57 120.05 12.39 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -86.76 69.98 10.34 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 122.051 -0.406 . . . . 0.0 110.673 -178.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 24.6 m 60.64 -79.08 0.02 OUTLIER 'General case' 0 N--CA 1.519 3.008 0 C-N-CA 123.217 0.607 . . . . 0.0 111.783 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 39.0 mmm -64.19 -34.97 79.29 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.552 -0.718 . . . . 0.0 110.107 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.469 ' O ' HD22 ' A' ' 15' ' ' LEU . 0.4 OUTLIER -66.04 -28.67 69.03 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.31 -0.869 . . . . 0.0 109.173 177.567 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.843 ' HA ' HD13 ' A' ' 15' ' ' LEU . 2.6 ttm-85 -66.37 -63.92 0.97 Allowed 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 178.479 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.9 p -53.16 -37.97 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 177.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.37 -40.73 85.78 Favored 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.318 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.436 ' CE3' HD22 ' A' ' 24' ' ' LEU . 3.4 t90 -55.35 -39.99 70.71 Favored 'General case' 0 N--CA 1.51 2.568 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.436 HD22 ' CE3' ' A' ' 23' ' ' TRP . 2.0 mm? -67.21 -47.82 69.7 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.72 -40.65 93.09 Favored 'General case' 0 N--CA 1.51 2.532 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.66 -41.24 98.23 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 178.047 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.464 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 2.0 tppm? -57.87 -42.81 85.32 Favored 'General case' 0 N--CA 1.503 2.213 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 179.245 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.471 HD13 ' HA ' ' A' ' 28' ' ' LEU . 4.2 mm? -70.34 -41.6 72.98 Favored 'General case' 0 N--CA 1.506 2.354 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -92.87 33.92 1.13 Allowed 'General case' 0 N--CA 1.501 2.124 0 O-C-N 122.04 -0.412 . . . . 0.0 110.231 178.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -94.68 -51.47 4.71 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 120.967 -1.083 . . . . 0.0 109.641 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.8 t -141.72 63.65 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.406 0 CA-C-O 121.807 0.813 . . . . 0.0 108.913 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -85.58 62.44 7.47 Favored 'General case' 0 N--CA 1.509 2.512 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 178.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 59.3 m-80 77.1 -58.8 0.49 Allowed 'General case' 0 N--CA 1.515 2.787 0 C-N-CA 123.567 0.747 . . . . 0.0 109.419 -177.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.415 ' O ' HG13 ' A' ' 35' ' ' VAL . 8.3 m-85 63.13 4.15 1.5 Allowed 'General case' 0 N--CA 1.514 2.741 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -179.848 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.415 HG13 ' O ' ' A' ' 34' ' ' PHE . 2.0 m -157.39 43.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.514 2.747 0 O-C-N 121.083 -1.01 . . . . 0.0 109.127 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -138.33 77.05 1.61 Allowed 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.295 -0.878 . . . . 0.0 109.851 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.7 mp 63.25 -83.01 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.778 0 C-N-CA 123.017 0.527 . . . . 0.0 110.819 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.32 -47.93 1.1 Allowed Glycine 0 N--CA 1.503 3.115 0 N-CA-C 110.04 -1.224 . . . . 0.0 110.04 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.504 2.248 0 CA-C-N 117.884 0.842 . . . . 0.0 110.085 -179.787 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.7 t . . . . . 0 N--CA 1.5 2.074 0 CA-C-O 120.822 0.344 . . . . 0.0 110.256 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 17.9 m -127.12 143.51 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 179.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.2 t 69.74 166.6 0.28 Allowed 'General case' 0 N--CA 1.515 2.786 0 CA-C-O 121.421 0.629 . . . . 0.0 110.937 -179.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -110.09 32.36 5.18 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.626 -0.671 . . . . 0.0 109.989 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 5.6 tp -60.8 -32.44 52.06 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.6 0 O-C-N 121.329 -0.857 . . . . 0.0 110.078 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -68.39 -45.96 71.31 Favored 'General case' 0 N--CA 1.51 2.528 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 178.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -67.4 -36.48 81.37 Favored 'General case' 0 N--CA 1.508 2.43 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 178.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.447 ' HB3' ' HA ' ' A' ' 16' ' ' ASN . 48.6 mtt -71.11 -31.99 68.47 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 122.037 -0.414 . . . . 0.0 110.575 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 -78.6 -45.35 21.86 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 179.129 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -66.62 -56.62 9.85 Favored 'General case' 0 N--CA 1.505 2.32 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.465 HD22 ' HA ' ' A' ' 11' ' ' LEU . 0.3 OUTLIER -99.46 114.54 27.55 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 178.171 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 110.86 -55.55 0.5 Allowed Glycine 0 N--CA 1.501 3.028 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 70.89 -71.92 0.12 Allowed 'General case' 0 N--CA 1.513 2.691 0 C-N-CA 123.161 0.584 . . . . 0.0 110.529 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -114.76 52.23 0.86 Allowed 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.503 -0.748 . . . . 0.0 109.126 179.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.484 ' HB2' ' HB3' ' A' ' 19' ' ' GLU . 0.9 OUTLIER -132.5 -61.36 0.86 Allowed 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.525 -0.734 . . . . 0.0 109.586 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.447 ' HA ' ' HB3' ' A' ' 8' ' ' MET . 17.6 m120 61.69 92.87 0.05 Allowed 'General case' 0 N--CA 1.513 2.697 0 C-N-CA 122.852 0.461 . . . . 0.0 110.093 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.446 ' O ' HG12 ' A' ' 21' ' ' VAL . 16.0 m 81.16 -48.15 0.26 Allowed 'General case' 0 N--CA 1.521 3.086 0 C-N-CA 123.791 0.836 . . . . 0.0 109.991 -178.429 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.575 ' HA ' ' CG1' ' A' ' 21' ' ' VAL . 22.5 mmm -66.6 -20.53 66.02 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.555 -0.716 . . . . 0.0 111.357 179.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.484 ' HB3' ' HB2' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -66.87 -8.68 30.81 Favored 'General case' 0 N--CA 1.514 2.73 0 CA-C-N 119.406 1.003 . . . . 0.0 110.773 177.948 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -128.48 29.59 5.28 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.354 -0.841 . . . . 0.0 109.851 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.575 ' CG1' ' HA ' ' A' ' 18' ' ' MET . 3.4 p -157.21 -59.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.5 0 O-C-N 120.998 -1.064 . . . . 0.0 108.434 179.269 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.537 ' H ' HG13 ' A' ' 21' ' ' VAL . 0.9 OUTLIER -75.0 -32.17 61.58 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 107.362 -1.348 . . . . 0.0 107.362 175.602 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 8.4 t90 -50.72 -43.41 57.92 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.499 HD22 ' N ' ' A' ' 24' ' ' LEU . 2.9 mm? -62.85 -44.81 95.14 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -178.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.83 -32.78 74.64 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.992 -0.442 . . . . 0.0 110.147 178.068 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.0 mtmm -75.08 -44.29 48.31 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.81 -42.14 83.64 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.309 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 21.0 mt -68.42 -34.44 76.01 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 122.011 -0.43 . . . . 0.0 110.294 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.38 4.96 18.96 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.709 -0.619 . . . . 0.0 112.227 179.812 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.25 -54.94 41.15 Favored 'General case' 0 N--CA 1.511 2.585 0 CA-C-N 119.463 1.029 . . . . 0.0 110.498 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 47.1 t -67.61 -39.97 83.27 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.715 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.607 ' HE1' ' HB3' ' A' ' 39' ' ' ALA . 38.1 t-80 -60.29 -35.87 76.56 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 122.003 -0.435 . . . . 0.0 110.61 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -90.33 -23.5 21.12 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 121.621 -0.674 . . . . 0.0 111.195 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -77.84 86.06 4.1 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.47 -0.769 . . . . 0.0 111.078 -178.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.0 t 50.15 51.1 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.517 2.918 0 CA-C-O 121.37 0.605 . . . . 0.0 110.98 178.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -135.72 -58.05 0.77 Allowed 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.324 -0.86 . . . . 0.0 109.484 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.7 tt -149.91 -62.33 0.21 Allowed 'General case' 0 N--CA 1.503 2.212 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 96.97 82.87 1.66 Allowed Glycine 0 N--CA 1.5 2.943 0 N-CA-C 110.229 -1.148 . . . . 0.0 110.229 179.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.607 ' HB3' ' HE1' ' A' ' 32' ' ' HIS . . . . . . . . 0 N--CA 1.511 2.576 0 CA-C-O 118.716 -0.659 . . . . 0.0 109.864 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.604 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 96.1 mt . . . . . 0 N--CA 1.516 2.854 0 CA-C-O 121.365 0.602 . . . . 0.0 110.97 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -142.16 -63.57 0.43 Allowed 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.863 -0.523 . . . . 0.0 110.645 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.2 p -107.96 -88.1 0.48 Allowed 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.76 -0.588 . . . . 0.0 109.726 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -72.22 -27.55 62.6 Favored 'General case' 0 N--CA 1.51 2.559 0 CA-C-N 118.958 0.799 . . . . 0.0 110.406 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.604 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 23.5 mt-10 -71.73 -46.38 58.75 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.446 -0.784 . . . . 0.0 109.068 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -61.59 -57.56 11.56 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 122.028 -0.42 . . . . 0.0 110.791 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.9 p -47.97 -38.44 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.788 0 CA-C-N 117.903 0.32 . . . . 0.0 110.809 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.476 ' HA ' ' HD3' ' A' ' 25' ' ' ARG . 0.4 OUTLIER -63.12 -43.15 99.2 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.564 -0.71 . . . . 0.0 109.252 178.278 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.46 ' CE3' HD22 ' A' ' 24' ' ' LEU . 4.6 t90 -62.96 -43.8 97.8 Favored 'General case' 0 N--CA 1.504 2.268 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.46 HD22 ' CE3' ' A' ' 23' ' ' TRP . 1.2 mm? -65.49 -38.62 90.29 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.989 -0.444 . . . . 0.0 110.093 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.674 ' HA ' HD12 ' A' ' 28' ' ' LEU . 22.1 mtp180 -58.55 -43.7 89.38 Favored 'General case' 0 N--CA 1.508 2.445 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 178.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.508 ' HA ' ' HE2' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -66.43 -40.43 89.49 Favored 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.655 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.456 ' HD3' ' HA ' ' A' ' 27' ' ' LYS . 1.5 tppm? -56.02 -36.2 67.71 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 122.243 -0.286 . . . . 0.0 110.741 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.674 HD12 ' HA ' ' A' ' 25' ' ' ARG . 5.9 mt -60.43 -40.36 90.81 Favored 'General case' 0 N--CA 1.511 2.602 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 178.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -69.92 -37.83 76.06 Favored 'General case' 0 N--CA 1.508 2.434 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 . . . . . 0 N--CA 1.509 2.486 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.357 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.742 HD22 ' HB2' ' A' ' 19' ' ' GLU . 1.6 tm? . . . . . 0 N--CA 1.499 2.002 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.652 ' N ' HD13 ' A' ' 15' ' ' LEU . 20.8 t-20 -158.16 -63.55 0.09 Allowed 'General case' 0 N--CA 1.517 2.894 0 O-C-N 121.952 -0.467 . . . . 0.0 110.491 177.132 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.8 p -143.22 -63.48 0.4 Allowed 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.646 -0.659 . . . . 0.0 109.744 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 3.8 tpt -66.19 -27.08 67.72 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.846 -0.534 . . . . 0.0 109.799 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.742 ' HB2' HD22 ' A' ' 15' ' ' LEU . 2.2 mp0 -79.63 -32.02 41.65 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.708 ' HB3' HD11 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -99.29 32.32 2.78 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.549 -0.72 . . . . 0.0 112.434 -179.644 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 2.3 p -121.95 -54.57 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.136 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 176.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.41 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . 9.5 tp10 -68.34 -35.74 78.22 Favored 'General case' 0 N--CA 1.507 2.415 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 176.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.77 ' CE3' HD13 ' A' ' 24' ' ' LEU . 0.6 OUTLIER -49.88 -50.07 47.18 Favored 'General case' 0 N--CA 1.513 2.72 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 176.493 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.77 HD13 ' CE3' ' A' ' 23' ' ' TRP . 2.5 mm? -76.85 -37.37 55.73 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.421 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.41 ' HB2' ' HA ' ' A' ' 22' ' ' GLU . 0.1 OUTLIER -63.23 -30.81 71.88 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.805 -0.56 . . . . 0.0 110.049 178.183 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.41 44.68 1.09 Allowed 'General case' 0 N--CA 1.5 2.054 0 CA-C-O 122.147 0.975 . . . . 0.0 108.791 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.458 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 0.1 OUTLIER -145.42 -56.22 0.31 Allowed 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 179.311 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mt -76.69 -39.06 53.23 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -57.74 -30.71 65.79 Favored 'General case' 0 N--CA 1.514 2.74 0 O-C-N 121.369 -0.832 . . . . 0.0 110.442 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 . . . . . 0 N--CA 1.502 2.17 0 O-C-N 121.836 -0.54 . . . . 0.0 110.098 179.214 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.68 HD23 ' HB3' ' A' ' 19' ' ' GLU . 36.5 mt . . . . . 0 N--CA 1.499 1.994 0 CA-C-O 122.209 1.004 . . . . 0.0 108.587 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -105.96 -49.3 3.42 Favored 'General case' 0 N--CA 1.506 2.327 0 CA-C-N 115.397 -0.82 . . . . 0.0 108.883 -179.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.28 151.07 22.43 Favored 'General case' 0 N--CA 1.5 2.059 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 178.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.493 ' CA ' HG12 ' A' ' 21' ' ' VAL . 0.2 OUTLIER 74.69 -65.58 0.34 Allowed 'General case' 0 N--CA 1.518 2.968 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -177.852 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.68 ' HB3' HD23 ' A' ' 15' ' ' LEU . 16.5 mt-10 -59.17 -35.81 74.2 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.789 -0.57 . . . . 0.0 109.789 177.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.485 ' HA ' ' HD1' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -100.0 -29.71 12.39 Favored 'General case' 0 N--CA 1.506 2.342 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -178.617 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.493 HG12 ' CA ' ' A' ' 18' ' ' MET . 7.8 p -61.44 -44.02 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.503 0 CA-C-N 119.979 1.263 . . . . 0.0 108.069 178.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.419 ' N ' HG13 ' A' ' 21' ' ' VAL . 0.7 OUTLIER -71.42 -37.29 71.48 Favored 'General case' 0 N--CA 1.506 2.347 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 177.403 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.485 ' HD1' ' HA ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -60.13 -45.57 92.57 Favored 'General case' 0 N--CA 1.508 2.459 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.226 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.428 HD13 ' HD2' ' A' ' 27' ' ' LYS . 2.6 mm? -59.76 -28.44 67.4 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.742 -0.599 . . . . 0.0 111.917 178.105 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.1 -45.49 93.25 Favored 'General case' 0 N--CA 1.513 2.676 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.498 ' HE3' ' HB2' ' A' ' 30' ' ' ASP . 3.9 tptt -68.42 -37.2 80.08 Favored 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.428 ' HD2' HD13 ' A' ' 24' ' ' LEU . 33.0 tttm -56.78 -41.24 77.31 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.905 -0.497 . . . . 0.0 110.6 178.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 28' ' ' LEU . 2.5 mm? -71.73 -55.77 7.04 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.581 -0.699 . . . . 0.0 110.105 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -62.58 -19.79 64.06 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 121.378 -0.826 . . . . 0.0 112.289 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.498 ' HB2' ' HE3' ' A' ' 26' ' ' LYS . 0.9 OUTLIER . . . . . 0 N--CA 1.5 2.025 0 CA-C-N 119.257 0.935 . . . . 0.0 110.362 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.667 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 74.8 mt . . . . . 0 N--CA 1.507 2.395 0 CA-C-O 121.895 0.855 . . . . 0.0 109.651 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -121.23 -62.93 1.38 Allowed 'General case' 0 N--CA 1.503 2.197 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.66 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.9 m -136.43 -67.46 0.51 Allowed 'General case' 0 N--CA 1.506 2.346 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -69.33 -30.44 68.49 Favored 'General case' 0 N--CA 1.509 2.505 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.667 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 1.2 mt-10 -79.43 -41.35 27.8 Favored 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 178.165 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 mtt180 -61.92 -54.91 35.38 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.915 -0.49 . . . . 0.0 111.255 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.3 p -47.33 -39.08 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.021 0 CA-C-N 118.317 0.508 . . . . 0.0 110.714 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -68.89 -43.81 74.53 Favored 'General case' 0 N--CA 1.505 2.325 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 178.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.541 ' CE3' HD22 ' A' ' 24' ' ' LEU . 1.1 t90 -56.31 -46.59 79.78 Favored 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 178.112 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.541 HD22 ' CE3' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -56.59 -42.55 78.9 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 122.109 -0.369 . . . . 0.0 110.095 -179.319 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.7 mtt-85 -59.7 -43.92 93.9 Favored 'General case' 0 N--CA 1.507 2.409 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -41.08 69.92 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.83 -0.544 . . . . 0.0 109.737 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.498 ' HA ' ' HE2' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -63.39 -37.45 87.31 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.975 -0.453 . . . . 0.0 110.548 179.403 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.0 mt -67.35 -44.71 78.37 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -80.2 -6.08 57.21 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.839 -0.538 . . . . 0.0 111.643 179.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.511 2.6 0 CA-C-N 119.357 0.981 . . . . 0.0 109.618 179.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.741 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 2.9 tp . . . . . 0 N--CA 1.502 2.166 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -129.52 -60.43 1.05 Allowed 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.97 -0.456 . . . . 0.0 110.206 -178.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.546 ' O ' HG12 ' A' ' 21' ' ' VAL . 27.4 t -131.34 -72.47 0.55 Allowed 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.701 -0.625 . . . . 0.0 109.756 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -27.87 65.51 Favored 'General case' 0 N--CA 1.516 2.831 0 CA-C-N 118.77 0.714 . . . . 0.0 110.653 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.741 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 1.2 mp0 -84.25 -38.18 20.83 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 178.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.508 ' HA ' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.7 -52.73 63.1 Favored 'General case' 0 N--CA 1.504 2.236 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.529 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.546 HG12 ' O ' ' A' ' 17' ' ' SER . 7.3 p -58.36 -38.06 67.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.405 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -60.25 -38.1 82.44 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.841 -0.537 . . . . 0.0 109.701 178.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.459 ' CZ3' HD11 ' A' ' 24' ' ' LEU . 4.8 t90 -56.24 -40.92 74.91 Favored 'General case' 0 N--CA 1.51 2.529 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 177.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.459 HD11 ' CZ3' ' A' ' 23' ' ' TRP . 2.2 mm? -68.49 -42.12 79.11 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.4 ' HD2' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -65.41 -43.58 90.11 Favored 'General case' 0 N--CA 1.513 2.676 0 O-C-N 121.844 -0.535 . . . . 0.0 109.614 178.905 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.59 -27.16 68.21 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 122.043 -0.411 . . . . 0.0 110.009 178.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.539 ' HA ' ' HE2' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -84.94 -39.74 17.8 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.702 -0.624 . . . . 0.0 109.789 179.095 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.83 -38.48 79.86 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.666 -0.646 . . . . 0.0 110.599 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -57.35 -25.13 58.94 Favored 'General case' 0 N--CA 1.513 2.72 0 O-C-N 121.854 -0.529 . . . . 0.0 111.558 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 . . . . . 0 N--CA 1.509 2.51 0 CA-C-N 118.85 0.75 . . . . 0.0 109.013 178.837 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.754 HD23 ' HG3' ' A' ' 20' ' ' ARG . 1.5 mp . . . . . 0 N--CA 1.496 1.835 0 CA-C-O 121.599 0.714 . . . . 0.0 109.245 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.1 m-80 -82.87 -60.59 2.12 Favored 'General case' 0 N--CA 1.503 2.191 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.511 -178.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.484 ' O ' HG12 ' A' ' 21' ' ' VAL . 17.1 p -149.66 -74.84 0.16 Allowed 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.195 -0.941 . . . . 0.0 111.301 -178.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 17.7 ptp -62.54 -38.38 89.77 Favored 'General case' 0 N--CA 1.517 2.909 0 CA-C-N 118.866 0.757 . . . . 0.0 110.892 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.643 ' HG3' ' HA ' ' A' ' 15' ' ' LEU . 1.2 pm0 -70.76 -25.08 62.75 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.815 -0.553 . . . . 0.0 110.219 178.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.754 ' HG3' HD23 ' A' ' 15' ' ' LEU . 33.7 ttp85 -84.26 -57.36 3.2 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.531 -0.73 . . . . 0.0 109.694 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.616 HG22 ' HD3' ' A' ' 25' ' ' ARG . 7.3 p -49.43 -42.2 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.808 -0.558 . . . . 0.0 110.727 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.405 ' N ' HG13 ' A' ' 21' ' ' VAL . 0.5 OUTLIER -71.84 -40.2 69.22 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.408 -0.807 . . . . 0.0 109.369 178.331 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.795 ' CZ3' HD13 ' A' ' 24' ' ' LEU . 2.2 t90 -52.61 -48.16 66.49 Favored 'General case' 0 N--CA 1.517 2.878 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 176.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.795 HD13 ' CZ3' ' A' ' 23' ' ' TRP . 3.7 mm? -74.68 -32.75 62.3 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.089 -178.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.616 ' HD3' HG22 ' A' ' 21' ' ' VAL . 4.7 mtp85 -67.96 -51.94 41.69 Favored 'General case' 0 N--CA 1.51 2.526 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.68 -48.46 63.88 Favored 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.494 ' HD2' ' CH2' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -56.02 -41.89 75.63 Favored 'General case' 0 N--CA 1.512 2.641 0 CA-C-N 118.1 0.409 . . . . 0.0 110.663 179.902 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.0 tt -63.55 -44.54 93.88 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.874 -0.516 . . . . 0.0 109.629 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -95.93 24.41 5.52 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.784 -0.572 . . . . 0.0 111.311 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.502 2.127 0 O-C-N 120.998 -1.064 . . . . 0.0 108.339 178.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.682 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 5.7 mp . . . . . 0 N--CA 1.508 2.432 0 CA-C-O 122.483 1.135 . . . . 0.0 109.737 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -85.69 -52.42 5.8 Favored 'General case' 0 N--CA 1.502 2.129 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.079 -178.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -156.52 -59.05 0.09 Allowed 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.881 -0.512 . . . . 0.0 110.188 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -28.34 69.55 Favored 'General case' 0 N--CA 1.514 2.748 0 O-C-N 122.0 -0.438 . . . . 0.0 111.746 -179.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.682 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 1.5 mp0 -87.62 -48.13 8.14 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.474 -0.766 . . . . 0.0 109.607 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.474 ' HA ' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -72.59 -20.18 61.34 Favored 'General case' 0 N--CA 1.512 2.642 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -179.442 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.7 p -66.72 -40.84 87.0 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.534 0 CA-C-N 119.722 1.146 . . . . 0.0 108.147 177.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.425 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 23.3 mm-40 -74.81 -37.4 62.34 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.57 ' CD1' HD23 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.3 -47.72 84.67 Favored 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 106.946 -1.502 . . . . 0.0 106.946 177.217 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.456 HD13 ' HD2' ' A' ' 27' ' ' LYS . 2.8 mm? -63.76 -30.56 71.64 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.724 -0.61 . . . . 0.0 111.381 177.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.425 ' HD2' ' HA ' ' A' ' 22' ' ' GLU . 0.2 OUTLIER -56.71 -40.17 75.17 Favored 'General case' 0 N--CA 1.51 2.566 0 CA-C-N 118.895 0.77 . . . . 0.0 109.189 179.295 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.413 ' N ' ' HG2' ' A' ' 25' ' ' ARG . 13.1 ttpp -78.88 -41.5 29.66 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.456 ' HD2' HD13 ' A' ' 24' ' ' LEU . 25.6 tttm -51.45 -40.7 59.95 Favored 'General case' 0 N--CA 1.515 2.799 0 C-N-CA 122.443 0.297 . . . . 0.0 110.687 178.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.6 mt -58.69 -44.68 90.37 Favored 'General case' 0 N--CA 1.509 2.476 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -70.82 -39.07 73.24 Favored 'General case' 0 N--CA 1.504 2.261 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 178.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 . . . . . 0 N--CA 1.51 2.554 0 O-C-N 121.832 -0.543 . . . . 0.0 109.696 179.462 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.428 ' HB2' ' HB2' ' A' ' 20' ' ' ARG . 24.1 mt . . . . . 0 N--CA 1.496 1.861 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -175.17 115.05 0.15 Allowed 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.255 -0.903 . . . . 0.0 110.955 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.454 ' O ' HG12 ' A' ' 21' ' ' VAL . 71.6 m 46.12 -102.95 0.07 Allowed 'General case' 0 N--CA 1.52 3.054 0 C-N-CA 123.167 0.587 . . . . 0.0 112.357 177.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.546 ' HA ' ' CG1' ' A' ' 21' ' ' VAL . 50.3 mtp -63.47 -35.63 81.08 Favored 'General case' 0 N--CA 1.516 2.833 0 CA-C-N 119.488 1.04 . . . . 0.0 110.342 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' A' ' 23' ' ' TRP . 1.7 mp0 -67.56 -20.84 65.45 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 178.132 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HA ' ' CD1' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -114.15 39.28 2.78 Favored 'General case' 0 N--CA 1.503 2.2 0 CA-C-O 122.113 0.959 . . . . 0.0 110.487 179.238 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.546 ' CG1' ' HA ' ' A' ' 18' ' ' MET . 3.4 p -146.47 -51.26 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.515 2.776 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 176.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -68.04 -26.6 65.95 Favored 'General case' 0 N--CA 1.509 2.48 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 174.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.687 ' CH2' ' HE2' ' A' ' 27' ' ' LYS . 2.8 p-90 -56.09 -37.71 69.72 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 122.087 -0.383 . . . . 0.0 110.241 178.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.949 HD23 ' HD2' ' A' ' 27' ' ' LYS . 30.3 mt -77.65 -29.74 51.78 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 122.126 -0.359 . . . . 0.0 110.427 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.5 ttm105 -58.88 -43.49 90.91 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.885 -0.509 . . . . 0.0 110.114 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.06 -43.32 13.2 Favored 'General case' 0 N--CA 1.506 2.357 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 177.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.949 ' HD2' HD23 ' A' ' 24' ' ' LEU . 0.1 OUTLIER -52.1 -43.56 63.98 Favored 'General case' 0 N--CA 1.517 2.89 0 O-C-N 122.079 -0.388 . . . . 0.0 110.57 179.362 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.4 tp -69.05 -43.08 75.37 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.556 -0.715 . . . . 0.0 109.724 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 62.4 mm-40 -95.88 28.97 2.86 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.74 -0.6 . . . . 0.0 110.443 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.496 1.874 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.843 HD13 ' HA ' ' A' ' 20' ' ' ARG . 56.3 mt . . . . . 0 N--CA 1.497 1.894 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -86.76 69.98 10.34 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 122.051 -0.406 . . . . 0.0 110.673 -178.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 24.6 m 60.64 -79.08 0.02 OUTLIER 'General case' 0 N--CA 1.519 3.008 0 C-N-CA 123.217 0.607 . . . . 0.0 111.783 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 39.0 mmm -64.19 -34.97 79.29 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.552 -0.718 . . . . 0.0 110.107 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.469 ' O ' HD22 ' A' ' 15' ' ' LEU . 0.4 OUTLIER -66.04 -28.67 69.03 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.31 -0.869 . . . . 0.0 109.173 177.567 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.843 ' HA ' HD13 ' A' ' 15' ' ' LEU . 2.6 ttm-85 -66.37 -63.92 0.97 Allowed 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 178.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.9 p -53.16 -37.97 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 177.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.37 -40.73 85.78 Favored 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.436 ' CE3' HD22 ' A' ' 24' ' ' LEU . 3.4 t90 -55.35 -39.99 70.71 Favored 'General case' 0 N--CA 1.51 2.568 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.436 HD22 ' CE3' ' A' ' 23' ' ' TRP . 2.0 mm? -67.21 -47.82 69.7 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.72 -40.65 93.09 Favored 'General case' 0 N--CA 1.51 2.532 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.66 -41.24 98.23 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 178.047 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.464 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 2.0 tppm? -57.87 -42.81 85.32 Favored 'General case' 0 N--CA 1.503 2.213 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 179.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.471 HD13 ' HA ' ' A' ' 28' ' ' LEU . 4.2 mm? -70.34 -41.6 72.98 Favored 'General case' 0 N--CA 1.506 2.354 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -92.87 33.92 1.13 Allowed 'General case' 0 N--CA 1.501 2.124 0 O-C-N 122.04 -0.412 . . . . 0.0 110.231 178.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.505 2.309 0 O-C-N 120.967 -1.083 . . . . 0.0 109.641 -179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.484 ' HB2' ' HB3' ' A' ' 19' ' ' GLU . 0.9 OUTLIER . . . . . 0 N--CA 1.504 2.24 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.6 m120 61.69 92.87 0.05 Allowed 'General case' 0 N--CA 1.513 2.697 0 C-N-CA 122.852 0.461 . . . . 0.0 110.093 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.446 ' O ' HG12 ' A' ' 21' ' ' VAL . 16.0 m 81.16 -48.15 0.26 Allowed 'General case' 0 N--CA 1.521 3.086 0 C-N-CA 123.791 0.836 . . . . 0.0 109.991 -178.429 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . 0.575 ' HA ' ' CG1' ' A' ' 21' ' ' VAL . 22.5 mmm -66.6 -20.53 66.02 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.555 -0.716 . . . . 0.0 111.357 179.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.484 ' HB3' ' HB2' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -66.87 -8.68 30.81 Favored 'General case' 0 N--CA 1.514 2.73 0 CA-C-N 119.406 1.003 . . . . 0.0 110.773 177.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -128.48 29.59 5.28 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.354 -0.841 . . . . 0.0 109.851 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.575 ' CG1' ' HA ' ' A' ' 18' ' ' MET . 3.4 p -157.21 -59.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.5 0 O-C-N 120.998 -1.064 . . . . 0.0 108.434 179.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.537 ' H ' HG13 ' A' ' 21' ' ' VAL . 0.9 OUTLIER -75.0 -32.17 61.58 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 107.362 -1.348 . . . . 0.0 107.362 175.602 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 8.4 t90 -50.72 -43.41 57.92 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.499 HD22 ' N ' ' A' ' 24' ' ' LEU . 2.9 mm? -62.85 -44.81 95.14 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -178.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.83 -32.78 74.64 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.992 -0.442 . . . . 0.0 110.147 178.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.0 mtmm -75.08 -44.29 48.31 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.81 -42.14 83.64 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 21.0 mt -68.42 -34.44 76.01 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 122.011 -0.43 . . . . 0.0 110.294 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.38 4.96 18.96 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.709 -0.619 . . . . 0.0 112.227 179.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.511 2.585 0 CA-C-N 119.463 1.029 . . . . 0.0 110.498 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 35.8 p . . . . . 0 N--CA 1.501 2.107 0 CA-C-O 120.77 0.319 . . . . 0.0 110.279 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.731 HG11 HD12 ' A' ' 5' ' ' ILE . 47.9 t -122.06 120.07 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.264 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 90.8 p -104.56 144.98 30.95 Favored 'General case' 0 N--CA 1.503 2.207 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.432 ' HB3' ' HB3' ' A' ' 7' ' ' LEU . 5.2 mp0 59.07 37.19 24.36 Favored 'General case' 0 N--CA 1.517 2.875 0 CA-C-O 120.889 0.375 . . . . 0.0 110.789 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.731 HD12 HG11 ' A' ' 2' ' ' VAL . 2.7 tt -61.85 -42.3 94.05 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.525 0 O-C-N 121.189 -0.944 . . . . 0.0 110.242 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -72.81 -34.77 67.09 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.618 -0.676 . . . . 0.0 109.676 178.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.432 ' HB3' ' HB3' ' A' ' 4' ' ' GLU . 2.8 tt -54.24 -49.4 69.59 Favored 'General case' 0 N--CA 1.51 2.547 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 178.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.4 mpp? -67.66 -37.85 82.95 Favored 'General case' 0 N--CA 1.506 2.335 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 63.3 m170 -61.53 -28.27 69.2 Favored 'General case' 0 N--CA 1.515 2.799 0 O-C-N 121.746 -0.596 . . . . 0.0 110.85 178.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -74.36 -37.06 63.61 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.558 -0.714 . . . . 0.0 110.633 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.579 ' HA ' ' HG2' ' A' ' 19' ' ' GLU . 0.7 OUTLIER 33.56 58.63 0.53 Allowed 'General case' 0 N--CA 1.526 3.337 0 C-N-CA 123.964 0.906 . . . . 0.0 112.689 -179.497 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 129.8 -34.36 2.77 Favored Glycine 0 N--CA 1.505 3.235 0 N-CA-C 110.201 -1.16 . . . . 0.0 110.201 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.5 mtmt -77.95 -26.56 48.89 Favored 'General case' 0 N--CA 1.51 2.569 0 CA-C-N 118.055 0.927 . . . . 0.0 111.207 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -94.96 -45.87 7.08 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.436 -0.79 . . . . 0.0 110.542 -179.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.604 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 96.1 mt 57.22 86.6 0.07 Allowed 'General case' 0 N--CA 1.516 2.854 0 CA-C-O 121.365 0.602 . . . . 0.0 110.97 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -142.16 -63.57 0.43 Allowed 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.863 -0.523 . . . . 0.0 110.645 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.2 p -107.96 -88.1 0.48 Allowed 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.76 -0.588 . . . . 0.0 109.726 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -72.22 -27.55 62.6 Favored 'General case' 0 N--CA 1.51 2.559 0 CA-C-N 118.958 0.799 . . . . 0.0 110.406 179.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.604 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 23.5 mt-10 -71.73 -46.38 58.75 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.446 -0.784 . . . . 0.0 109.068 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 ttt180 -61.59 -57.56 11.56 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 122.028 -0.42 . . . . 0.0 110.791 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.9 p -47.97 -38.44 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.515 2.788 0 CA-C-N 117.903 0.32 . . . . 0.0 110.809 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.476 ' HA ' ' HD3' ' A' ' 25' ' ' ARG . 0.4 OUTLIER -63.12 -43.15 99.2 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.564 -0.71 . . . . 0.0 109.252 178.278 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.46 ' CE3' HD22 ' A' ' 24' ' ' LEU . 4.6 t90 -62.96 -43.8 97.8 Favored 'General case' 0 N--CA 1.504 2.268 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.46 HD22 ' CE3' ' A' ' 23' ' ' TRP . 1.2 mm? -65.49 -38.62 90.29 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.989 -0.444 . . . . 0.0 110.093 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.674 ' HA ' HD12 ' A' ' 28' ' ' LEU . 22.1 mtp180 -58.55 -43.7 89.38 Favored 'General case' 0 N--CA 1.508 2.445 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 178.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.508 ' HA ' ' HE2' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -66.43 -40.43 89.49 Favored 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.655 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.456 ' HD3' ' HA ' ' A' ' 27' ' ' LYS . 1.5 tppm? -56.02 -36.2 67.71 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 122.243 -0.286 . . . . 0.0 110.741 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.674 HD12 ' HA ' ' A' ' 25' ' ' ARG . 5.9 mt -60.43 -40.36 90.81 Favored 'General case' 0 N--CA 1.511 2.602 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 178.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -69.92 -37.83 76.06 Favored 'General case' 0 N--CA 1.508 2.434 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -63.25 -49.31 74.62 Favored 'General case' 0 N--CA 1.509 2.486 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 74.0 t -60.57 -40.83 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.662 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 16.0 t60 -55.76 -46.19 77.93 Favored 'General case' 0 N--CA 1.508 2.429 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 178.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -103.51 44.28 1.03 Allowed 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -110.58 -59.13 1.99 Allowed 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.265 -0.897 . . . . 0.0 109.614 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 16.2 m -127.01 -43.19 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.638 0 O-C-N 122.017 -0.427 . . . . 0.0 110.198 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -142.88 137.72 29.73 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.8 mt -83.66 81.04 8.92 Favored 'General case' 0 N--CA 1.504 2.251 0 CA-C-O 121.522 0.677 . . . . 0.0 110.303 -179.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -107.25 -59.93 0.57 Allowed Glycine 0 N--CA 1.5 2.916 0 N-CA-C 108.77 -1.732 . . . . 0.0 108.77 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.504 2.227 0 CA-C-O 117.834 -1.079 . . . . 0.0 110.178 179.388 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 67.2 m . . . . . 0 N--CA 1.5 2.027 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 6.4 m -93.44 70.52 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.542 0 CA-C-O 121.831 0.824 . . . . 0.0 109.185 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 12.1 p -135.86 -54.84 0.77 Allowed 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.65 -0.656 . . . . 0.0 109.924 -179.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.88 -42.95 13.65 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.886 -0.509 . . . . 0.0 109.989 179.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.0 mp 48.1 51.68 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.517 2.912 0 CA-C-O 121.636 0.731 . . . . 0.0 110.739 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.2 -45.06 0.38 Allowed 'General case' 0 N--CA 1.514 2.731 0 O-C-N 121.421 -0.799 . . . . 0.0 110.757 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.77 -41.61 97.93 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.498 -0.751 . . . . 0.0 109.331 178.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 15.6 ttt -62.94 -39.78 95.66 Favored 'General case' 0 N--CA 1.508 2.47 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 63.7 t-80 -62.41 -44.72 95.77 Favored 'General case' 0 N--CA 1.506 2.338 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -103.0 49.08 0.84 Allowed 'General case' 0 N--CA 1.502 2.127 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 tp -99.51 98.63 9.5 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.465 -0.772 . . . . 0.0 109.436 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.685 ' CA ' ' HB2' ' A' ' 16' ' ' ASN . . . -133.82 -62.94 0.07 OUTLIER Glycine 0 N--CA 1.503 3.153 0 N-CA-C 110.392 -1.083 . . . . 0.0 110.392 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.0 mptt 73.18 -67.13 0.28 Allowed 'General case' 0 N--CA 1.515 2.793 0 N-CA-C 106.284 -1.747 . . . . 0.0 106.284 -176.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -95.87 -33.68 12.13 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 175.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.742 HD22 ' HB2' ' A' ' 19' ' ' GLU . 1.6 tm? -162.04 127.01 3.38 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.385 -0.822 . . . . 0.0 112.546 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.685 ' HB2' ' CA ' ' A' ' 12' ' ' GLY . 20.8 t-20 -158.16 -63.55 0.09 Allowed 'General case' 0 N--CA 1.517 2.894 0 O-C-N 121.952 -0.467 . . . . 0.0 110.491 177.132 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.8 p -143.22 -63.48 0.4 Allowed 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.646 -0.659 . . . . 0.0 109.744 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 3.8 tpt -66.19 -27.08 67.72 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.846 -0.534 . . . . 0.0 109.799 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.742 ' HB2' HD22 ' A' ' 15' ' ' LEU . 2.2 mp0 -79.63 -32.02 41.65 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 178.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.708 ' HB3' HD11 ' A' ' 15' ' ' LEU . 0.1 OUTLIER -99.29 32.32 2.78 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.549 -0.72 . . . . 0.0 112.434 -179.644 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 2.3 p -121.95 -54.57 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.136 0 N-CA-C 107.082 -1.451 . . . . 0.0 107.082 176.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.41 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . 9.5 tp10 -68.34 -35.74 78.22 Favored 'General case' 0 N--CA 1.507 2.415 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 176.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.77 ' CE3' HD13 ' A' ' 24' ' ' LEU . 0.6 OUTLIER -49.88 -50.07 47.18 Favored 'General case' 0 N--CA 1.513 2.72 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 176.493 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.77 HD13 ' CE3' ' A' ' 23' ' ' TRP . 2.5 mm? -76.85 -37.37 55.73 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.421 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.41 ' HB2' ' HA ' ' A' ' 22' ' ' GLU . 0.1 OUTLIER -63.23 -30.81 71.88 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.805 -0.56 . . . . 0.0 110.049 178.183 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.41 44.68 1.09 Allowed 'General case' 0 N--CA 1.5 2.054 0 CA-C-O 122.147 0.975 . . . . 0.0 108.791 178.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.458 ' HB2' ' O ' ' A' ' 23' ' ' TRP . 0.1 OUTLIER -145.42 -56.22 0.31 Allowed 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 179.311 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mt -76.69 -39.06 53.23 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -57.74 -30.71 65.79 Favored 'General case' 0 N--CA 1.514 2.74 0 O-C-N 121.369 -0.832 . . . . 0.0 110.442 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -68.72 -43.51 75.8 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.836 -0.54 . . . . 0.0 110.098 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 98.0 t -121.42 -89.11 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.206 0 O-C-N 121.666 -0.647 . . . . 0.0 109.769 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 60.3 t60 43.59 54.98 5.2 Favored 'General case' 0 N--CA 1.52 3.072 0 CA-C-N 118.953 0.797 . . . . 0.0 110.663 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 57.7 60.19 2.91 Favored 'General case' 0 N--CA 1.507 2.42 0 CA-C-O 121.482 0.658 . . . . 0.0 110.068 -179.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 43.6 p90 -65.01 -27.29 68.72 Favored 'General case' 0 N--CA 1.512 2.662 0 O-C-N 121.608 -0.683 . . . . 0.0 110.727 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 8.3 p -66.28 -32.89 60.13 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.458 0 O-C-N 121.614 -0.679 . . . . 0.0 110.657 179.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -140.06 97.64 3.28 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.756 -0.59 . . . . 0.0 109.44 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.435 ' CD2' ' HB3' ' A' ' 39' ' ' ALA . 1.3 tt -80.22 122.29 26.67 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.849 -0.532 . . . . 0.0 109.629 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -101.17 63.27 0.55 Allowed Glycine 0 N--CA 1.503 3.155 0 N-CA-C 109.899 -1.28 . . . . 0.0 109.899 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.435 ' HB3' ' CD2' ' A' ' 37' ' ' LEU . . . . . . . . 0 N--CA 1.507 2.406 0 CA-C-O 117.729 -1.129 . . . . 0.0 110.059 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 55.8 m . . . . . 0 N--CA 1.501 2.087 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 24.5 t 74.58 -55.46 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.521 3.097 0 C-N-CA 123.41 0.684 . . . . 0.0 111.256 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 18.1 p -53.78 -48.49 69.72 Favored 'General case' 0 N--CA 1.514 2.768 0 O-C-N 121.483 -0.761 . . . . 0.0 111.925 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.06 -35.38 80.04 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 121.822 -0.549 . . . . 0.0 111.686 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 7.9 tp -84.28 -21.94 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.394 0 O-C-N 121.397 -0.814 . . . . 0.0 110.507 179.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -63.18 -50.57 69.79 Favored 'General case' 0 N--CA 1.51 2.541 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 178.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.5 pp -68.32 -34.83 76.82 Favored 'General case' 0 N--CA 1.509 2.502 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 177.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.11 -32.38 74.05 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.783 -0.573 . . . . 0.0 109.949 178.211 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -57.69 -35.91 71.25 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.758 -0.589 . . . . 0.0 110.227 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 38.0 m-80 -92.04 51.42 1.81 Allowed 'General case' 0 N--CA 1.507 2.381 0 CA-C-O 121.395 0.617 . . . . 0.0 109.488 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -176.67 -56.07 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.527 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.6 91.18 0.1 Allowed Glycine 0 N--CA 1.499 2.898 0 N-CA-C 108.298 -1.921 . . . . 0.0 108.298 179.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.74 97.29 0.07 Allowed 'General case' 0 N--CA 1.511 2.578 0 CA-C-N 117.43 0.615 . . . . 0.0 110.521 -178.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 10.2 t-80 48.71 40.42 15.88 Favored 'General case' 0 N--CA 1.509 2.52 0 CA-C-O 121.166 0.508 . . . . 0.0 111.3 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.68 HD23 ' HB3' ' A' ' 19' ' ' GLU . 36.5 mt -96.12 72.95 2.93 Favored 'General case' 0 N--CA 1.499 1.994 0 CA-C-O 122.209 1.004 . . . . 0.0 108.587 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -105.96 -49.3 3.42 Favored 'General case' 0 N--CA 1.506 2.327 0 CA-C-N 115.397 -0.82 . . . . 0.0 108.883 -179.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.28 151.07 22.43 Favored 'General case' 0 N--CA 1.5 2.059 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 178.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.493 ' CA ' HG12 ' A' ' 21' ' ' VAL . 0.2 OUTLIER 74.69 -65.58 0.34 Allowed 'General case' 0 N--CA 1.518 2.968 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -177.852 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.68 ' HB3' HD23 ' A' ' 15' ' ' LEU . 16.5 mt-10 -59.17 -35.81 74.2 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.789 -0.57 . . . . 0.0 109.789 177.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.485 ' HA ' ' HD1' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -100.0 -29.71 12.39 Favored 'General case' 0 N--CA 1.506 2.342 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -178.617 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.493 HG12 ' CA ' ' A' ' 18' ' ' MET . 7.8 p -61.44 -44.02 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.503 0 CA-C-N 119.979 1.263 . . . . 0.0 108.069 178.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.419 ' N ' HG13 ' A' ' 21' ' ' VAL . 0.7 OUTLIER -71.42 -37.29 71.48 Favored 'General case' 0 N--CA 1.506 2.347 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 177.403 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.485 ' HD1' ' HA ' ' A' ' 20' ' ' ARG . 0.0 OUTLIER -60.13 -45.57 92.57 Favored 'General case' 0 N--CA 1.508 2.459 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.226 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.428 HD13 ' HD2' ' A' ' 27' ' ' LYS . 2.6 mm? -59.76 -28.44 67.4 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.742 -0.599 . . . . 0.0 111.917 178.105 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.1 -45.49 93.25 Favored 'General case' 0 N--CA 1.513 2.676 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.498 ' HE3' ' HB2' ' A' ' 30' ' ' ASP . 3.9 tptt -68.42 -37.2 80.08 Favored 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 177.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.428 ' HD2' HD13 ' A' ' 24' ' ' LEU . 33.0 tttm -56.78 -41.24 77.31 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.905 -0.497 . . . . 0.0 110.6 178.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.43 ' O ' ' HB3' ' A' ' 32' ' ' HIS . 2.5 mm? -71.73 -55.77 7.04 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.581 -0.699 . . . . 0.0 110.105 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -62.58 -19.79 64.06 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 121.378 -0.826 . . . . 0.0 112.289 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.498 ' HB2' ' HE3' ' A' ' 26' ' ' LYS . 0.9 OUTLIER -100.6 -59.43 1.7 Allowed 'General case' 0 N--CA 1.5 2.025 0 CA-C-N 119.257 0.935 . . . . 0.0 110.362 -179.731 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 32.9 t -67.47 -52.63 39.64 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.661 0 O-C-N 121.712 -0.618 . . . . 0.0 110.153 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.43 ' HB3' ' O ' ' A' ' 28' ' ' LEU . 49.3 t-80 -69.59 -41.86 75.22 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.79 -0.569 . . . . 0.0 110.394 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -111.01 58.87 0.61 Allowed 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.712 -0.618 . . . . 0.0 110.196 -179.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -83.41 -59.25 2.51 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.32 -0.862 . . . . 0.0 109.234 179.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.414 ' O ' ' HB3' ' A' ' 36' ' ' ALA . 7.6 p -109.1 -35.94 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.314 0 O-C-N 121.958 -0.464 . . . . 0.0 110.602 179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.414 ' HB3' ' O ' ' A' ' 35' ' ' VAL . . . 74.62 -63.44 0.42 Allowed 'General case' 0 N--CA 1.514 2.762 0 C-N-CA 123.051 0.54 . . . . 0.0 110.22 -179.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -138.87 -44.25 0.47 Allowed 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.671 -0.643 . . . . 0.0 110.958 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 80.45 54.43 3.75 Favored Glycine 0 N--CA 1.501 3.012 0 N-CA-C 109.957 -1.257 . . . . 0.0 109.957 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.504 2.267 0 CA-C-O 117.795 -1.097 . . . . 0.0 110.172 -179.843 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.501 2.096 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 28.4 m -71.54 -35.8 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.754 0 O-C-N 121.905 -0.497 . . . . 0.0 110.306 179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.0 t -113.46 177.92 4.46 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.629 -0.669 . . . . 0.0 110.228 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.06 -17.67 58.59 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.618 -0.676 . . . . 0.0 110.802 179.198 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.535 ' HB ' ' HB2' ' A' ' 9' ' ' HIS . 25.5 mm 82.22 -56.6 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.516 2.867 0 CA-C-N 118.657 0.662 . . . . 0.0 109.385 -179.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.4 mm-40 65.13 -66.53 0.14 Allowed 'General case' 0 N--CA 1.517 2.911 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 178.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.422 HD13 ' HA ' ' A' ' 7' ' ' LEU . 2.6 mm? -66.24 -61.84 1.8 Allowed 'General case' 0 N--CA 1.513 2.688 0 CA-C-N 119.173 0.897 . . . . 0.0 110.037 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.424 ' HB2' ' CG2' ' A' ' 5' ' ' ILE . 0.1 OUTLIER -68.23 -22.81 64.76 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.888 -0.508 . . . . 0.0 110.653 178.957 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.535 ' HB2' ' HB ' ' A' ' 5' ' ' ILE . 14.0 t-160 -77.4 -50.45 12.7 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.508 -0.745 . . . . 0.0 109.506 178.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -122.01 97.88 5.68 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.833 -0.542 . . . . 0.0 109.978 -178.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -132.03 118.42 19.66 Favored 'General case' 0 N--CA 1.51 2.57 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 179.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 54.8 46.11 77.04 Favored Glycine 0 N--CA 1.514 3.842 0 N-CA-C 109.416 -1.474 . . . . 0.0 109.416 -178.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 10.6 ttmt -122.42 -57.18 1.77 Allowed 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.867 -0.784 . . . . 0.0 111.228 -177.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -85.62 -22.58 27.91 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 121.636 -0.665 . . . . 0.0 111.45 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.667 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 74.8 mt 61.54 78.26 0.3 Allowed 'General case' 0 N--CA 1.507 2.395 0 CA-C-O 121.895 0.855 . . . . 0.0 109.651 -179.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -121.23 -62.93 1.38 Allowed 'General case' 0 N--CA 1.503 2.197 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.66 -179.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 45.9 m -136.43 -67.46 0.51 Allowed 'General case' 0 N--CA 1.506 2.346 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -69.33 -30.44 68.49 Favored 'General case' 0 N--CA 1.509 2.505 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.667 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 1.2 mt-10 -79.43 -41.35 27.8 Favored 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 178.165 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 mtt180 -61.92 -54.91 35.38 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.915 -0.49 . . . . 0.0 111.255 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.3 p -47.33 -39.08 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.519 3.021 0 CA-C-N 118.317 0.508 . . . . 0.0 110.714 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -68.89 -43.81 74.53 Favored 'General case' 0 N--CA 1.505 2.325 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 178.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.541 ' CE3' HD22 ' A' ' 24' ' ' LEU . 1.1 t90 -56.31 -46.59 79.78 Favored 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 178.112 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.541 HD22 ' CE3' ' A' ' 23' ' ' TRP . 1.0 OUTLIER -56.59 -42.55 78.9 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 122.109 -0.369 . . . . 0.0 110.095 -179.319 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 9.7 mtt-85 -59.7 -43.92 93.9 Favored 'General case' 0 N--CA 1.507 2.409 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -41.08 69.92 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.83 -0.544 . . . . 0.0 109.737 178.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.498 ' HA ' ' HE2' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -63.39 -37.45 87.31 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.975 -0.453 . . . . 0.0 110.548 179.403 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.0 mt -67.35 -44.71 78.37 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -80.2 -6.08 57.21 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.839 -0.538 . . . . 0.0 111.643 179.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.03 -56.29 23.44 Favored 'General case' 0 N--CA 1.511 2.6 0 CA-C-N 119.357 0.981 . . . . 0.0 109.618 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.1 p -71.51 -31.67 43.52 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.416 0 O-C-N 121.916 -0.49 . . . . 0.0 109.853 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -61.04 -49.1 78.77 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.749 -0.595 . . . . 0.0 109.613 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 24.0 m-80 -77.31 -44.39 29.76 Favored 'General case' 0 N--CA 1.503 2.224 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -102.26 84.18 2.44 Favored 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.5 t -85.21 -54.1 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.406 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 68.69 164.15 0.23 Allowed 'General case' 0 N--CA 1.515 2.809 0 CA-C-O 121.443 0.639 . . . . 0.0 111.373 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -133.16 103.39 5.98 Favored 'General case' 0 N--CA 1.502 2.139 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.35 -71.01 2.88 Favored Glycine 0 N--CA 1.503 3.118 0 N-CA-C 108.853 -1.699 . . . . 0.0 108.853 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.12 0 CA-C-O 117.751 -1.118 . . . . 0.0 109.549 179.064 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.9 t . . . . . 0 N--CA 1.501 2.113 0 CA-C-O 120.96 0.409 . . . . 0.0 110.458 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.3 p -90.66 -37.39 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.302 0 O-C-N 121.767 -0.583 . . . . 0.0 109.675 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 12.3 p -134.32 110.21 9.33 Favored 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -140.77 39.11 1.83 Allowed 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.759 -0.588 . . . . 0.0 110.588 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.6 tp -100.87 28.21 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.447 0 O-C-N 121.274 -0.891 . . . . 0.0 110.155 179.031 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 -74.55 -46.58 38.08 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 120.963 -1.086 . . . . 0.0 109.796 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.64 -47.09 85.26 Favored 'General case' 0 N--CA 1.507 2.416 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 179.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -61.86 -42.02 98.55 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.981 -0.45 . . . . 0.0 109.975 179.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.508 ' HA ' ' HD2' ' A' ' 13' ' ' LYS . 6.0 m170 -64.93 -36.06 83.15 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.849 -0.532 . . . . 0.0 110.222 178.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 24.7 m-80 -94.11 45.65 1.15 Allowed 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.7 -0.625 . . . . 0.0 109.681 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -150.96 72.26 1.06 Allowed 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.394 -0.816 . . . . 0.0 108.982 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 66.02 58.34 9.12 Favored Glycine 0 N--CA 1.507 3.395 0 N-CA-C 110.027 -1.229 . . . . 0.0 110.027 -179.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.508 ' HD2' ' HA ' ' A' ' 9' ' ' HIS . 0.4 OUTLIER -59.73 -47.83 84.1 Favored 'General case' 0 N--CA 1.511 2.61 0 CA-C-N 117.777 0.789 . . . . 0.0 109.66 179.823 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 20.1 t-80 -107.72 48.02 0.87 Allowed 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 177.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.741 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 2.9 tp -164.83 83.08 0.39 Allowed 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -129.52 -60.43 1.05 Allowed 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.97 -0.456 . . . . 0.0 110.206 -178.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.546 ' O ' HG12 ' A' ' 21' ' ' VAL . 27.4 t -131.34 -72.47 0.55 Allowed 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.701 -0.625 . . . . 0.0 109.756 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -27.87 65.51 Favored 'General case' 0 N--CA 1.516 2.831 0 CA-C-N 118.77 0.714 . . . . 0.0 110.653 179.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.741 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 1.2 mp0 -84.25 -38.18 20.83 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 178.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.508 ' HA ' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.7 -52.73 63.1 Favored 'General case' 0 N--CA 1.504 2.236 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.529 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.546 HG12 ' O ' ' A' ' 17' ' ' SER . 7.3 p -58.36 -38.06 67.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.405 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -60.25 -38.1 82.44 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.841 -0.537 . . . . 0.0 109.701 178.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.459 ' CZ3' HD11 ' A' ' 24' ' ' LEU . 4.8 t90 -56.24 -40.92 74.91 Favored 'General case' 0 N--CA 1.51 2.529 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 177.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.459 HD11 ' CZ3' ' A' ' 23' ' ' TRP . 2.2 mm? -68.49 -42.12 79.11 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.4 ' HD2' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -65.41 -43.58 90.11 Favored 'General case' 0 N--CA 1.513 2.676 0 O-C-N 121.844 -0.535 . . . . 0.0 109.614 178.905 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.59 -27.16 68.21 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 122.043 -0.411 . . . . 0.0 110.009 178.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.539 ' HA ' ' HE2' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -84.94 -39.74 17.8 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.702 -0.624 . . . . 0.0 109.789 179.095 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.83 -38.48 79.86 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.666 -0.646 . . . . 0.0 110.599 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -57.35 -25.13 58.94 Favored 'General case' 0 N--CA 1.513 2.72 0 O-C-N 121.854 -0.529 . . . . 0.0 111.558 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -58.33 -58.42 8.56 Favored 'General case' 0 N--CA 1.509 2.51 0 CA-C-N 118.85 0.75 . . . . 0.0 109.013 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.3 p -73.94 -28.24 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.514 0 O-C-N 122.015 -0.428 . . . . 0.0 110.004 178.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -64.04 -25.36 68.08 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.618 -0.676 . . . . 0.0 110.753 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -88.36 48.84 1.69 Allowed 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.434 -0.791 . . . . 0.0 110.351 179.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -132.2 60.54 1.68 Allowed 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 179.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.738 HG12 ' HG ' ' A' ' 37' ' ' LEU . 40.0 t -123.25 -63.27 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.305 0 O-C-N 121.599 -0.688 . . . . 0.0 109.266 -179.154 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 57.92 38.76 27.03 Favored 'General case' 0 N--CA 1.514 2.73 0 CA-C-O 121.058 0.456 . . . . 0.0 111.415 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.738 ' HG ' HG12 ' A' ' 35' ' ' VAL . 2.1 pp -165.95 156.81 13.28 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.26 -0.9 . . . . 0.0 110.352 179.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.29 -73.89 1.66 Allowed Glycine 0 N--CA 1.502 3.063 0 N-CA-C 109.392 -1.483 . . . . 0.0 109.392 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.502 2.157 0 CA-C-O 118.694 -0.67 . . . . 0.0 109.829 179.445 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.452 ' HA ' HD22 ' A' ' 7' ' ' LEU . 67.8 m . . . . . 0 N--CA 1.498 1.93 0 CA-C-O 121.449 0.642 . . . . 0.0 109.699 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 2.0 m -143.44 -53.19 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.582 0 O-C-N 121.839 -0.538 . . . . 0.0 109.84 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 7.4 t -162.17 75.15 0.44 Allowed 'General case' 0 N--CA 1.504 2.244 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.406 ' OE2' HD13 ' A' ' 7' ' ' LEU . 2.5 mp0 -111.26 -4.36 14.99 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.708 -0.62 . . . . 0.0 111.622 -179.066 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.1 mt 73.63 -63.17 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.519 3.01 0 CA-C-N 119.158 0.89 . . . . 0.0 109.685 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -67.35 -36.45 81.44 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.707 -0.62 . . . . 0.0 110.065 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.452 HD22 ' HA ' ' A' ' 1' ' ' SER . 0.8 OUTLIER -61.9 -46.6 88.68 Favored 'General case' 0 N--CA 1.506 2.35 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.519 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.86 -40.06 91.31 Favored 'General case' 0 N--CA 1.509 2.497 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.117 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -58.72 -44.65 90.45 Favored 'General case' 0 N--CA 1.509 2.5 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 178.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.5 m-80 -98.02 66.98 1.89 Allowed 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.9 tp -153.12 73.98 1.01 Allowed 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.49 -0.756 . . . . 0.0 110.288 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -91.48 73.88 1.62 Allowed Glycine 0 N--CA 1.505 3.247 0 N-CA-C 108.429 -1.868 . . . . 0.0 108.429 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.0 mttp 69.2 -75.68 0.07 Allowed 'General case' 0 N--CA 1.516 2.869 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 -178.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 29.8 p80 -119.66 11.55 12.02 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.803 -0.561 . . . . 0.0 110.308 177.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.754 HD23 ' HG3' ' A' ' 20' ' ' ARG . 1.5 mp -94.5 89.87 5.99 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.307 -0.871 . . . . 0.0 109.245 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.1 m-80 -82.87 -60.59 2.12 Favored 'General case' 0 N--CA 1.503 2.191 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.511 -178.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.484 ' O ' HG12 ' A' ' 21' ' ' VAL . 17.1 p -149.66 -74.84 0.16 Allowed 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.195 -0.941 . . . . 0.0 111.301 -178.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 17.7 ptp -62.54 -38.38 89.77 Favored 'General case' 0 N--CA 1.517 2.909 0 CA-C-N 118.866 0.757 . . . . 0.0 110.892 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.643 ' HG3' ' HA ' ' A' ' 15' ' ' LEU . 1.2 pm0 -70.76 -25.08 62.75 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.815 -0.553 . . . . 0.0 110.219 178.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.754 ' HG3' HD23 ' A' ' 15' ' ' LEU . 33.7 ttp85 -84.26 -57.36 3.2 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.531 -0.73 . . . . 0.0 109.694 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.616 HG22 ' HD3' ' A' ' 25' ' ' ARG . 7.3 p -49.43 -42.2 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.808 -0.558 . . . . 0.0 110.727 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.405 ' N ' HG13 ' A' ' 21' ' ' VAL . 0.5 OUTLIER -71.84 -40.2 69.22 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.408 -0.807 . . . . 0.0 109.369 178.331 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.795 ' CZ3' HD13 ' A' ' 24' ' ' LEU . 2.2 t90 -52.61 -48.16 66.49 Favored 'General case' 0 N--CA 1.517 2.878 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 176.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.795 HD13 ' CZ3' ' A' ' 23' ' ' TRP . 3.7 mm? -74.68 -32.75 62.3 Favored 'General case' 0 N--CA 1.493 1.714 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.089 -178.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.616 ' HD3' HG22 ' A' ' 21' ' ' VAL . 4.7 mtp85 -67.96 -51.94 41.69 Favored 'General case' 0 N--CA 1.51 2.526 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.68 -48.46 63.88 Favored 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.494 ' HD2' ' CH2' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -56.02 -41.89 75.63 Favored 'General case' 0 N--CA 1.512 2.641 0 CA-C-N 118.1 0.409 . . . . 0.0 110.663 179.902 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.0 tt -63.55 -44.54 93.88 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.874 -0.516 . . . . 0.0 109.629 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -95.93 24.41 5.52 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.784 -0.572 . . . . 0.0 111.311 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.65 -51.12 7.55 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 120.998 -1.064 . . . . 0.0 108.339 178.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.492 HG21 ' HA3' ' A' ' 38' ' ' GLY . 3.4 t -99.58 -35.12 4.56 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.322 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 178.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 -61.76 -48.32 81.22 Favored 'General case' 0 N--CA 1.512 2.636 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 178.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -91.97 56.4 2.88 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 177.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -164.26 -57.7 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 -179.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 7.2 p -136.26 -53.69 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.205 0 O-C-N 122.036 -0.415 . . . . 0.0 110.303 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -179.58 -65.86 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.693 0 CA-C-N 119.225 0.921 . . . . 0.0 110.741 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -162.49 139.58 8.02 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.624 -0.673 . . . . 0.0 110.044 -178.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.492 ' HA3' HG21 ' A' ' 31' ' ' VAL . . . -125.28 63.14 0.58 Allowed Glycine 0 N--CA 1.505 3.246 0 N-CA-C 109.664 -1.375 . . . . 0.0 109.664 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.506 2.33 0 CA-C-O 117.732 -1.127 . . . . 0.0 110.043 -179.89 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 75.4 m . . . . . 0 N--CA 1.498 1.973 0 CA-C-O 121.393 0.616 . . . . 0.0 109.569 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.1 p -164.53 -47.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.511 0 O-C-N 121.86 -0.525 . . . . 0.0 110.255 -179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.1 t -144.07 74.72 1.43 Allowed 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -126.21 37.67 4.28 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.764 -0.585 . . . . 0.0 109.715 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.507 HG13 ' HB2' ' A' ' 9' ' ' HIS . 18.7 pt -73.5 -40.33 55.5 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.575 0 O-C-N 121.342 -0.849 . . . . 0.0 109.66 179.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 61.74 -77.43 0.03 OUTLIER 'General case' 0 N--CA 1.517 2.875 0 C-N-CA 123.167 0.587 . . . . 0.0 112.191 178.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.1 tt -59.68 -54.36 47.3 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.635 -0.666 . . . . 0.0 110.285 -179.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.498 ' HB2' ' HB ' ' A' ' 5' ' ' ILE . 6.0 mtt -59.57 -35.43 74.26 Favored 'General case' 0 N--CA 1.511 2.581 0 O-C-N 122.008 -0.433 . . . . 0.0 110.501 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.507 ' HB2' HG13 ' A' ' 5' ' ' ILE . 38.2 t-80 -65.67 -47.8 74.24 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.702 -0.624 . . . . 0.0 109.526 178.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -87.7 14.34 8.72 Favored 'General case' 0 N--CA 1.507 2.404 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.0 tp -97.82 52.84 1.09 Allowed 'General case' 0 N--CA 1.506 2.344 0 O-C-N 120.718 -1.239 . . . . 0.0 109.669 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 76.68 -82.86 1.05 Allowed Glycine 0 N--CA 1.502 3.039 0 N-CA-C 109.156 -1.578 . . . . 0.0 109.156 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.42 -95.35 0.05 Allowed 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 123.021 0.528 . . . . 0.0 110.962 179.129 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.69 10.54 2.24 Favored 'General case' 0 N--CA 1.508 2.434 0 CA-C-N 119.426 1.012 . . . . 0.0 111.784 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.682 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 5.7 mp 52.86 64.86 1.7 Allowed 'General case' 0 N--CA 1.508 2.432 0 CA-C-O 122.483 1.135 . . . . 0.0 109.737 -179.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -85.69 -52.42 5.8 Favored 'General case' 0 N--CA 1.502 2.129 0 CA-C-N 115.019 -0.991 . . . . 0.0 110.079 -178.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -156.52 -59.05 0.09 Allowed 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.881 -0.512 . . . . 0.0 110.188 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -28.34 69.55 Favored 'General case' 0 N--CA 1.514 2.748 0 O-C-N 122.0 -0.438 . . . . 0.0 111.746 -179.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.682 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 1.5 mp0 -87.62 -48.13 8.14 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.474 -0.766 . . . . 0.0 109.607 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.474 ' HA ' ' HB3' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -72.59 -20.18 61.34 Favored 'General case' 0 N--CA 1.512 2.642 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -179.442 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.7 p -66.72 -40.84 87.0 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.534 0 CA-C-N 119.722 1.146 . . . . 0.0 108.147 177.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.425 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 23.3 mm-40 -74.81 -37.4 62.34 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.57 ' CD1' HD23 ' A' ' 15' ' ' LEU . 0.0 OUTLIER -61.3 -47.72 84.67 Favored 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 106.946 -1.502 . . . . 0.0 106.946 177.217 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.456 HD13 ' HD2' ' A' ' 27' ' ' LYS . 2.8 mm? -63.76 -30.56 71.64 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.724 -0.61 . . . . 0.0 111.381 177.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.425 ' HD2' ' HA ' ' A' ' 22' ' ' GLU . 0.2 OUTLIER -56.71 -40.17 75.17 Favored 'General case' 0 N--CA 1.51 2.566 0 CA-C-N 118.895 0.77 . . . . 0.0 109.189 179.295 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.413 ' N ' ' HG2' ' A' ' 25' ' ' ARG . 13.1 ttpp -78.88 -41.5 29.66 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.456 ' HD2' HD13 ' A' ' 24' ' ' LEU . 25.6 tttm -51.45 -40.7 59.95 Favored 'General case' 0 N--CA 1.515 2.799 0 C-N-CA 122.443 0.297 . . . . 0.0 110.687 178.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.6 mt -58.69 -44.68 90.37 Favored 'General case' 0 N--CA 1.509 2.476 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -70.82 -39.07 73.24 Favored 'General case' 0 N--CA 1.504 2.261 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 178.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -59.77 -50.6 73.2 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.832 -0.543 . . . . 0.0 109.696 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 86.1 t -64.8 -36.3 77.27 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.541 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -60.71 -46.15 91.49 Favored 'General case' 0 N--CA 1.508 2.446 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -68.63 -37.27 79.58 Favored 'General case' 0 N--CA 1.505 2.317 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -74.74 -177.61 3.3 Favored 'General case' 0 N--CA 1.504 2.271 0 CA-C-O 121.208 0.528 . . . . 0.0 110.06 178.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 11.9 t -104.53 53.86 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.224 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 62.27 49.51 4.26 Favored 'General case' 0 N--CA 1.51 2.527 0 CA-C-O 121.561 0.696 . . . . 0.0 109.446 -178.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.4 mt -106.98 141.55 38.02 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.62 -0.675 . . . . 0.0 110.137 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.2 -60.98 0.32 Allowed Glycine 0 N--CA 1.503 3.155 0 N-CA-C 109.684 -1.366 . . . . 0.0 109.684 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.503 2.187 0 CA-C-O 117.611 -1.185 . . . . 0.0 109.804 179.533 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 38.6 m . . . . . 0 N--CA 1.5 2.049 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.9 p -84.3 -38.55 13.83 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.673 -0.642 . . . . 0.0 110.077 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 28.6 t -90.86 -62.16 1.51 Allowed 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 179.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 175.67 -50.72 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.365 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 5.6 tt 45.06 31.75 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.522 3.173 0 C-N-CA 123.637 0.775 . . . . 0.0 112.856 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -103.22 -45.1 5.0 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 121.015 -1.053 . . . . 0.0 108.99 178.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.846 ' HB3' HD12 ' A' ' 11' ' ' LEU . 79.1 mt -63.2 -29.82 71.08 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 122.077 -0.39 . . . . 0.0 110.267 178.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 44.6 mmm -58.04 -42.95 86.49 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.665 -0.647 . . . . 0.0 109.504 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 24.8 t60 -76.42 -49.05 17.7 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 178.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -134.4 101.4 4.98 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.846 HD12 ' HB3' ' A' ' 7' ' ' LEU . 1.9 tp -80.73 77.9 7.54 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 -179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 70.14 44.3 60.94 Favored Glycine 0 N--CA 1.504 3.219 0 N-CA-C 109.097 -1.601 . . . . 0.0 109.097 -178.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 67.73 -80.32 0.03 OUTLIER 'General case' 0 N--CA 1.511 2.587 0 CA-C-N 117.391 0.595 . . . . 0.0 109.801 -178.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 -163.79 100.74 0.89 Allowed 'General case' 0 N--CA 1.503 2.213 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.428 ' HB2' ' HB2' ' A' ' 20' ' ' ARG . 24.1 mt -134.5 -157.41 0.8 Allowed 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 -179.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -175.17 115.05 0.15 Allowed 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.255 -0.903 . . . . 0.0 110.955 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.454 ' O ' HG12 ' A' ' 21' ' ' VAL . 71.6 m 46.12 -102.95 0.07 Allowed 'General case' 0 N--CA 1.52 3.054 0 C-N-CA 123.167 0.587 . . . . 0.0 112.357 177.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.546 ' HA ' ' CG1' ' A' ' 21' ' ' VAL . 50.3 mtp -63.47 -35.63 81.08 Favored 'General case' 0 N--CA 1.516 2.833 0 CA-C-N 119.488 1.04 . . . . 0.0 110.342 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' A' ' 23' ' ' TRP . 1.7 mp0 -67.56 -20.84 65.45 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 178.132 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HA ' ' CD1' ' A' ' 23' ' ' TRP . 0.0 OUTLIER -114.15 39.28 2.78 Favored 'General case' 0 N--CA 1.503 2.2 0 CA-C-O 122.113 0.959 . . . . 0.0 110.487 179.238 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.546 ' CG1' ' HA ' ' A' ' 18' ' ' MET . 3.4 p -146.47 -51.26 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.515 2.776 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 176.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -68.04 -26.6 65.95 Favored 'General case' 0 N--CA 1.509 2.48 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 174.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.687 ' CH2' ' HE2' ' A' ' 27' ' ' LYS . 2.8 p-90 -56.09 -37.71 69.72 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 122.087 -0.383 . . . . 0.0 110.241 178.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.949 HD23 ' HD2' ' A' ' 27' ' ' LYS . 30.3 mt -77.65 -29.74 51.78 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 122.126 -0.359 . . . . 0.0 110.427 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.5 ttm105 -58.88 -43.49 90.91 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.885 -0.509 . . . . 0.0 110.114 179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.06 -43.32 13.2 Favored 'General case' 0 N--CA 1.506 2.357 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 177.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.949 ' HD2' HD23 ' A' ' 24' ' ' LEU . 0.1 OUTLIER -52.1 -43.56 63.98 Favored 'General case' 0 N--CA 1.517 2.89 0 O-C-N 122.079 -0.388 . . . . 0.0 110.57 179.362 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.4 tp -69.05 -43.08 75.37 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.556 -0.715 . . . . 0.0 109.724 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 62.4 mm-40 -95.88 28.97 2.86 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.74 -0.6 . . . . 0.0 110.443 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.78 -57.2 3.42 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 178.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.1 t -63.16 -35.74 73.11 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.543 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 32.0 m-70 -62.74 -43.56 98.48 Favored 'General case' 0 N--CA 1.507 2.419 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 178.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -110.77 65.68 0.62 Allowed 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -133.46 130.29 38.4 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.552 -0.717 . . . . 0.0 109.862 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 78.5 t -132.16 -63.88 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -159.56 -59.94 0.07 Allowed 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.843 -0.535 . . . . 0.0 110.009 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 tt -90.69 112.55 24.35 Favored 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -115.36 59.62 0.42 Allowed Glycine 0 N--CA 1.503 3.102 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.505 2.294 0 CA-C-O 117.735 -1.126 . . . . 0.0 110.098 -179.771 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 30.7 p . . . . . 0 N--CA 1.503 2.206 0 CA-C-O 120.849 0.357 . . . . 0.0 110.221 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 3.0 m -128.02 100.44 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.417 0 CA-C-O 121.362 0.601 . . . . 0.0 109.449 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.7 t -104.58 93.21 4.65 Favored 'General case' 0 N--CA 1.502 2.16 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -171.43 -34.12 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.776 0 O-C-N 121.973 -0.454 . . . . 0.0 111.971 -179.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.7 mt 81.61 -49.2 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.526 3.33 0 CA-C-N 118.946 0.793 . . . . 0.0 110.65 -179.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -27.4 63.74 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 121.533 -0.729 . . . . 0.0 111.8 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.01 -48.84 72.82 Favored 'General case' 0 N--CA 1.51 2.569 0 CA-C-N 118.74 0.7 . . . . 0.0 109.59 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.66 -41.37 38.46 Favored 'General case' 0 N--CA 1.502 2.129 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 177.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.423 ' C ' ' HB3' ' A' ' 13' ' ' LYS . 17.6 t-80 -84.46 70.76 10.73 Favored 'General case' 0 N--CA 1.5 2.072 0 CA-C-O 121.692 0.758 . . . . 0.0 109.627 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -159.44 -60.3 0.07 Allowed 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.511 -0.743 . . . . 0.0 109.609 179.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 13.8 tp -73.57 -49.61 25.46 Favored 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -117.44 38.23 3.04 Favored Glycine 0 N--CA 1.501 2.992 0 N-CA-C 109.986 -1.246 . . . . 0.0 109.986 178.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.423 ' HB3' ' C ' ' A' ' 9' ' ' HIS . 7.8 pttm -65.88 -43.09 89.33 Favored 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 118.037 0.919 . . . . 0.0 110.122 179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 48.8 m-70 -126.93 35.57 4.58 Favored 'General case' 0 N--CA 1.505 2.288 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.843 HD13 ' HA ' ' A' ' 20' ' ' ARG . 56.3 mt -141.57 120.05 12.39 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -86.76 69.98 10.34 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 122.051 -0.406 . . . . 0.0 110.673 -178.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 24.6 m 60.64 -79.08 0.02 OUTLIER 'General case' 0 N--CA 1.519 3.008 0 C-N-CA 123.217 0.607 . . . . 0.0 111.783 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 39.0 mmm -64.19 -34.97 79.29 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.552 -0.718 . . . . 0.0 110.107 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.469 ' O ' HD22 ' A' ' 15' ' ' LEU . 0.4 OUTLIER -66.04 -28.67 69.03 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.31 -0.869 . . . . 0.0 109.173 177.567 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.843 ' HA ' HD13 ' A' ' 15' ' ' LEU . 2.6 ttm-85 -66.37 -63.92 0.97 Allowed 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 178.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.9 p -53.16 -37.97 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 177.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.37 -40.73 85.78 Favored 'General case' 0 N--CA 1.505 2.321 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.436 ' CE3' HD22 ' A' ' 24' ' ' LEU . 3.4 t90 -55.35 -39.99 70.71 Favored 'General case' 0 N--CA 1.51 2.568 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.436 HD22 ' CE3' ' A' ' 23' ' ' TRP . 2.0 mm? -67.21 -47.82 69.7 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 179.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -60.72 -40.65 93.09 Favored 'General case' 0 N--CA 1.51 2.532 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.66 -41.24 98.23 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 178.047 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.464 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 2.0 tppm? -57.87 -42.81 85.32 Favored 'General case' 0 N--CA 1.503 2.213 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 179.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.471 HD13 ' HA ' ' A' ' 28' ' ' LEU . 4.2 mm? -70.34 -41.6 72.98 Favored 'General case' 0 N--CA 1.506 2.354 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 177.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -92.87 33.92 1.13 Allowed 'General case' 0 N--CA 1.501 2.124 0 O-C-N 122.04 -0.412 . . . . 0.0 110.231 178.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -94.68 -51.47 4.71 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 120.967 -1.083 . . . . 0.0 109.641 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.8 t -141.72 63.65 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.406 0 CA-C-O 121.807 0.813 . . . . 0.0 108.913 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -85.58 62.44 7.47 Favored 'General case' 0 N--CA 1.509 2.512 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 178.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 59.3 m-80 77.1 -58.8 0.49 Allowed 'General case' 0 N--CA 1.515 2.787 0 C-N-CA 123.567 0.747 . . . . 0.0 109.419 -177.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.415 ' O ' HG13 ' A' ' 35' ' ' VAL . 8.3 m-85 63.13 4.15 1.5 Allowed 'General case' 0 N--CA 1.514 2.741 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -179.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.415 HG13 ' O ' ' A' ' 34' ' ' PHE . 2.0 m -157.39 43.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.514 2.747 0 O-C-N 121.083 -1.01 . . . . 0.0 109.127 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -138.33 77.05 1.61 Allowed 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.295 -0.878 . . . . 0.0 109.851 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.7 mp 63.25 -83.01 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.778 0 C-N-CA 123.017 0.527 . . . . 0.0 110.819 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -105.32 -47.93 1.1 Allowed Glycine 0 N--CA 1.503 3.115 0 N-CA-C 110.04 -1.224 . . . . 0.0 110.04 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.504 2.248 0 CA-C-N 117.884 0.842 . . . . 0.0 110.085 -179.787 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.7 t . . . . . 0 N--CA 1.5 2.074 0 CA-C-O 120.822 0.344 . . . . 0.0 110.256 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 17.9 m -127.12 143.51 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 179.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.2 t 69.74 166.6 0.28 Allowed 'General case' 0 N--CA 1.515 2.786 0 CA-C-O 121.421 0.629 . . . . 0.0 110.937 -179.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -110.09 32.36 5.18 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.626 -0.671 . . . . 0.0 109.989 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 5.6 tp -60.8 -32.44 52.06 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.6 0 O-C-N 121.329 -0.857 . . . . 0.0 110.078 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -68.39 -45.96 71.31 Favored 'General case' 0 N--CA 1.51 2.528 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 178.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -67.4 -36.48 81.37 Favored 'General case' 0 N--CA 1.508 2.43 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 178.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.447 ' HB3' ' HA ' ' A' ' 16' ' ' ASN . 48.6 mtt -71.11 -31.99 68.47 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 122.037 -0.414 . . . . 0.0 110.575 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 -78.6 -45.35 21.86 Favored 'General case' 0 N--CA 1.502 2.173 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 179.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -66.62 -56.62 9.85 Favored 'General case' 0 N--CA 1.505 2.32 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.465 HD22 ' HA ' ' A' ' 11' ' ' LEU . 0.3 OUTLIER -99.46 114.54 27.55 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 178.171 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 110.86 -55.55 0.5 Allowed Glycine 0 N--CA 1.501 3.028 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 70.89 -71.92 0.12 Allowed 'General case' 0 N--CA 1.513 2.691 0 C-N-CA 123.161 0.584 . . . . 0.0 110.529 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -114.76 52.23 0.86 Allowed 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.503 -0.748 . . . . 0.0 109.126 179.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.484 ' HB2' ' HB3' ' A' ' 19' ' ' GLU . 0.9 OUTLIER -132.5 -61.36 0.86 Allowed 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.525 -0.734 . . . . 0.0 109.586 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.447 ' HA ' ' HB3' ' A' ' 8' ' ' MET . 17.6 m120 61.69 92.87 0.05 Allowed 'General case' 0 N--CA 1.513 2.697 0 C-N-CA 122.852 0.461 . . . . 0.0 110.093 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.446 ' O ' HG12 ' A' ' 21' ' ' VAL . 16.0 m 81.16 -48.15 0.26 Allowed 'General case' 0 N--CA 1.521 3.086 0 C-N-CA 123.791 0.836 . . . . 0.0 109.991 -178.429 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.575 ' HA ' ' CG1' ' A' ' 21' ' ' VAL . 22.5 mmm -66.6 -20.53 66.02 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.555 -0.716 . . . . 0.0 111.357 179.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.484 ' HB3' ' HB2' ' A' ' 15' ' ' LEU . 0.1 OUTLIER -66.87 -8.68 30.81 Favored 'General case' 0 N--CA 1.514 2.73 0 CA-C-N 119.406 1.003 . . . . 0.0 110.773 177.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -128.48 29.59 5.28 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.354 -0.841 . . . . 0.0 109.851 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.575 ' CG1' ' HA ' ' A' ' 18' ' ' MET . 3.4 p -157.21 -59.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.5 0 O-C-N 120.998 -1.064 . . . . 0.0 108.434 179.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.537 ' H ' HG13 ' A' ' 21' ' ' VAL . 0.9 OUTLIER -75.0 -32.17 61.58 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 107.362 -1.348 . . . . 0.0 107.362 175.602 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 8.4 t90 -50.72 -43.41 57.92 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.499 HD22 ' N ' ' A' ' 24' ' ' LEU . 2.9 mm? -62.85 -44.81 95.14 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -178.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.83 -32.78 74.64 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.992 -0.442 . . . . 0.0 110.147 178.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.0 mtmm -75.08 -44.29 48.31 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.81 -42.14 83.64 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 21.0 mt -68.42 -34.44 76.01 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 122.011 -0.43 . . . . 0.0 110.294 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.38 4.96 18.96 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.709 -0.619 . . . . 0.0 112.227 179.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.25 -54.94 41.15 Favored 'General case' 0 N--CA 1.511 2.585 0 CA-C-N 119.463 1.029 . . . . 0.0 110.498 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 47.1 t -67.61 -39.97 83.27 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.715 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.607 ' HE1' ' HB3' ' A' ' 39' ' ' ALA . 38.1 t-80 -60.29 -35.87 76.56 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 122.003 -0.435 . . . . 0.0 110.61 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -90.33 -23.5 21.12 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 121.621 -0.674 . . . . 0.0 111.195 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -77.84 86.06 4.1 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.47 -0.769 . . . . 0.0 111.078 -178.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.0 t 50.15 51.1 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.517 2.918 0 CA-C-O 121.37 0.605 . . . . 0.0 110.98 178.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -135.72 -58.05 0.77 Allowed 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.324 -0.86 . . . . 0.0 109.484 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.7 tt -149.91 -62.33 0.21 Allowed 'General case' 0 N--CA 1.503 2.212 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 96.97 82.87 1.66 Allowed Glycine 0 N--CA 1.5 2.943 0 N-CA-C 110.229 -1.148 . . . . 0.0 110.229 179.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.607 ' HB3' ' HE1' ' A' ' 32' ' ' HIS . . . . . . . . 0 N--CA 1.511 2.576 0 CA-C-O 118.716 -0.659 . . . . 0.0 109.864 179.374 . . . . . . . . 1 1 . 1 stop_ save_