data_1scy_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 1scy _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.966 0.412 . . . . 0.0 110.387 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.6 tp -53.93 -37.03 63.43 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.94 0.896 . . . . 0.0 112.103 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 72.6 ttt-85 -64.61 -48.84 73.42 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 119.62 1.1 . . . . 0.0 109.596 -178.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -61.95 -46.2 90.35 Favored 'General case' 0 N--CA 1.457 -0.117 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.4 t -56.42 -52.52 64.34 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 110.428 -0.212 . . . . 0.0 110.428 -178.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -51.49 -49.95 60.83 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 118.314 -0.851 . . . . 0.0 110.422 173.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.7 tp -58.28 -52.41 65.69 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 119.236 0.925 . . . . 0.0 110.909 -177.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.8 m -64.69 -42.84 95.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.535 0.683 . . . . 0.0 109.458 -172.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.5 m -64.29 -43.1 95.81 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 175.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -32.01 73.18 Favored 'General case' 0 C--O 1.226 -0.146 0 N-CA-C 107.165 -1.421 . . . . 0.0 107.165 -170.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.0 m -56.37 -33.41 65.69 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.142 0.428 . . . . 0.0 111.162 173.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 40.3 mt -91.86 12.29 22.05 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.9 0.88 . . . . 0.0 110.764 174.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.39 -20.61 36.6 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 125.139 1.352 . . . . 0.0 112.533 -177.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.0 mt -83.47 178.01 8.2 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.389 -1.065 . . . . 0.0 110.294 -152.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 13.3 tp -109.24 94.83 5.25 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.983 2.513 . . . . 0.0 107.347 -177.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -64.51 130.5 37.44 Favored Glycine 0 CA--C 1.523 0.534 0 CA-C-O 119.431 -0.65 . . . . 0.0 111.794 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.91 138.68 42.64 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 168.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -111.81 108.02 17.28 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 119.263 -0.399 . . . . 0.0 110.588 -155.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.5 mt -86.17 161.63 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -172.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -40.07 -49.97 3.52 Favored Glycine 0 CA--C 1.525 0.682 0 C-N-CA 125.283 1.421 . . . . 0.0 113.908 -172.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.74 -46.21 14.57 Favored 'General case' 0 N--CA 1.44 -0.941 0 C-N-CA 126.137 1.775 . . . . 0.0 108.875 -176.068 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -156.68 159.73 38.67 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -156.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 18.0 t -71.59 141.51 50.03 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.92 0.888 . . . . 0.0 111.173 175.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -127.67 172.6 10.63 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 167.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.5 m -145.01 97.36 3.0 Favored 'General case' 0 C--N 1.334 -0.068 0 C-N-CA 126.443 1.897 . . . . 0.0 107.241 -167.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -74.94 164.62 3.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 169.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.2 tttt . . . . . 0 N--CA 1.436 -1.147 0 O-C-N 121.342 -0.849 . . . . 0.0 110.196 178.249 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.5 t30 . . . . . 0 N--CA 1.45 -0.463 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 45.7 tp -46.08 -47.25 17.2 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.567 1.147 . . . . 0.0 112.084 174.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.1 ttm180 -60.19 -46.78 88.55 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.771 0.319 . . . . 0.0 110.22 -169.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 16.8 tmm? -67.9 -45.73 73.61 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 123.288 0.635 . . . . 0.0 109.342 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.1 t -53.97 -42.69 69.24 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.658 0.742 . . . . 0.0 111.231 -175.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -51.1 -33.73 27.4 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.918 1.287 . . . . 0.0 112.636 173.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.57 -46.35 59.66 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 123.886 0.874 . . . . 0.0 109.295 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.2 m -64.56 -53.28 50.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -176.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 97.2 m -64.8 -28.4 69.54 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.9 1.28 . . . . 0.0 110.943 -174.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.1 ttm105 -59.03 -20.16 50.56 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 117.938 -1.03 . . . . 0.0 111.123 177.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.6 p -50.53 -47.88 57.36 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 120.112 1.324 . . . . 0.0 110.899 175.158 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 81.9 mt -100.03 22.34 11.42 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.58 0.752 . . . . 0.0 109.424 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.12 20.25 60.22 Favored Glycine 0 C--N 1.334 0.463 0 C-N-CA 123.873 0.749 . . . . 0.0 113.042 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 33.5 mt -84.72 145.46 27.92 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.6 tt -76.68 97.85 4.57 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 105.237 -2.135 . . . . 0.0 105.237 175.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.5 148.12 48.03 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.715 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.443 ' NZ ' ' OE2' ' A' ' 27' ' ' GLU . 14.8 tptp -165.38 94.39 0.62 Allowed 'General case' 0 N--CA 1.425 -1.696 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 -140.408 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.7 t -74.53 116.62 15.42 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.243 -1.536 . . . . 0.0 110.973 -176.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 11.6 mm -84.68 161.24 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 162.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -25.31 -69.27 0.04 OUTLIER Glycine 0 CA--C 1.529 0.91 0 C-N-CA 125.886 1.708 . . . . 0.0 114.291 -169.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.73 -44.0 12.9 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 127.995 2.518 . . . . 0.0 108.928 179.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.1 mttm -108.78 129.38 55.38 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.006 0.522 . . . . 0.0 109.64 -151.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.3 t -65.04 118.91 9.83 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 164.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.443 ' OE2' ' NZ ' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -120.74 172.2 8.05 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 179.445 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 24.6 m -146.38 114.28 6.51 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 -165.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.5 m -103.03 145.46 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 171.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.7 tttm . . . . . 0 N--CA 1.437 -1.111 0 O-C-N 121.134 -0.979 . . . . 0.0 109.722 -178.448 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 64.3 t-20 . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 121.119 0.485 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.5 tp -49.63 -38.36 31.73 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.895 1.278 . . . . 0.0 112.148 176.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -64.54 -49.8 69.84 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.388 -0.82 . . . . 0.0 109.91 -177.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -65.42 -46.29 80.56 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.4 t -46.53 -50.81 16.64 Favored 'General case' 0 C--O 1.226 -0.139 0 C-N-CA 123.53 0.732 . . . . 0.0 109.846 178.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -58.27 -37.08 74.27 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 123.773 0.829 . . . . 0.0 112.94 177.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.8 tp -66.39 -45.73 79.02 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 119.799 1.181 . . . . 0.0 110.708 176.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.43 -45.49 87.3 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.3 m -63.45 -42.06 98.65 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.29 -31.91 70.7 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.5 m -71.52 -18.77 62.25 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 121.111 -0.993 . . . . 0.0 113.298 176.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 46.0 mt -93.85 6.21 49.14 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.892 0.877 . . . . 0.0 110.686 165.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.15 9.08 87.23 Favored Glycine 0 CA--C 1.527 0.822 0 O-C-N 120.743 -1.223 . . . . 0.0 113.126 -177.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 33.7 mt -105.15 148.92 26.36 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.267 1.427 . . . . 0.0 111.431 -171.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -79.6 124.09 28.21 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 127.145 2.178 . . . . 0.0 107.264 171.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -87.94 131.07 10.42 Favored Glycine 0 CA--C 1.525 0.711 0 CA-C-N 118.052 0.387 . . . . 0.0 112.945 -177.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -113.43 166.03 11.89 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 128.147 2.579 . . . . 0.0 109.09 175.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 33.4 t -119.4 130.18 55.18 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 169.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 4.5 mt -105.18 161.61 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 N-CA-C 105.804 -1.924 . . . . 0.0 105.804 161.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -46.33 -43.53 14.41 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 123.754 0.692 . . . . 0.0 113.531 -173.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -75.05 -47.0 31.12 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 126.383 1.873 . . . . 0.0 108.873 -175.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -156.51 164.01 38.72 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -153.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 14.7 t -64.73 138.0 58.13 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.617 1.167 . . . . 0.0 109.406 164.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.16 170.1 8.53 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 164.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 77.2 m -145.5 124.77 12.97 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 178.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.3 m -128.73 150.11 34.09 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.566 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 172.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.436 -1.142 0 O-C-N 120.732 -1.23 . . . . 0.0 111.598 -168.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.3 t30 . . . . . 0 N--CA 1.455 -0.182 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.6 tp -59.2 -35.33 73.41 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.82 0.848 . . . . 0.0 112.204 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -56.08 24.08 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 121.15 -0.969 . . . . 0.0 110.551 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 15.6 tmm? -54.58 -45.7 73.6 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 177.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.8 t -57.65 -57.52 12.38 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.85 -174.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -58.9 -40.06 83.33 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 122.09 -0.381 . . . . 0.0 110.737 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -57.13 -40.13 76.54 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 121.626 -0.671 . . . . 0.0 110.972 176.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.4 t -68.15 -51.67 43.36 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 176.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.6 m -64.15 -29.4 70.52 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.485 1.114 . . . . 0.0 110.82 -171.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.16 -46.37 12.01 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.512 1.125 . . . . 0.0 109.505 169.288 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -56.91 -28.29 61.78 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.105 0.411 . . . . 0.0 112.102 -175.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 mt -105.33 5.86 32.24 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 124.088 0.955 . . . . 0.0 111.15 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 56.2 52.59 48.54 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 -176.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 38.3 mt -126.75 142.27 51.59 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 125.415 1.486 . . . . 0.0 108.056 175.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.0 tt -76.39 109.64 10.26 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 105.704 -1.961 . . . . 0.0 105.704 170.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.27 134.07 28.75 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 177.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.47 165.39 21.71 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 167.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.7 t -132.07 102.98 6.03 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 122.075 -0.391 . . . . 0.0 110.013 -157.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.6 mt -82.99 161.31 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 N-CA-C 104.657 -2.349 . . . . 0.0 104.657 175.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -40.31 -55.6 3.01 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 123.966 0.793 . . . . 0.0 112.577 -166.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.03 -44.51 15.13 Favored 'General case' 0 N--CA 1.439 -0.988 0 C-N-CA 128.411 2.684 . . . . 0.0 107.697 -176.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -122.79 127.96 49.8 Favored 'General case' 0 C--N 1.334 -0.08 0 C-N-CA 124.037 0.935 . . . . 0.0 110.181 -145.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.6 t -64.62 140.89 58.91 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 161.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -140.29 172.09 13.23 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 106.857 -1.535 . . . . 0.0 106.857 167.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 65.7 m -145.83 108.69 4.54 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 -162.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.2 m -110.16 146.67 15.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 123.706 0.802 . . . . 0.0 109.727 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.6 tttp . . . . . 0 N--CA 1.445 -0.717 0 O-C-N 120.955 -1.091 . . . . 0.0 109.667 176.462 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.5 t30 . . . . . 0 N--CA 1.457 -0.096 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 38.4 tp -58.31 -38.48 77.18 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.414 0.686 . . . . 0.0 111.9 -178.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -51.33 69.52 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.555 0.616 . . . . 0.0 110.008 -178.391 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.0 -49.76 75.74 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.4 t -50.75 -52.71 37.94 Favored 'General case' 0 N--CA 1.46 0.055 0 CA-C-O 121.791 0.805 . . . . 0.0 110.337 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -60.19 -39.3 86.04 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 123.176 0.59 . . . . 0.0 111.284 177.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 40.5 tp -60.32 -43.24 96.54 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.676 -0.64 . . . . 0.0 111.204 176.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.78 -44.74 84.88 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.26 -0.9 . . . . 0.0 109.779 175.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -64.07 -36.04 82.7 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.538 0.335 . . . . 0.0 110.316 -173.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.4 ttt85 -45.13 -37.07 4.07 Favored 'General case' 0 C--N 1.341 0.211 0 C-N-CA 124.237 1.015 . . . . 0.0 111.163 170.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.3 t -55.81 -33.07 64.11 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.699 0.681 . . . . 0.0 111.027 -175.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.0 mt -107.64 15.38 24.75 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.778 0.831 . . . . 0.0 110.615 178.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.26 24.97 66.03 Favored Glycine 0 CA--C 1.524 0.624 0 O-C-N 121.387 -0.821 . . . . 0.0 113.152 -178.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 57.6 mt -98.81 162.37 13.14 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 123.78 0.832 . . . . 0.0 109.505 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 tt -105.51 104.43 14.16 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.99 1.716 . . . . 0.0 107.687 -174.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.96 123.79 31.02 Favored Glycine 0 CA--C 1.524 0.641 0 CA-C-O 119.306 -0.719 . . . . 0.0 112.148 -178.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.458 ' NZ ' ' OE1' ' A' ' 27' ' ' GLU . 2.2 pptp? -135.77 130.82 34.66 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 170.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 21.6 t -102.48 119.91 39.63 Favored 'General case' 0 N--CA 1.461 0.079 0 N-CA-C 112.486 0.551 . . . . 0.0 112.486 -166.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 13.5 mt -84.11 66.99 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 C-N-CA 125.591 1.556 . . . . 0.0 106.838 176.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.14 -84.1 0.51 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 125.524 1.535 . . . . 0.0 110.339 174.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.06 -45.44 18.31 Favored 'General case' 0 N--CA 1.44 -0.938 0 C-N-CA 125.61 1.564 . . . . 0.0 107.186 175.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.4 mttp -95.23 115.88 28.01 Favored 'General case' 0 C--O 1.227 -0.094 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 -155.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 20.1 t -64.53 119.05 9.72 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 165.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.458 ' OE1' ' NZ ' ' A' ' 20' ' ' LYS . 1.3 tm-20 -109.18 173.8 6.16 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 165.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 99.0 m -145.75 83.37 1.65 Allowed 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.616 1.567 . . . . 0.0 107.524 -167.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.4 m -76.46 144.25 12.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 C-N-CA 119.489 -0.884 . . . . 0.0 109.058 -173.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp . . . . . 0 N--CA 1.429 -1.489 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 175.15 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 . . . . . 0 C--O 1.23 0.049 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 35.7 tp -50.04 -35.77 26.27 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.77 1.228 . . . . 0.0 112.112 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.7 mmm-85 -67.45 -46.1 74.05 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.253 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -62.91 -46.61 87.02 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 35.9 t -47.84 -52.66 18.21 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.714 0.769 . . . . 0.0 109.783 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -61.04 -32.8 72.41 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 123.65 0.78 . . . . 0.0 112.242 177.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 37.2 tp -66.4 -44.06 84.09 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.805 1.184 . . . . 0.0 111.126 175.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.31 -43.29 95.17 Favored 'General case' 0 C--N 1.332 -0.189 0 O-C-N 120.997 -1.064 . . . . 0.0 108.875 176.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 65.2 m -64.38 -40.63 96.21 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.952 -0.547 . . . . 0.0 109.576 -177.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.6 ttt85 -47.56 -49.49 26.37 Favored 'General case' 0 C--N 1.343 0.29 0 CA-C-N 119.261 0.937 . . . . 0.0 109.961 168.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.9 m -59.77 -31.25 69.5 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.837 -0.125 . . . . 0.0 110.917 -175.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 53.6 mt -89.61 -1.88 58.15 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.697 0.799 . . . . 0.0 112.304 175.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.13 28.89 70.98 Favored Glycine 0 CA--C 1.526 0.765 0 O-C-N 120.657 -1.277 . . . . 0.0 112.511 -177.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 52.2 mt -117.64 177.43 4.76 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 126.797 2.039 . . . . 0.0 108.474 -179.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -122.02 111.43 17.03 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 126.961 2.105 . . . . 0.0 107.445 -171.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -73.28 119.65 6.77 Favored Glycine 0 CA--C 1.523 0.534 0 CA-C-O 119.321 -0.711 . . . . 0.0 111.589 -174.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -137.19 149.39 47.2 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 170.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -123.88 121.02 34.26 Favored 'General case' 0 N--CA 1.462 0.126 0 O-C-N 121.327 -0.858 . . . . 0.0 112.978 -159.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.1 mm -84.5 67.03 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 175.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.08 -88.06 0.19 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 126.539 2.019 . . . . 0.0 110.674 173.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.56 -29.83 56.81 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.7 mttp -108.7 108.05 18.74 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.238 1.015 . . . . 0.0 109.789 -159.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.3 t -64.09 131.59 47.99 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 165.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -132.54 172.97 11.82 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 106.033 -1.839 . . . . 0.0 106.033 166.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 79.6 m -131.42 88.38 2.58 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 126.789 2.036 . . . . 0.0 106.157 -170.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.5 m -71.54 164.82 3.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 173.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.4 tptp . . . . . 0 N--CA 1.433 -1.322 0 O-C-N 120.778 -1.201 . . . . 0.0 110.476 179.688 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 . . . . . 0 N--CA 1.454 -0.258 0 N-CA-C 108.512 -0.922 . . . . 0.0 108.512 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 44.1 tp -34.96 -53.42 0.57 Allowed 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 125.235 1.414 . . . . 0.0 114.672 -171.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 -45.99 -47.42 16.72 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-N 118.358 0.526 . . . . 0.0 111.813 -176.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 49.8 ttm -63.75 -53.41 51.47 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 -176.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.8 t -49.83 -54.69 17.77 Favored 'General case' 0 C--O 1.231 0.087 0 CA-C-O 121.593 0.711 . . . . 0.0 110.705 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -49.48 -51.54 35.39 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 125.401 1.481 . . . . 0.0 110.324 176.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 47.2 tp -61.5 -47.78 84.05 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.092 0.557 . . . . 0.0 111.051 -177.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 p -64.52 -47.53 78.49 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -175.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.1 m -64.41 -39.84 94.62 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -178.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.48 -38.76 75.06 Favored 'General case' 0 C--O 1.228 -0.074 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 m -63.61 -28.51 69.97 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.063 -0.398 . . . . 0.0 111.591 178.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 43.0 mt -88.24 3.52 49.16 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.889 0.876 . . . . 0.0 111.302 171.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 69.92 29.59 70.76 Favored Glycine 0 C--N 1.336 0.533 0 O-C-N 120.988 -1.07 . . . . 0.0 112.227 -177.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 70.6 mt -118.37 152.69 35.35 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 125.917 1.687 . . . . 0.0 109.064 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.0 tp -85.93 96.73 9.9 Favored 'General case' 0 N--CA 1.442 -0.835 0 C-N-CA 127.067 2.147 . . . . 0.0 106.86 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -65.91 114.4 6.56 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.483 -0.865 . . . . 0.0 111.264 -178.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.64 112.77 25.28 Favored 'General case' 0 N--CA 1.438 -1.072 0 N-CA-C 104.881 -2.266 . . . . 0.0 104.881 173.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.6 t -77.15 113.15 14.58 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 124.378 1.071 . . . . 0.0 109.29 177.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 30.1 mm -84.49 159.79 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 160.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -49.18 -48.2 32.73 Favored Glycine 0 C--O 1.224 -0.488 0 CA-C-O 121.982 0.768 . . . . 0.0 112.96 -159.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.2 -36.42 18.0 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 130.225 3.41 . . . . 0.0 115.964 177.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.0 tptt -133.93 129.5 36.4 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 -161.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.3 t -68.48 126.64 30.29 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 118.171 -0.919 . . . . 0.0 109.767 170.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -108.94 172.12 7.03 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 105.679 -1.971 . . . . 0.0 105.679 163.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.0 m -145.04 84.67 1.72 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 -168.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -70.07 172.1 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.2 mttt . . . . . 0 N--CA 1.43 -1.428 0 O-C-N 120.308 -1.495 . . . . 0.0 111.557 -172.747 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.5 t30 . . . . . 0 N--CA 1.456 -0.161 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 45.0 tp -51.07 -43.84 61.07 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 123.829 0.852 . . . . 0.0 112.16 177.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 63.8 ttp85 -62.83 -42.86 99.9 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.95 0.796 . . . . 0.0 110.717 -172.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 13.5 tmm? -61.7 -49.6 75.82 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 174.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.3 t -55.0 -52.02 64.42 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.911 -175.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -50.61 -55.06 18.04 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.06 1.344 . . . . 0.0 110.772 172.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 tp -56.72 -38.35 72.22 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.2 m -71.55 -53.4 13.92 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.11 0.481 . . . . 0.0 109.738 -178.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.3 m -64.35 -27.58 69.11 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 124.413 1.085 . . . . 0.0 110.663 -174.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 44.9 ttt180 -52.75 -25.47 11.28 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.217 -0.896 . . . . 0.0 111.273 173.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.6 p -50.38 -43.16 54.32 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 120.221 1.373 . . . . 0.0 111.29 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.7 mt -102.87 18.79 20.68 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.107 0.963 . . . . 0.0 110.132 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.21 31.25 72.79 Favored Glycine 0 CA--C 1.522 0.503 0 O-C-N 121.632 -0.668 . . . . 0.0 112.866 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 65.7 mt -98.43 139.16 34.59 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.784 0.833 . . . . 0.0 108.823 178.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 39.2 tp -63.59 108.31 1.36 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 165.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.22 129.09 22.96 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 108.925 -1.67 . . . . 0.0 108.925 167.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.57 153.54 48.69 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 174.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.2 t -128.96 100.83 5.81 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -146.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.7 mt -83.72 161.02 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 N-CA-C 105.383 -2.08 . . . . 0.0 105.383 173.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -40.87 -55.31 3.39 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 124.289 0.947 . . . . 0.0 112.854 -163.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.83 -43.91 12.9 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 127.234 2.214 . . . . 0.0 109.63 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -115.31 125.97 53.9 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.182 0.593 . . . . 0.0 109.791 -151.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.1 t -73.12 129.31 37.78 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 163.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -118.94 172.5 7.5 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 171.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.0 m -143.54 126.14 15.94 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 106.332 -1.729 . . . . 0.0 106.332 -173.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.4 m -135.53 152.99 32.44 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-N 118.423 0.556 . . . . 0.0 109.514 175.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 38.2 tttm . . . . . 0 N--CA 1.436 -1.157 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 174.665 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.8 t30 . . . . . 0 CA--C 1.53 0.196 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 48.9 tp -48.6 -42.45 34.0 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.535 1.134 . . . . 0.0 113.342 178.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.18 -54.11 48.43 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 118.81 0.732 . . . . 0.0 109.848 -178.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -60.47 -44.53 95.79 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.5 t -51.38 -57.55 8.65 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.543 0.687 . . . . 0.0 109.866 177.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -61.66 -34.82 76.4 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-O 117.984 -1.008 . . . . 0.0 111.458 -178.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 44.1 tp -63.0 -45.14 93.83 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.89 1.223 . . . . 0.0 110.637 175.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.0 m -64.89 -47.35 78.13 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.8 m -64.03 -43.82 94.41 Favored 'General case' 0 CA--C 1.535 0.365 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 -178.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -44.91 -53.61 7.41 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 125.688 1.595 . . . . 0.0 109.538 168.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 12.8 m -54.98 -44.21 74.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 118.235 0.47 . . . . 0.0 111.111 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.4 mt -75.28 -7.41 53.85 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.399 0.68 . . . . 0.0 112.454 177.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.97 43.84 25.81 Favored Glycine 0 C--N 1.334 0.457 0 CA-C-O 122.174 0.874 . . . . 0.0 111.298 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 54.1 mt -136.55 157.39 46.88 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 126.418 1.887 . . . . 0.0 108.403 -177.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.1 tp -90.78 108.01 19.56 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.67 1.988 . . . . 0.0 107.224 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.33 136.05 27.96 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.657 -0.782 . . . . 0.0 111.716 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 pptp? -134.57 153.47 51.94 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 166.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.6 t -134.08 96.87 3.72 Favored 'General case' 0 CA--C 1.518 -0.271 0 O-C-N 121.972 -0.455 . . . . 0.0 111.297 -154.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 6.2 mt -86.56 65.46 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 -177.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.72 -73.33 0.25 Allowed Glycine 0 CA--C 1.528 0.877 0 C-N-CA 124.374 0.988 . . . . 0.0 112.633 172.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.89 -49.96 7.47 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 126.217 1.807 . . . . 0.0 110.808 165.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -88.88 99.55 12.48 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -160.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 33.8 t -63.48 132.03 50.05 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 106.949 -1.501 . . . . 0.0 106.949 161.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -128.39 171.73 11.77 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 104.646 -2.353 . . . . 0.0 104.646 174.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -146.3 86.44 1.69 Allowed 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 -169.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -71.94 163.62 3.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 178.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.0 ttmm . . . . . 0 N--CA 1.437 -1.122 0 O-C-N 121.476 -0.765 . . . . 0.0 111.318 174.59 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 41.7 t30 . . . . . 0 CA--C 1.527 0.08 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.1 tp -35.99 -48.2 0.57 Allowed 'General case' 0 C--O 1.224 -0.275 0 C-N-CA 125.782 1.633 . . . . 0.0 113.768 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 70.4 mtm180 -55.34 -48.68 73.83 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 122.163 -0.336 . . . . 0.0 111.045 -176.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -65.41 -50.19 66.41 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 45.7 t -47.27 -52.67 15.47 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 121.646 0.736 . . . . 0.0 110.464 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -51.82 -47.09 64.49 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 124.121 0.968 . . . . 0.0 111.609 177.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 37.1 tp -67.27 -48.6 67.22 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 122.611 0.364 . . . . 0.0 110.186 -176.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.7 m -64.16 -41.03 97.31 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -174.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.0 m -64.92 -46.57 81.09 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 176.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.3 ttp-105 -58.12 -34.45 70.24 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 121.933 -0.48 . . . . 0.0 109.91 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.9 m -57.49 -29.46 64.29 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.679 0.672 . . . . 0.0 111.546 177.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 57.7 mt -99.9 14.48 30.3 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.185 0.994 . . . . 0.0 110.825 176.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.04 7.99 68.13 Favored Glycine 0 CA--C 1.527 0.811 0 O-C-N 120.996 -1.065 . . . . 0.0 113.235 -178.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 32.1 mt -92.05 145.22 24.69 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 122.179 0.99 . . . . 0.0 109.798 -175.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.5 tp -76.41 107.6 8.79 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 125.37 1.468 . . . . 0.0 107.193 170.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -90.2 138.26 14.4 Favored Glycine 0 C--N 1.331 0.29 0 CA-C-O 118.902 -0.944 . . . . 0.0 111.838 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.94 159.38 38.04 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 173.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 95.9 m -83.44 126.59 32.92 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 121.199 -0.938 . . . . 0.0 110.921 -176.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 14.8 mm -85.03 162.01 3.0 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 152.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -39.24 -56.72 2.26 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 124.921 1.248 . . . . 0.0 113.738 -171.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.37 -43.07 15.08 Favored 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 124.79 1.236 . . . . 0.0 108.606 -179.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.6 mttm -118.5 151.67 37.41 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 123.106 0.562 . . . . 0.0 110.902 -151.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.9 t -66.54 131.24 45.59 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 154.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -104.18 167.35 9.81 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 105.534 -2.025 . . . . 0.0 105.534 164.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 66.7 m -141.12 114.18 8.54 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 103.696 -2.705 . . . . 0.0 103.696 168.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.0 m -108.67 152.23 10.71 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.681 0 N-CA-C 106.519 -1.659 . . . . 0.0 106.519 168.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.432 -1.375 0 O-C-N 120.959 -1.088 . . . . 0.0 110.305 -173.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 . . . . . 0 N--CA 1.452 -0.336 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 31.7 tp -58.95 -45.39 90.57 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.541 0.337 . . . . 0.0 111.39 -173.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -61.99 -42.71 99.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 -176.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -58.37 -52.24 66.42 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.9 t -53.32 -55.92 20.89 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.652 -176.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -55.81 -46.59 78.0 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.318 1.047 . . . . 0.0 111.767 177.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.0 tt -56.78 -42.07 78.78 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 121.754 -0.591 . . . . 0.0 110.4 178.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 m -66.8 -50.39 62.8 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.4 m -63.52 -33.41 75.53 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.914 1.285 . . . . 0.0 109.616 -173.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.46 -26.75 21.57 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.517 1.527 . . . . 0.0 110.502 177.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.0 m -53.63 -36.92 62.56 Favored 'General case' 0 C--O 1.225 -0.198 0 O-C-N 121.025 -1.047 . . . . 0.0 112.961 175.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 mt -111.99 22.61 14.67 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.125 0.57 . . . . 0.0 109.929 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 58.47 26.33 59.33 Favored Glycine 0 CA--C 1.526 0.773 0 CA-C-O 122.04 0.8 . . . . 0.0 113.084 -179.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.4 mt -92.95 156.65 16.78 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 122.064 0.935 . . . . 0.0 108.766 178.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 tt -98.7 95.89 7.55 Favored 'General case' 0 N--CA 1.441 -0.921 0 C-N-CA 129.346 3.058 . . . . 0.0 106.514 -170.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.42 131.19 29.53 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.522 -0.847 . . . . 0.0 111.909 -177.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.424 ' NZ ' ' OE1' ' A' ' 27' ' ' GLU . 13.0 pttp -135.51 134.95 40.03 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 159.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 57.2 m -74.93 114.64 13.63 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 174.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.4 mt -83.44 162.57 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 N-CA-C 105.26 -2.126 . . . . 0.0 105.26 166.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -34.85 -57.3 0.79 Allowed Glycine 0 CA--C 1.525 0.674 0 C-N-CA 125.27 1.414 . . . . 0.0 112.987 -166.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.46 -43.21 19.19 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 127.837 2.455 . . . . 0.0 109.82 -172.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.22 164.35 38.92 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -160.233 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.6 t -64.96 133.14 51.11 Favored 'General case' 0 C--N 1.333 -0.114 0 C-N-CA 124.008 0.923 . . . . 0.0 110.225 174.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.424 ' OE1' ' NZ ' ' A' ' 20' ' ' LYS . 5.1 tm-20 -118.38 170.94 8.5 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 106.472 -1.677 . . . . 0.0 106.472 161.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 94.9 m -146.12 82.81 1.61 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 -168.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -72.69 150.47 8.3 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 -176.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.6 ttpt . . . . . 0 N--CA 1.433 -1.292 0 C-N-CA 118.895 -1.122 . . . . 0.0 111.854 -164.464 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 64.9 t-20 . . . . . 0 N--CA 1.451 -0.395 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 32.7 tp -44.48 -45.19 9.05 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.485 1.114 . . . . 0.0 111.648 -179.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 69.2 ttp85 -56.79 -49.68 74.6 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 122.352 0.261 . . . . 0.0 111.338 -177.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -69.21 -49.31 57.6 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.7 t -46.23 -51.04 15.09 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 124.244 1.017 . . . . 0.0 110.595 -175.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -55.05 -45.02 75.22 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.77 -179.634 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 32.0 tp -70.11 -47.3 62.4 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.141 0.576 . . . . 0.0 109.79 -174.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 p -64.18 -45.82 86.71 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 -176.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.0 m -64.34 -40.31 95.63 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.2 ttp-105 -62.54 -41.75 99.08 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -178.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.5 m -57.32 -35.04 69.36 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.188 0.449 . . . . 0.0 111.422 175.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.6 mt -85.08 5.18 30.75 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.598 0.759 . . . . 0.0 111.669 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 61.54 47.17 92.17 Favored Glycine 0 C--N 1.334 0.461 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 23.5 mt -131.46 148.88 52.68 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 126.507 1.923 . . . . 0.0 108.582 175.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.8 tp -82.16 107.13 14.62 Favored 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 171.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.03 129.71 29.63 Favored Glycine 0 N--CA 1.451 -0.307 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 178.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.17 131.32 40.28 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 176.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 m -80.27 133.28 35.97 Favored 'General case' 0 CA--C 1.515 -0.373 0 O-C-N 121.084 -1.01 . . . . 0.0 109.734 177.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.9 mm -84.34 160.44 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.683 0 N-CA-C 104.324 -2.473 . . . . 0.0 104.324 149.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.21 -47.78 41.43 Favored Glycine 0 CA--C 1.528 0.862 0 O-C-N 121.449 -0.782 . . . . 0.0 112.355 -171.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.93 -44.65 47.44 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 127.034 2.134 . . . . 0.0 107.765 -172.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -155.01 152.99 30.31 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-O 121.529 0.68 . . . . 0.0 110.883 -151.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.9 t -70.93 140.78 51.07 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 124.348 1.059 . . . . 0.0 111.182 -178.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -128.23 171.97 11.47 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 106.53 -1.655 . . . . 0.0 106.53 163.327 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 86.4 m -146.08 102.38 3.62 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 -170.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.2 m -89.03 166.81 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 172.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm . . . . . 0 N--CA 1.44 -0.963 0 O-C-N 120.752 -1.218 . . . . 0.0 108.941 172.179 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 62.7 t-20 . . . . . 0 N--CA 1.463 0.203 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.9 tp -48.11 -43.77 31.25 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.702 0.801 . . . . 0.0 111.969 176.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -66.12 -45.78 79.88 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.859 -0.526 . . . . 0.0 110.297 -172.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -60.13 -49.16 78.74 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 175.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.1 t -51.0 -54.43 24.61 Favored 'General case' 0 CA--C 1.523 -0.077 0 CA-C-O 121.309 0.576 . . . . 0.0 110.787 -176.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -53.83 -47.29 71.08 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 124.45 1.1 . . . . 0.0 110.801 176.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 41.9 tp -60.74 -42.75 97.99 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 119.178 -0.439 . . . . 0.0 111.61 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.91 -51.0 52.87 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 119.1 0.864 . . . . 0.0 109.611 179.079 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.1 m -63.58 -31.8 73.08 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 124.101 0.96 . . . . 0.0 109.018 -171.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -49.25 -29.89 6.41 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.356 -0.831 . . . . 0.0 111.942 172.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 80.1 p -52.68 -40.71 63.16 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 120.175 1.352 . . . . 0.0 111.483 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.4 mt -104.5 21.35 16.9 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.826 0.85 . . . . 0.0 109.953 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.2 33.71 86.82 Favored Glycine 0 C--N 1.335 0.509 0 CA-C-O 122.209 0.894 . . . . 0.0 111.882 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.9 mt -102.39 132.34 48.46 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-O 121.866 0.841 . . . . 0.0 109.373 -178.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.3 tp -68.01 94.61 0.5 Allowed 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 125.668 1.587 . . . . 0.0 106.955 170.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.47 123.7 29.84 Favored Glycine 0 N--CA 1.448 -0.535 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 170.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.2 143.62 46.5 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 106.789 -1.56 . . . . 0.0 106.789 173.35 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 t -129.29 96.36 4.28 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 -145.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.4 mt -83.06 159.87 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 N-CA-C 104.109 -2.552 . . . . 0.0 104.109 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -46.31 -49.9 14.1 Favored Glycine 0 CA--C 1.53 0.972 0 CA-C-O 122.504 1.058 . . . . 0.0 113.45 -162.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.47 -24.24 24.19 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 130.814 3.646 . . . . 0.0 115.241 -177.115 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.5 mmtm -138.91 118.16 12.71 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.049 0.94 . . . . 0.0 112.402 -170.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.2 t -64.29 124.46 21.79 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 155.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -117.67 172.05 7.62 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 105.832 -1.914 . . . . 0.0 105.832 171.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.0 m -142.56 98.75 3.36 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.751 1.62 . . . . 0.0 107.655 -172.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -83.04 173.26 0.96 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 172.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.7 ttmp? . . . . . 0 N--CA 1.444 -0.762 0 O-C-N 119.975 -1.703 . . . . 0.0 109.913 170.783 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 63.8 t-20 . . . . . 0 N--CA 1.462 0.162 0 CA-C-O 122.112 0.958 . . . . 0.0 108.891 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 24.2 tp -56.44 -34.89 67.27 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.642 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.71 -48.79 79.14 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.875 0.761 . . . . 0.0 110.739 177.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -58.38 -49.28 77.82 Favored 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 109.047 -0.724 . . . . 0.0 109.047 177.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.6 t -51.52 -52.75 44.31 Favored 'General case' 0 C--O 1.227 -0.116 0 CA-C-O 121.022 0.439 . . . . 0.0 110.542 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -52.37 -48.46 65.58 Favored 'General case' 0 N--CA 1.444 -0.759 0 C-N-CA 123.129 0.572 . . . . 0.0 111.481 175.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.0 tp -63.1 -49.6 73.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.436 0.562 . . . . 0.0 111.197 -176.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.1 m -64.71 -42.37 95.31 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 121.376 -0.828 . . . . 0.0 109.695 -177.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 87.2 m -63.9 -42.85 97.34 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.3 ttt85 -54.86 -46.91 74.76 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.0 m -58.24 -35.18 71.32 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 117.949 0.34 . . . . 0.0 111.05 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.5 mt -84.92 1.73 45.98 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.543 0.737 . . . . 0.0 111.851 176.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.97 47.7 64.31 Favored Glycine 0 C--N 1.334 0.422 0 O-C-N 120.71 -1.244 . . . . 0.0 110.148 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.9 mt -136.49 177.69 7.65 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 128.13 2.572 . . . . 0.0 107.48 176.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -125.13 110.76 14.5 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 126.29 1.836 . . . . 0.0 106.914 -175.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -73.46 123.59 8.38 Favored Glycine 0 N--CA 1.449 -0.491 0 CA-C-O 119.451 -0.639 . . . . 0.0 112.445 -173.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.4 ' NZ ' ' OE1' ' A' ' 27' ' ' GLU . 1.9 pptp? -134.99 133.48 39.5 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 106.006 -1.85 . . . . 0.0 106.006 167.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 30.2 t -103.78 136.84 42.71 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -165.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 23.2 mt -97.85 163.33 2.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 125.68 1.592 . . . . 0.0 107.274 176.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -12.55 -70.55 0.01 OUTLIER Glycine 0 CA--C 1.532 1.141 0 C-N-CA 127.839 2.638 . . . . 0.0 116.352 -176.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.92 -47.9 9.22 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 126.639 1.976 . . . . 0.0 108.927 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -136.93 149.39 47.55 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.969 0.89 . . . . 0.0 113.159 -146.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.5 t -64.87 139.59 58.78 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.161 1.784 . . . . 0.0 111.307 -178.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.4 ' OE1' ' NZ ' ' A' ' 20' ' ' LYS . 4.0 tm-20 -122.95 172.76 8.25 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 105.241 -2.133 . . . . 0.0 105.241 160.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 94.4 m -145.87 83.69 1.65 Allowed 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 -164.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 31.4 m -72.28 157.17 6.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -177.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 43.9 tptt . . . . . 0 N--CA 1.437 -1.082 0 O-C-N 121.35 -0.844 . . . . 0.0 112.368 -167.86 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 . . . . . 0 N--CA 1.458 -0.049 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.8 tp -50.48 -37.05 36.59 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.965 0.906 . . . . 0.0 112.333 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.38 -52.08 44.31 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 121.358 -0.839 . . . . 0.0 110.506 -176.062 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -61.61 -42.98 99.64 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.2 t -50.76 -57.44 8.34 Favored 'General case' 0 CA--C 1.523 -0.083 0 CA-C-O 121.487 0.66 . . . . 0.0 109.226 177.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -60.99 -37.33 82.1 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 122.827 0.451 . . . . 0.0 111.93 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 31.2 tp -60.93 -43.03 99.19 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.095 0.861 . . . . 0.0 110.468 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.5 m -67.1 -44.78 79.09 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.8 m -63.77 -41.24 98.0 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -177.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.81 -30.93 4.4 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 125.315 1.446 . . . . 0.0 111.164 172.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.0 t -51.69 -44.3 63.07 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.696 1.135 . . . . 0.0 109.825 -177.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 57.5 mt -108.69 25.22 11.99 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.97 0.908 . . . . 0.0 110.266 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 61.01 27.16 66.7 Favored Glycine 0 CA--C 1.526 0.753 0 CA-C-O 121.858 0.699 . . . . 0.0 113.386 177.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.8 mt -91.64 172.24 8.63 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 123.897 0.879 . . . . 0.0 109.391 177.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.1 tt -126.2 97.64 5.16 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 127.292 2.237 . . . . 0.0 106.269 -161.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.32 125.06 11.56 Favored Glycine 0 CA--C 1.526 0.763 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.581 -168.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.5 mtpm? -124.73 120.0 30.53 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 126.134 1.774 . . . . 0.0 107.925 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.0 m -74.78 130.53 39.64 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 6.2 mt -111.73 66.42 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 125.391 1.476 . . . . 0.0 107.54 169.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.99 -88.8 0.48 Allowed Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 126.429 1.966 . . . . 0.0 110.319 173.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.74 -45.25 21.58 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 176.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.9 mttp -88.99 157.09 18.5 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.25 0.62 . . . . 0.0 109.714 -162.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.7 t -101.81 123.82 46.41 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 164.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -104.88 170.2 8.01 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 167.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 92.2 m -149.57 85.12 1.43 Allowed 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.943 1.697 . . . . 0.0 110.253 -169.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.6 m -76.23 166.09 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 O-C-N 120.69 -1.256 . . . . 0.0 110.294 177.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.4 mtmt . . . . . 0 N--CA 1.439 -0.979 0 O-C-N 121.145 -0.972 . . . . 0.0 111.797 -174.327 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 . . . . . 0 CA--C 1.529 0.15 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.2 tp -53.87 -37.4 63.67 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.676 0.79 . . . . 0.0 111.601 176.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.62 -49.19 78.73 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.722 0.692 . . . . 0.0 109.917 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -59.21 -52.35 66.08 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 178.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.7 t -51.95 -50.06 61.94 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 122.023 0.916 . . . . 0.0 110.852 -176.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -54.42 -46.87 73.28 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.395 176.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.92 -49.76 71.38 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.084 0.554 . . . . 0.0 111.493 -177.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.6 p -64.55 -42.27 95.79 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.44 -0.787 . . . . 0.0 109.222 -176.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.1 m -63.78 -42.97 97.65 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.01 -42.43 94.27 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 -178.07 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.9 m -55.88 -43.51 77.25 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 120.82 -1.175 . . . . 0.0 111.232 175.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.9 mt -72.91 -4.71 33.69 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 122.751 0.42 . . . . 0.0 111.648 175.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.02 14.84 82.21 Favored Glycine 0 CA--C 1.524 0.625 0 O-C-N 121.184 -0.947 . . . . 0.0 111.866 -178.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 24.0 mt -100.76 -179.73 4.16 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 125.884 1.674 . . . . 0.0 107.884 177.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -121.62 104.39 9.59 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 -171.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -77.15 130.77 10.65 Favored Glycine 0 C--N 1.332 0.351 0 CA-C-O 119.428 -0.651 . . . . 0.0 113.239 -170.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.88 130.76 27.8 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 106.474 -1.676 . . . . 0.0 106.474 168.228 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.6 t -99.71 124.96 45.47 Favored 'General case' 0 CA--C 1.518 -0.271 0 O-C-N 121.933 -0.479 . . . . 0.0 111.125 -174.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.6 mt -84.85 161.98 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 172.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -45.57 -36.23 6.03 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.444 1.021 . . . . 0.0 114.195 -177.024 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -57.83 3.67 Favored 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 127.933 2.493 . . . . 0.0 107.872 -179.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.65 155.9 30.85 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -152.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.5 t -66.59 133.03 49.47 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 124.15 0.98 . . . . 0.0 110.877 171.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.9 172.08 9.67 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 164.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 76.8 m -145.81 89.98 1.95 Allowed 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 126.507 1.923 . . . . 0.0 106.31 -167.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.6 m -70.19 146.81 11.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 174.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.9 ttpp . . . . . 0 N--CA 1.435 -1.215 0 O-C-N 121.37 -0.832 . . . . 0.0 111.137 -164.293 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.6 t30 . . . . . 0 CA--C 1.527 0.07 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 56.0 tp -39.51 -46.91 1.8 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.784 1.634 . . . . 0.0 113.291 174.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.8 ttt85 -64.02 -44.45 92.54 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 119.006 0.821 . . . . 0.0 109.797 -174.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -61.75 -48.25 81.52 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 174.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 54.1 t -53.16 -55.06 27.13 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.834 0.826 . . . . 0.0 109.582 -176.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.3 mm-40 -57.24 -46.15 83.27 Favored 'General case' 0 N--CA 1.44 -0.958 0 O-C-N 121.888 -0.508 . . . . 0.0 110.888 178.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 46.6 tp -62.74 -46.45 88.02 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.686 0.675 . . . . 0.0 111.482 -176.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.4 p -64.98 -45.13 86.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -178.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 88.4 m -62.95 -42.8 99.93 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -41.53 77.3 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 177.128 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.9 m -68.54 -27.21 65.89 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 177.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 69.1 mt -80.18 -3.85 50.66 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.545 0.612 . . . . 0.0 111.534 167.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 75.32 29.13 60.61 Favored Glycine 0 C--N 1.337 0.591 0 CA-C-N 119.299 0.954 . . . . 0.0 111.444 -177.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 30.8 mt -123.55 -176.44 3.45 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.847 2.059 . . . . 0.0 108.17 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.9 tp -135.45 113.95 11.65 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 126.193 1.797 . . . . 0.0 107.992 -166.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.14 144.76 45.22 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 121.441 -0.409 . . . . 0.0 112.997 -165.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -127.99 87.11 2.56 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 128.16 2.584 . . . . 0.0 105.375 171.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -78.28 98.11 5.8 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 123.602 0.761 . . . . 0.0 110.728 -176.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.4 mt -87.96 161.34 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 N-CA-C 106.703 -1.592 . . . . 0.0 106.703 164.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.36 -53.53 23.8 Favored Glycine 0 CA--C 1.523 0.544 0 O-C-N 121.989 -0.444 . . . . 0.0 113.293 -166.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.4 -26.13 26.61 Favored 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 124.859 1.263 . . . . 0.0 110.435 179.702 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -129.02 110.47 12.08 Favored 'General case' 0 C--O 1.226 -0.14 0 C-N-CA 123.368 0.667 . . . . 0.0 110.162 -156.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 31.6 t -76.42 117.67 18.32 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 164.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -103.49 170.95 7.64 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 171.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.8 m -148.48 84.67 1.49 Allowed 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.669 1.588 . . . . 0.0 109.165 -171.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.7 m -70.7 154.84 7.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 118.941 -1.104 . . . . 0.0 109.306 178.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt . . . . . 0 N--CA 1.436 -1.134 0 O-C-N 121.368 -0.832 . . . . 0.0 109.671 -178.609 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 32.9 t-20 . . . . . 0 N--CA 1.45 -0.466 0 N-CA-C 103.415 -2.809 . . . . 0.0 103.415 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.0 tp -51.68 -39.46 58.29 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 118.535 0.607 . . . . 0.0 110.305 177.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -61.25 -38.54 87.04 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-O 118.584 -0.722 . . . . 0.0 112.143 176.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 58.5 ttp -63.94 -49.96 70.56 Favored 'General case' 0 CA--C 1.528 0.101 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.1 t -52.95 -54.75 30.38 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-O 121.289 0.566 . . . . 0.0 110.07 179.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -61.84 -35.9 79.63 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-O 118.554 -0.736 . . . . 0.0 112.519 -179.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.6 tt -63.82 -43.84 95.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 119.605 1.093 . . . . 0.0 109.535 176.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.3 t -64.37 -48.76 74.26 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 -178.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.8 m -63.42 -42.52 98.71 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 -177.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -39.1 68.02 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 124.253 1.021 . . . . 0.0 108.644 176.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.4 m -68.93 -25.12 64.42 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.637 -0.665 . . . . 0.0 112.66 177.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.7 mt -89.02 -0.02 57.07 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.682 0.793 . . . . 0.0 111.743 168.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.84 35.06 65.78 Favored Glycine 0 CA--C 1.525 0.682 0 O-C-N 121.24 -0.912 . . . . 0.0 112.646 -177.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 35.3 mt -129.1 172.82 11.03 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 126.496 1.918 . . . . 0.0 109.72 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.0 tp -116.44 110.93 19.29 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 126.574 1.95 . . . . 0.0 109.228 -171.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -74.48 132.06 13.98 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 114.336 0.494 . . . . 0.0 114.336 -169.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? -124.38 108.99 12.76 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 126.448 1.899 . . . . 0.0 107.429 171.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.5 t -76.01 112.5 12.5 Favored 'General case' 0 C--N 1.332 -0.152 0 O-C-N 122.038 -0.414 . . . . 0.0 111.242 -178.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.2 mm -88.46 65.92 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 C-N-CA 125.565 1.546 . . . . 0.0 107.676 177.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.62 -88.12 0.17 Allowed Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 125.829 1.68 . . . . 0.0 110.791 175.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.29 -42.98 34.82 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 106.352 -1.722 . . . . 0.0 106.352 178.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -102.38 162.93 12.53 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.507 1.123 . . . . 0.0 108.799 -159.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.2 t -112.02 122.36 47.56 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 175.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -104.58 169.84 8.23 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 106.19 -1.781 . . . . 0.0 106.19 167.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 90.2 m -149.11 85.18 1.46 Allowed 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.867 1.667 . . . . 0.0 110.167 -167.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.2 m -76.43 148.61 6.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 O-C-N 120.876 -1.14 . . . . 0.0 110.601 -178.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt . . . . . 0 N--CA 1.435 -1.194 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -179.555 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 . . . . . 0 N--CA 1.452 -0.369 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 49.5 tp -39.54 -46.26 1.71 Allowed 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 125.691 1.596 . . . . 0.0 113.453 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.72 -52.5 59.91 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.492 0.717 . . . . 0.0 111.815 178.161 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -63.31 -47.36 82.58 Favored 'General case' 0 N--CA 1.457 -0.079 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 178.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 34.8 t -49.78 -56.51 10.05 Favored 'General case' 0 C--O 1.224 -0.287 0 O-C-N 123.856 0.722 . . . . 0.0 109.713 -178.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -57.01 -45.09 83.31 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 124.346 1.059 . . . . 0.0 112.468 -179.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.3 tt -60.65 -44.75 96.04 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.582 0.706 . . . . 0.0 109.972 179.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.7 m -64.52 -45.6 86.5 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 97.7 m -63.15 -41.41 99.26 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 -176.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.18 -36.62 82.46 Favored 'General case' 0 C--O 1.228 -0.064 0 N-CA-C 106.938 -1.504 . . . . 0.0 106.938 -178.071 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.2 m -70.59 -14.87 62.66 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 177.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.6 mt -98.07 5.13 49.01 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.444 0.698 . . . . 0.0 110.644 168.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.05 21.01 79.28 Favored Glycine 0 CA--C 1.526 0.78 0 O-C-N 120.782 -1.199 . . . . 0.0 112.168 -177.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.1 mt -112.33 -177.7 3.23 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.122 1.769 . . . . 0.0 108.365 177.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -140.95 105.78 4.94 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -163.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.17 134.6 25.15 Favored Glycine 0 CA--C 1.528 0.844 0 C-N-CA 121.335 -0.46 . . . . 0.0 113.866 -166.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 11.9 mptt -117.21 165.63 13.2 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 127.374 2.27 . . . . 0.0 105.587 161.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 50.8 t -150.37 104.94 3.28 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.244 -0.91 . . . . 0.0 110.515 -169.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.4 mt -87.08 161.36 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 N-CA-C 105.449 -2.056 . . . . 0.0 105.449 162.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -45.32 -49.94 10.3 Favored Glycine 0 CA--C 1.527 0.785 0 CA-C-O 122.236 0.909 . . . . 0.0 114.119 -170.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.05 -33.33 22.5 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 124.182 0.993 . . . . 0.0 109.587 -177.204 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 37.3 mttp -119.3 116.21 25.76 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 125.033 1.333 . . . . 0.0 111.258 -157.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 20.3 t -66.51 127.03 30.76 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 155.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -105.54 169.09 8.67 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 105.379 -2.082 . . . . 0.0 105.379 165.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 87.9 m -148.7 84.09 1.47 Allowed 'General case' 0 C--O 1.233 0.212 0 C-N-CA 124.904 1.282 . . . . 0.0 109.335 -177.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -71.41 146.78 11.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 O-C-N 121.175 -0.953 . . . . 0.0 108.905 -177.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? . . . . . 0 N--CA 1.441 -0.876 0 O-C-N 120.854 -1.154 . . . . 0.0 112.606 -160.048 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 51.3 t-20 . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.739 0.304 . . . . 0.0 110.594 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.5 tp -51.71 -38.27 54.46 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 124.466 1.106 . . . . 0.0 111.494 -178.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 40.8 mtp85 -58.24 -52.3 66.14 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 64.6 ttp -64.3 -49.7 70.76 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 -179.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.3 t -49.9 -52.77 30.45 Favored 'General case' 0 C--N 1.334 -0.067 0 C-N-CA 123.008 0.523 . . . . 0.0 110.261 -176.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -69.21 -15.52 63.4 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.8 tp -80.54 -52.47 7.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 119.817 1.19 . . . . 0.0 109.36 168.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.1 p -63.91 -41.45 97.67 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.604 -0.685 . . . . 0.0 109.432 -172.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 83.5 m -64.07 -40.23 95.81 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 176.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.7 ttm105 -65.28 -35.64 81.64 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -175.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.2 m -55.82 -33.05 64.09 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.536 0.607 . . . . 0.0 111.562 172.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 42.5 mt -90.69 6.76 42.69 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.795 0.838 . . . . 0.0 111.302 177.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.16 19.7 78.69 Favored Glycine 0 CA--C 1.526 0.754 0 O-C-N 121.32 -0.863 . . . . 0.0 113.299 -178.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 37.3 mt -111.75 170.1 8.37 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.743 1.217 . . . . 0.0 109.976 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -115.61 104.16 11.43 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 126.252 1.821 . . . . 0.0 107.89 -170.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.59 128.92 38.94 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-N 116.477 -0.329 . . . . 0.0 113.061 -173.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.2 mtpm? -121.11 116.44 24.99 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.549 -1.648 . . . . 0.0 106.549 166.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -94.44 100.67 12.63 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 117.896 0.316 . . . . 0.0 110.148 -169.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.2 mt -90.25 162.29 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -171.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -39.93 -49.59 3.41 Favored Glycine 0 CA--C 1.525 0.704 0 C-N-CA 125.162 1.363 . . . . 0.0 113.854 -171.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.21 -42.24 14.88 Favored 'General case' 0 N--CA 1.439 -1.003 0 C-N-CA 125.782 1.633 . . . . 0.0 107.518 -171.318 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -156.23 159.86 39.3 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.985 0.914 . . . . 0.0 111.531 -153.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.7 t -79.32 125.19 29.18 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.07 169.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -105.41 170.78 7.68 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 167.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.3 m -148.57 84.89 1.49 Allowed 'General case' 0 C--O 1.232 0.155 0 C-N-CA 125.115 1.366 . . . . 0.0 110.59 -167.398 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.4 m -76.08 144.72 11.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 O-C-N 120.945 -1.097 . . . . 0.0 111.281 -175.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt . . . . . 0 N--CA 1.433 -1.28 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 173.186 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 55.3 t-20 . . . . . 0 N--CA 1.454 -0.249 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 49.3 tp -51.51 -36.8 46.23 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.935 0.894 . . . . 0.0 111.034 178.604 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.74 -52.38 65.75 Favored 'General case' 0 N--CA 1.458 -0.073 0 CA-C-N 118.776 0.717 . . . . 0.0 110.222 179.36 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 15.5 tmm? -64.32 -46.16 84.72 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -178.405 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 11.4 t -49.79 -57.64 6.95 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 177.565 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -58.79 -40.99 85.64 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 118.522 -0.751 . . . . 0.0 112.078 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.9 tt -60.64 -43.66 97.31 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.605 1.093 . . . . 0.0 110.015 178.149 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.1 t -64.07 -46.48 84.15 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 -178.242 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.8 m -63.23 -45.86 89.66 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -176.755 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -38.97 67.51 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 125.339 1.456 . . . . 0.0 108.817 177.702 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.1 m -67.51 -19.02 65.26 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 178.951 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.8 mt -101.13 9.21 42.25 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.837 0.855 . . . . 0.0 111.039 169.538 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.28 23.11 77.59 Favored Glycine 0 CA--C 1.526 0.756 0 O-C-N 120.878 -1.139 . . . . 0.0 112.779 -179.476 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.7 mt -109.11 175.46 5.45 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 125.562 1.545 . . . . 0.0 108.868 178.302 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.7 tt -126.82 102.86 7.22 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.983 1.713 . . . . 0.0 107.057 -167.917 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.84 120.19 20.42 Favored Glycine 0 CA--C 1.529 0.951 0 O-C-N 122.104 -0.373 . . . . 0.0 112.499 -174.811 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.4 tptt -122.17 106.29 11.02 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 104.521 -2.4 . . . . 0.0 104.521 174.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 5.1 t -110.76 124.87 52.82 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.704 0.684 . . . . 0.0 111.534 -170.213 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 22.2 mt -91.34 162.67 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 105.874 -1.899 . . . . 0.0 105.874 168.162 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -5.8 -81.04 0.01 OUTLIER Glycine 0 CA--C 1.532 1.135 0 C-N-CA 127.209 2.337 . . . . 0.0 115.441 -175.043 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.54 -38.78 16.87 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 128.496 2.718 . . . . 0.0 113.919 167.153 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -85.38 100.53 11.9 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.879 1.271 . . . . 0.0 110.433 -156.941 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.4 t -66.64 119.05 11.09 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.048 0.939 . . . . 0.0 110.513 166.018 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.62 171.52 7.32 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 104.802 -2.296 . . . . 0.0 104.802 161.503 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 94.0 m -145.95 83.2 1.63 Allowed 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.234 -2.135 . . . . 0.0 105.234 -177.694 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.3 m -73.53 144.24 12.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 C-N-CA 119.33 -0.948 . . . . 0.0 108.949 -177.455 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.6 ttpp . . . . . 0 N--CA 1.435 -1.218 0 CA-C-O 118.202 -0.904 . . . . 0.0 111.568 -159.755 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 28.1 tp -53.61 -33.81 56.26 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.396 1.078 . . . . 0.0 111.817 179.434 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.73 -46.68 68.27 Favored 'General case' 0 N--CA 1.453 -0.277 0 O-C-N 121.393 -0.817 . . . . 0.0 110.27 -176.76 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 13.3 tmm? -69.1 -44.61 72.12 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 176.694 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 23.3 t -50.7 -55.43 16.59 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 123.889 0.876 . . . . 0.0 110.08 -177.839 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -55.51 -39.42 70.48 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 178.97 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 39.8 tp -67.06 -44.83 79.1 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.972 -0.455 . . . . 0.0 110.618 -179.575 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.1 t -63.65 -44.97 92.27 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 -179.206 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 88.6 m -62.82 -43.65 98.25 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 -177.47 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.8 tpt85 -57.99 -44.49 87.19 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 177.722 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -55.86 -44.51 78.12 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 118.01 0.368 . . . . 0.0 110.039 177.732 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.8 mt -74.95 -3.33 31.57 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.284 0.634 . . . . 0.0 111.6 178.563 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.11 40.19 43.1 Favored Glycine 0 C--N 1.333 0.415 0 CA-C-O 122.313 0.952 . . . . 0.0 110.775 179.292 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 16.8 mt -131.37 -174.26 3.35 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 127.987 2.515 . . . . 0.0 107.303 177.363 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 47.9 tp -145.82 117.18 7.95 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 125.945 1.698 . . . . 0.0 107.517 -168.103 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.68 162.97 49.47 Favored Glycine 0 CA--C 1.533 1.186 0 N-CA-C 115.535 0.974 . . . . 0.0 115.535 -161.829 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -145.04 166.64 24.76 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 127.91 2.484 . . . . 0.0 106.902 157.802 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -121.54 120.35 34.6 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 121.465 -0.772 . . . . 0.0 109.524 177.681 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 56.7 mt -84.49 163.33 2.82 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 156.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -39.87 -59.01 2.14 Favored Glycine 0 CA--C 1.529 0.919 0 C-N-CA 124.468 1.033 . . . . 0.0 114.013 -171.556 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.83 -33.59 45.89 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.449 1.5 . . . . 0.0 108.596 -177.261 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.4 ttpm? -140.77 124.15 16.75 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.724 0.297 . . . . 0.0 111.011 -130.717 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.5 t -65.03 134.01 52.91 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.173 0.989 . . . . 0.0 110.5 173.248 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.3 tm-20 -106.31 166.5 10.48 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 105.544 -2.021 . . . . 0.0 105.544 164.314 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 84.2 m -149.74 84.97 1.41 Allowed 'General case' 0 C--O 1.235 0.315 0 C-N-CA 125.474 1.51 . . . . 0.0 110.598 -178.691 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.0 m -71.13 157.46 6.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 178.541 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.441 -0.884 0 O-C-N 120.592 -1.318 . . . . 0.0 109.837 174.53 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 . . . . . 0 N--CA 1.456 -0.165 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.8 tp -50.46 -36.71 34.72 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 124.659 1.184 . . . . 0.0 112.352 177.718 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.17 -48.85 69.38 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 121.209 -0.932 . . . . 0.0 109.238 -177.906 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 12.2 tmm? -55.11 -48.25 73.87 Favored 'General case' 0 C--N 1.335 -0.049 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 174.281 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.8 t -56.73 -58.34 8.5 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.271 0.557 . . . . 0.0 110.518 -175.793 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -49.77 -45.76 49.96 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 125.08 1.352 . . . . 0.0 110.822 175.728 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.4 tp -63.46 -42.4 98.62 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 121.627 -0.671 . . . . 0.0 110.989 -177.576 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -64.62 -51.99 59.79 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 178.43 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.8 m -64.13 -34.36 77.89 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 123.944 0.898 . . . . 0.0 110.147 -170.713 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -47.04 -37.96 10.2 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 123.592 0.757 . . . . 0.0 111.216 170.402 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.3 t -56.2 -34.6 66.42 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.671 0.669 . . . . 0.0 110.742 -176.467 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 68.7 mt -104.34 15.18 28.79 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.675 0.79 . . . . 0.0 110.647 177.58 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 59.77 19.98 51.16 Favored Glycine 0 CA--C 1.523 0.555 0 C-N-CA 124.135 0.874 . . . . 0.0 113.342 -177.757 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 45.9 mt -89.41 171.2 9.91 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 178.375 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -113.41 106.76 14.96 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 105.84 -1.911 . . . . 0.0 105.84 -169.61 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.15 108.53 2.21 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-O 119.399 -0.667 . . . . 0.0 111.755 -174.008 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.22 121.42 41.02 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 172.187 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.1 m -75.26 125.07 28.21 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 168.726 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.7 mt -82.44 160.75 3.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 104.333 -2.469 . . . . 0.0 104.333 146.009 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.49 -46.86 45.52 Favored Glycine 0 CA--C 1.528 0.864 0 O-C-N 121.568 -0.708 . . . . 0.0 113.299 -161.909 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.56 -36.49 18.87 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.89 2.476 . . . . 0.0 111.369 178.812 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -135.21 138.3 43.48 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-O 121.549 0.69 . . . . 0.0 112.107 -153.744 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.8 t -68.7 129.64 40.52 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 118.495 -0.764 . . . . 0.0 111.108 171.642 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -115.95 173.63 6.46 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 105.636 -1.987 . . . . 0.0 105.636 156.073 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -137.0 84.98 2.1 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 125.769 1.628 . . . . 0.0 107.833 -171.327 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.0 m -68.82 151.01 10.44 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.493 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -178.832 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.5 tttp . . . . . 0 N--CA 1.43 -1.453 0 O-C-N 121.37 -0.831 . . . . 0.0 110.628 -165.76 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 59.3 t-20 . . . . . 0 N--CA 1.453 -0.295 0 CA-C-O 120.641 0.258 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 40.2 tp -53.64 -33.81 56.45 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.172 0.989 . . . . 0.0 111.921 -179.608 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.28 -57.77 8.46 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.425 -0.797 . . . . 0.0 110.554 178.693 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -61.88 -42.9 99.62 Favored 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 -178.337 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 38.8 t -48.63 -60.83 2.39 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.045 0.938 . . . . 0.0 108.854 178.832 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -60.72 -34.99 75.22 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -177.425 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.6 tt -63.52 -43.0 98.44 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.42 1.009 . . . . 0.0 110.677 175.237 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.5 t -64.37 -45.68 86.67 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.497 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 63.2 m -63.61 -41.51 98.29 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 -176.642 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.79 -50.18 69.12 Favored 'General case' 0 C--N 1.339 0.11 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 173.486 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.9 m -58.7 -33.35 70.08 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 179.354 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.8 mt -87.22 -4.56 59.1 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.315 0.646 . . . . 0.0 112.177 178.11 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.87 52.52 32.79 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 110.16 -1.176 . . . . 0.0 110.16 -176.921 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 28.2 mt -142.39 174.46 10.61 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 129.895 3.278 . . . . 0.0 107.82 177.552 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.5 tt -130.0 113.92 15.17 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 127.893 2.477 . . . . 0.0 106.715 -172.111 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -77.71 138.09 21.07 Favored Glycine 0 CA--C 1.53 0.984 0 N-CA-C 114.597 0.599 . . . . 0.0 114.597 -168.608 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -117.47 167.49 11.24 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 127.231 2.212 . . . . 0.0 107.868 167.765 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.2 t -112.58 130.8 55.9 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.656 0.782 . . . . 0.0 110.597 173.797 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.5 mt -111.13 163.62 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 C-N-CA 126.914 2.086 . . . . 0.0 106.996 168.111 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -27.07 -63.27 0.08 OUTLIER Glycine 0 CA--C 1.535 1.321 0 C-N-CA 126.228 1.871 . . . . 0.0 116.481 -175.513 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.19 -34.18 22.11 Favored 'General case' 0 N--CA 1.443 -0.776 0 O-C-N 121.063 -1.257 . . . . 0.0 109.345 -178.064 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -147.98 152.59 37.74 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.124 0.57 . . . . 0.0 112.512 -129.357 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.0 t -65.06 144.48 57.23 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.661 1.584 . . . . 0.0 111.504 173.009 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -114.93 168.71 9.66 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 157.048 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 98.6 m -147.01 84.35 1.59 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 126.081 1.752 . . . . 0.0 110.648 178.497 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -82.79 158.32 3.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 -174.718 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.1 tptt . . . . . 0 N--CA 1.44 -0.935 0 O-C-N 120.815 -1.178 . . . . 0.0 109.876 165.065 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.0 t30 . . . . . 0 N--CA 1.463 0.203 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 30.6 tp -48.47 -44.73 35.95 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 123.166 0.586 . . . . 0.0 112.291 179.547 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -64.25 -37.34 87.14 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 120.139 -0.624 . . . . 0.0 111.033 -172.452 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.3 tmm? -60.86 -51.06 70.91 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 174.775 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.0 t -57.47 -56.93 15.53 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.88 -175.51 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -45.79 -50.62 13.83 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 126.031 1.732 . . . . 0.0 110.354 171.741 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 31.5 tp -62.49 -30.67 71.44 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 121.768 -0.583 . . . . 0.0 111.518 -177.289 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.3 t -71.73 -56.46 5.75 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 119.004 0.82 . . . . 0.0 109.053 172.014 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.2 m -63.81 -28.36 69.81 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.597 1.559 . . . . 0.0 110.639 -167.442 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.2 ttp85 -41.22 -46.02 3.03 Favored 'General case' 0 C--O 1.226 -0.136 0 C-N-CA 125.927 1.691 . . . . 0.0 110.422 168.333 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.6 m -55.18 -31.12 61.13 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.626 0.648 . . . . 0.0 112.286 -175.431 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.7 mt -106.53 9.48 31.52 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 123.711 0.804 . . . . 0.0 111.074 -178.059 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 56.6 54.57 35.3 Favored Glycine 0 C--N 1.339 0.74 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 -177.575 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 39.0 mt -127.15 140.55 52.18 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 125.393 1.477 . . . . 0.0 108.092 175.576 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.5 tp -72.11 121.42 19.22 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 125.843 1.657 . . . . 0.0 107.043 168.703 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.35 128.76 16.35 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 111.521 -0.631 . . . . 0.0 111.521 -178.645 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -107.91 94.6 5.16 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 126.904 2.082 . . . . 0.0 107.241 177.231 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.1 103.08 4.43 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 172.074 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 22.8 mt -82.74 161.15 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 N-CA-C 104.1 -2.556 . . . . 0.0 104.1 167.402 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -45.46 -47.75 11.88 Favored Glycine 0 CA--C 1.527 0.784 0 O-C-N 122.022 -0.424 . . . . 0.0 112.536 -166.878 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.438 ' OD2' ' NZ ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -81.94 -41.96 20.11 Favored 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 128.202 2.601 . . . . 0.0 109.227 -172.426 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.438 ' NZ ' ' OD2' ' A' ' 24' ' ' ASP . 5.1 ptpp? -155.87 161.39 40.6 Favored 'General case' 0 C--O 1.227 -0.118 0 CA-C-O 121.246 0.546 . . . . 0.0 112.314 -153.737 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.9 t -88.28 129.89 35.25 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.014 0.926 . . . . 0.0 110.744 179.078 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -117.26 172.43 7.31 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 168.032 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 82.3 m -147.8 100.84 3.26 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.401 1.08 . . . . 0.0 108.78 -169.895 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.8 m -97.22 154.24 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 O-C-N 121.012 -1.055 . . . . 0.0 109.133 176.515 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.5 ttmm . . . . . 0 N--CA 1.443 -0.815 0 O-C-N 121.673 -0.642 . . . . 0.0 109.901 170.648 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.171 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -69.0 84.77 0.33 Allowed 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 120.64 1.564 . . . . 0.0 107.083 163.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 21.3 t -67.8 107.37 2.58 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 105.201 -2.148 . . . . 0.0 105.201 167.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 -74.22 95.2 2.58 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.966 0.412 . . . . 0.0 110.387 -163.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.6 tp -53.93 -37.03 63.43 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.94 0.896 . . . . 0.0 112.103 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 72.6 ttt-85 -64.61 -48.84 73.42 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 119.62 1.1 . . . . 0.0 109.596 -178.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -61.95 -46.2 90.35 Favored 'General case' 0 N--CA 1.457 -0.117 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.4 t -56.42 -52.52 64.34 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 110.428 -0.212 . . . . 0.0 110.428 -178.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -51.49 -49.95 60.83 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 118.314 -0.851 . . . . 0.0 110.422 173.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.7 tp -58.28 -52.41 65.69 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 119.236 0.925 . . . . 0.0 110.909 -177.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.8 m -64.69 -42.84 95.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.535 0.683 . . . . 0.0 109.458 -172.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.5 m -64.29 -43.1 95.81 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 175.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -32.01 73.18 Favored 'General case' 0 C--O 1.226 -0.146 0 N-CA-C 107.165 -1.421 . . . . 0.0 107.165 -170.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.0 m -56.37 -33.41 65.69 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.142 0.428 . . . . 0.0 111.162 173.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 40.3 mt -91.86 12.29 22.05 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.9 0.88 . . . . 0.0 110.764 174.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.39 -20.61 36.6 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 125.139 1.352 . . . . 0.0 112.533 -177.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.0 mt -83.47 178.01 8.2 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.389 -1.065 . . . . 0.0 110.294 -152.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 13.3 tp -109.24 94.83 5.25 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.983 2.513 . . . . 0.0 107.347 -177.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -64.51 130.5 37.44 Favored Glycine 0 CA--C 1.523 0.534 0 CA-C-O 119.431 -0.65 . . . . 0.0 111.794 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.91 138.68 42.64 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 168.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -111.81 108.02 17.28 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 119.263 -0.399 . . . . 0.0 110.588 -155.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.5 mt -86.17 161.63 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -172.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -40.07 -49.97 3.52 Favored Glycine 0 CA--C 1.525 0.682 0 C-N-CA 125.283 1.421 . . . . 0.0 113.908 -172.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.74 -46.21 14.57 Favored 'General case' 0 N--CA 1.44 -0.941 0 C-N-CA 126.137 1.775 . . . . 0.0 108.875 -176.068 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -156.68 159.73 38.67 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -156.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 18.0 t -71.59 141.51 50.03 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.92 0.888 . . . . 0.0 111.173 175.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -127.67 172.6 10.63 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 167.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.5 m -145.01 97.36 3.0 Favored 'General case' 0 C--N 1.334 -0.068 0 C-N-CA 126.443 1.897 . . . . 0.0 107.241 -167.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -74.94 164.62 3.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 169.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.2 tttt -84.74 -76.68 0.3 Allowed 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 121.342 -0.849 . . . . 0.0 110.196 178.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 21.9 m170 -80.25 162.13 24.78 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.355 0.843 0 O-C-N 123.891 0.744 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.128 0 N-CA-C 105.747 -1.946 . . . . 0.0 105.747 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 51.8 t80 67.86 -56.89 0.47 Allowed 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 119.537 1.062 . . . . 0.0 109.365 -157.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.5 t -61.69 128.78 37.9 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 162.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -129.2 117.81 21.35 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 127.13 2.172 . . . . 0.0 107.335 -158.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 45.7 tp -46.08 -47.25 17.2 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.567 1.147 . . . . 0.0 112.084 174.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.1 ttm180 -60.19 -46.78 88.55 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.771 0.319 . . . . 0.0 110.22 -169.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 16.8 tmm? -67.9 -45.73 73.61 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 123.288 0.635 . . . . 0.0 109.342 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.1 t -53.97 -42.69 69.24 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.658 0.742 . . . . 0.0 111.231 -175.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -51.1 -33.73 27.4 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.918 1.287 . . . . 0.0 112.636 173.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.57 -46.35 59.66 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 123.886 0.874 . . . . 0.0 109.295 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.2 m -64.56 -53.28 50.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -176.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 97.2 m -64.8 -28.4 69.54 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.9 1.28 . . . . 0.0 110.943 -174.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.1 ttm105 -59.03 -20.16 50.56 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 117.938 -1.03 . . . . 0.0 111.123 177.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.6 p -50.53 -47.88 57.36 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 120.112 1.324 . . . . 0.0 110.899 175.158 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 81.9 mt -100.03 22.34 11.42 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.58 0.752 . . . . 0.0 109.424 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.12 20.25 60.22 Favored Glycine 0 C--N 1.334 0.463 0 C-N-CA 123.873 0.749 . . . . 0.0 113.042 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 33.5 mt -84.72 145.46 27.92 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.6 tt -76.68 97.85 4.57 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 105.237 -2.135 . . . . 0.0 105.237 175.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.5 148.12 48.03 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.715 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.443 ' NZ ' ' OE2' ' A' ' 27' ' ' GLU . 14.8 tptp -165.38 94.39 0.62 Allowed 'General case' 0 N--CA 1.425 -1.696 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 -140.408 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.7 t -74.53 116.62 15.42 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.243 -1.536 . . . . 0.0 110.973 -176.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 11.6 mm -84.68 161.24 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 162.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -25.31 -69.27 0.04 OUTLIER Glycine 0 CA--C 1.529 0.91 0 C-N-CA 125.886 1.708 . . . . 0.0 114.291 -169.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.73 -44.0 12.9 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 127.995 2.518 . . . . 0.0 108.928 179.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.1 mttm -108.78 129.38 55.38 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.006 0.522 . . . . 0.0 109.64 -151.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.3 t -65.04 118.91 9.83 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 164.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.443 ' OE2' ' NZ ' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -120.74 172.2 8.05 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 179.445 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 24.6 m -146.38 114.28 6.51 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 -165.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.5 m -103.03 145.46 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 171.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.7 tttm -82.46 80.4 8.63 Favored 'General case' 0 N--CA 1.437 -1.111 0 O-C-N 121.134 -0.979 . . . . 0.0 109.722 -178.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 72.43 -65.67 0.34 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.769 1.628 . . . . 0.0 109.668 175.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.067 0 O-C-N 124.281 0.988 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.045 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -75.14 63.21 1.28 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 120.137 1.335 . . . . 0.0 111.066 -178.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.4 t -71.89 89.3 1.07 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 176.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 64.3 t-20 -74.28 85.39 1.92 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.119 0.485 . . . . 0.0 110.363 -170.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.5 tp -49.63 -38.36 31.73 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.895 1.278 . . . . 0.0 112.148 176.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -64.54 -49.8 69.84 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.388 -0.82 . . . . 0.0 109.91 -177.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -65.42 -46.29 80.56 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.4 t -46.53 -50.81 16.64 Favored 'General case' 0 C--O 1.226 -0.139 0 C-N-CA 123.53 0.732 . . . . 0.0 109.846 178.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -58.27 -37.08 74.27 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 123.773 0.829 . . . . 0.0 112.94 177.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.8 tp -66.39 -45.73 79.02 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 119.799 1.181 . . . . 0.0 110.708 176.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.43 -45.49 87.3 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.3 m -63.45 -42.06 98.65 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.29 -31.91 70.7 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.5 m -71.52 -18.77 62.25 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 121.111 -0.993 . . . . 0.0 113.298 176.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 46.0 mt -93.85 6.21 49.14 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.892 0.877 . . . . 0.0 110.686 165.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.15 9.08 87.23 Favored Glycine 0 CA--C 1.527 0.822 0 O-C-N 120.743 -1.223 . . . . 0.0 113.126 -177.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 33.7 mt -105.15 148.92 26.36 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.267 1.427 . . . . 0.0 111.431 -171.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -79.6 124.09 28.21 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 127.145 2.178 . . . . 0.0 107.264 171.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -87.94 131.07 10.42 Favored Glycine 0 CA--C 1.525 0.711 0 CA-C-N 118.052 0.387 . . . . 0.0 112.945 -177.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -113.43 166.03 11.89 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 128.147 2.579 . . . . 0.0 109.09 175.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 33.4 t -119.4 130.18 55.18 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 169.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 4.5 mt -105.18 161.61 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 N-CA-C 105.804 -1.924 . . . . 0.0 105.804 161.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -46.33 -43.53 14.41 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 123.754 0.692 . . . . 0.0 113.531 -173.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -75.05 -47.0 31.12 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 126.383 1.873 . . . . 0.0 108.873 -175.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -156.51 164.01 38.72 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -153.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 14.7 t -64.73 138.0 58.13 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.617 1.167 . . . . 0.0 109.406 164.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.16 170.1 8.53 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 164.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 77.2 m -145.5 124.77 12.97 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 178.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.3 m -128.73 150.11 34.09 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.566 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 172.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -72.44 125.0 26.33 Favored 'General case' 0 N--CA 1.436 -1.142 0 O-C-N 120.732 -1.23 . . . . 0.0 111.598 -168.373 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 48.5 m80 -37.54 145.17 0.07 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.463 1.505 . . . . 0.0 111.403 169.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 0.995 0 O-C-N 123.917 0.761 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.977 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -67.42 -46.62 72.61 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 160.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -63.65 132.61 51.64 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 168.394 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -98.56 119.24 36.94 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 126.23 1.812 . . . . 0.0 108.494 171.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.6 tp -59.2 -35.33 73.41 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.82 0.848 . . . . 0.0 112.204 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -56.08 24.08 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 121.15 -0.969 . . . . 0.0 110.551 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 15.6 tmm? -54.58 -45.7 73.6 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 177.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.8 t -57.65 -57.52 12.38 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.85 -174.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -58.9 -40.06 83.33 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 122.09 -0.381 . . . . 0.0 110.737 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -57.13 -40.13 76.54 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 121.626 -0.671 . . . . 0.0 110.972 176.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.4 t -68.15 -51.67 43.36 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 176.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.6 m -64.15 -29.4 70.52 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.485 1.114 . . . . 0.0 110.82 -171.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.16 -46.37 12.01 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.512 1.125 . . . . 0.0 109.505 169.288 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -56.91 -28.29 61.78 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.105 0.411 . . . . 0.0 112.102 -175.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 mt -105.33 5.86 32.24 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 124.088 0.955 . . . . 0.0 111.15 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 56.2 52.59 48.54 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 -176.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 38.3 mt -126.75 142.27 51.59 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 125.415 1.486 . . . . 0.0 108.056 175.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.0 tt -76.39 109.64 10.26 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 105.704 -1.961 . . . . 0.0 105.704 170.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.27 134.07 28.75 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 177.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.47 165.39 21.71 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 167.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.7 t -132.07 102.98 6.03 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 122.075 -0.391 . . . . 0.0 110.013 -157.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.6 mt -82.99 161.31 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 N-CA-C 104.657 -2.349 . . . . 0.0 104.657 175.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -40.31 -55.6 3.01 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 123.966 0.793 . . . . 0.0 112.577 -166.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.03 -44.51 15.13 Favored 'General case' 0 N--CA 1.439 -0.988 0 C-N-CA 128.411 2.684 . . . . 0.0 107.697 -176.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -122.79 127.96 49.8 Favored 'General case' 0 C--N 1.334 -0.08 0 C-N-CA 124.037 0.935 . . . . 0.0 110.181 -145.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.6 t -64.62 140.89 58.91 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 161.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -140.29 172.09 13.23 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 106.857 -1.535 . . . . 0.0 106.857 167.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 65.7 m -145.83 108.69 4.54 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 -162.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.2 m -110.16 146.67 15.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 123.706 0.802 . . . . 0.0 109.727 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.6 tttp -85.65 50.06 1.89 Allowed 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 120.955 -1.091 . . . . 0.0 109.667 176.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -72.38 75.54 1.02 Allowed 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.402 1.081 . . . . 0.0 108.407 -178.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 1.009 0 O-C-N 124.334 1.021 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.746 0 N-CA-C 104.954 -2.239 . . . . 0.0 104.954 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.28 -52.43 52.85 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 157.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 44.8 t -66.04 124.38 22.4 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 174.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -108.65 114.69 28.7 Favored 'General case' 0 C--N 1.333 -0.119 0 C-N-CA 125.84 1.656 . . . . 0.0 107.583 169.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 38.4 tp -58.31 -38.48 77.18 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.414 0.686 . . . . 0.0 111.9 -178.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -51.33 69.52 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.555 0.616 . . . . 0.0 110.008 -178.391 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.0 -49.76 75.74 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.4 t -50.75 -52.71 37.94 Favored 'General case' 0 N--CA 1.46 0.055 0 CA-C-O 121.791 0.805 . . . . 0.0 110.337 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -60.19 -39.3 86.04 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 123.176 0.59 . . . . 0.0 111.284 177.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 40.5 tp -60.32 -43.24 96.54 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.676 -0.64 . . . . 0.0 111.204 176.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.78 -44.74 84.88 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.26 -0.9 . . . . 0.0 109.779 175.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -64.07 -36.04 82.7 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.538 0.335 . . . . 0.0 110.316 -173.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.4 ttt85 -45.13 -37.07 4.07 Favored 'General case' 0 C--N 1.341 0.211 0 C-N-CA 124.237 1.015 . . . . 0.0 111.163 170.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.3 t -55.81 -33.07 64.11 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.699 0.681 . . . . 0.0 111.027 -175.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.0 mt -107.64 15.38 24.75 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.778 0.831 . . . . 0.0 110.615 178.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.26 24.97 66.03 Favored Glycine 0 CA--C 1.524 0.624 0 O-C-N 121.387 -0.821 . . . . 0.0 113.152 -178.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 57.6 mt -98.81 162.37 13.14 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 123.78 0.832 . . . . 0.0 109.505 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 tt -105.51 104.43 14.16 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.99 1.716 . . . . 0.0 107.687 -174.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.96 123.79 31.02 Favored Glycine 0 CA--C 1.524 0.641 0 CA-C-O 119.306 -0.719 . . . . 0.0 112.148 -178.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.458 ' NZ ' ' OE1' ' A' ' 27' ' ' GLU . 2.2 pptp? -135.77 130.82 34.66 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 170.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 21.6 t -102.48 119.91 39.63 Favored 'General case' 0 N--CA 1.461 0.079 0 N-CA-C 112.486 0.551 . . . . 0.0 112.486 -166.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 13.5 mt -84.11 66.99 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 C-N-CA 125.591 1.556 . . . . 0.0 106.838 176.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.14 -84.1 0.51 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 125.524 1.535 . . . . 0.0 110.339 174.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.06 -45.44 18.31 Favored 'General case' 0 N--CA 1.44 -0.938 0 C-N-CA 125.61 1.564 . . . . 0.0 107.186 175.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.4 mttp -95.23 115.88 28.01 Favored 'General case' 0 C--O 1.227 -0.094 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 -155.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 20.1 t -64.53 119.05 9.72 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 165.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.458 ' OE1' ' NZ ' ' A' ' 20' ' ' LYS . 1.3 tm-20 -109.18 173.8 6.16 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 165.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 99.0 m -145.75 83.37 1.65 Allowed 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.616 1.567 . . . . 0.0 107.524 -167.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.4 m -76.46 144.25 12.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 C-N-CA 119.489 -0.884 . . . . 0.0 109.058 -173.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -81.18 94.41 6.65 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 175.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 10.8 t-160 -72.72 -118.52 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 160.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 0.979 0 O-C-N 123.25 0.344 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.559 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -72.31 104.84 3.85 Favored 'General case' 0 C--N 1.334 -0.078 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 172.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.2 t -83.58 83.96 7.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.989 0.423 . . . . 0.0 111.111 -173.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -73.3 90.67 1.65 Allowed 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 169.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 35.7 tp -50.04 -35.77 26.27 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.77 1.228 . . . . 0.0 112.112 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.7 mmm-85 -67.45 -46.1 74.05 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.253 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -62.91 -46.61 87.02 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 35.9 t -47.84 -52.66 18.21 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.714 0.769 . . . . 0.0 109.783 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -61.04 -32.8 72.41 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 123.65 0.78 . . . . 0.0 112.242 177.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 37.2 tp -66.4 -44.06 84.09 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.805 1.184 . . . . 0.0 111.126 175.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.31 -43.29 95.17 Favored 'General case' 0 C--N 1.332 -0.189 0 O-C-N 120.997 -1.064 . . . . 0.0 108.875 176.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 65.2 m -64.38 -40.63 96.21 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.952 -0.547 . . . . 0.0 109.576 -177.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.6 ttt85 -47.56 -49.49 26.37 Favored 'General case' 0 C--N 1.343 0.29 0 CA-C-N 119.261 0.937 . . . . 0.0 109.961 168.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.9 m -59.77 -31.25 69.5 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.837 -0.125 . . . . 0.0 110.917 -175.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 53.6 mt -89.61 -1.88 58.15 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.697 0.799 . . . . 0.0 112.304 175.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.13 28.89 70.98 Favored Glycine 0 CA--C 1.526 0.765 0 O-C-N 120.657 -1.277 . . . . 0.0 112.511 -177.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 52.2 mt -117.64 177.43 4.76 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 126.797 2.039 . . . . 0.0 108.474 -179.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -122.02 111.43 17.03 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 126.961 2.105 . . . . 0.0 107.445 -171.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -73.28 119.65 6.77 Favored Glycine 0 CA--C 1.523 0.534 0 CA-C-O 119.321 -0.711 . . . . 0.0 111.589 -174.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -137.19 149.39 47.2 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 170.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -123.88 121.02 34.26 Favored 'General case' 0 N--CA 1.462 0.126 0 O-C-N 121.327 -0.858 . . . . 0.0 112.978 -159.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.1 mm -84.5 67.03 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 175.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.08 -88.06 0.19 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 126.539 2.019 . . . . 0.0 110.674 173.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.56 -29.83 56.81 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.7 mttp -108.7 108.05 18.74 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.238 1.015 . . . . 0.0 109.789 -159.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.3 t -64.09 131.59 47.99 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 165.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -132.54 172.97 11.82 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 106.033 -1.839 . . . . 0.0 106.033 166.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 79.6 m -131.42 88.38 2.58 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 126.789 2.036 . . . . 0.0 106.157 -170.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.5 m -71.54 164.82 3.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 173.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.4 tptp -65.56 -52.28 53.55 Favored 'General case' 0 N--CA 1.433 -1.322 0 O-C-N 120.778 -1.201 . . . . 0.0 110.476 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 30.6 m80 -140.99 164.15 31.05 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 106.857 -1.535 . . . . 0.0 106.857 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.355 0.827 0 O-C-N 124.187 0.929 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.942 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -145.05 -39.24 0.26 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 124.625 1.17 . . . . 0.0 112.604 -161.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 t -64.29 127.22 30.54 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.677 0.791 . . . . 0.0 110.557 -170.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -100.56 108.74 20.74 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 108.512 -0.922 . . . . 0.0 108.512 175.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 44.1 tp -34.96 -53.42 0.57 Allowed 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 125.235 1.414 . . . . 0.0 114.672 -171.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 -45.99 -47.42 16.72 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-N 118.358 0.526 . . . . 0.0 111.813 -176.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 49.8 ttm -63.75 -53.41 51.47 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 -176.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.8 t -49.83 -54.69 17.77 Favored 'General case' 0 C--O 1.231 0.087 0 CA-C-O 121.593 0.711 . . . . 0.0 110.705 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -49.48 -51.54 35.39 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 125.401 1.481 . . . . 0.0 110.324 176.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 47.2 tp -61.5 -47.78 84.05 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.092 0.557 . . . . 0.0 111.051 -177.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 p -64.52 -47.53 78.49 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -175.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.1 m -64.41 -39.84 94.62 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -178.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.48 -38.76 75.06 Favored 'General case' 0 C--O 1.228 -0.074 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 m -63.61 -28.51 69.97 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.063 -0.398 . . . . 0.0 111.591 178.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 43.0 mt -88.24 3.52 49.16 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.889 0.876 . . . . 0.0 111.302 171.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 69.92 29.59 70.76 Favored Glycine 0 C--N 1.336 0.533 0 O-C-N 120.988 -1.07 . . . . 0.0 112.227 -177.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 70.6 mt -118.37 152.69 35.35 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 125.917 1.687 . . . . 0.0 109.064 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.0 tp -85.93 96.73 9.9 Favored 'General case' 0 N--CA 1.442 -0.835 0 C-N-CA 127.067 2.147 . . . . 0.0 106.86 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -65.91 114.4 6.56 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.483 -0.865 . . . . 0.0 111.264 -178.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.64 112.77 25.28 Favored 'General case' 0 N--CA 1.438 -1.072 0 N-CA-C 104.881 -2.266 . . . . 0.0 104.881 173.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.6 t -77.15 113.15 14.58 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 124.378 1.071 . . . . 0.0 109.29 177.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 30.1 mm -84.49 159.79 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 160.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -49.18 -48.2 32.73 Favored Glycine 0 C--O 1.224 -0.488 0 CA-C-O 121.982 0.768 . . . . 0.0 112.96 -159.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.2 -36.42 18.0 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 130.225 3.41 . . . . 0.0 115.964 177.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.0 tptt -133.93 129.5 36.4 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 -161.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.3 t -68.48 126.64 30.29 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 118.171 -0.919 . . . . 0.0 109.767 170.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -108.94 172.12 7.03 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 105.679 -1.971 . . . . 0.0 105.679 163.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.0 m -145.04 84.67 1.72 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 -168.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -70.07 172.1 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -84.75 155.83 21.69 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.308 -1.495 . . . . 0.0 111.557 -172.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -32.62 90.53 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.188 1.395 . . . . 0.0 109.713 154.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 0.953 0 O-C-N 124.189 0.931 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.633 0 N-CA-C 104.673 -2.343 . . . . 0.0 104.673 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -63.27 -58.81 5.93 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 154.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.1 t -63.84 136.29 57.28 Favored 'General case' 0 C--O 1.239 0.544 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 176.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -98.7 110.47 23.06 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 126.374 1.87 . . . . 0.0 108.201 175.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 45.0 tp -51.07 -43.84 61.07 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 123.829 0.852 . . . . 0.0 112.16 177.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 63.8 ttp85 -62.83 -42.86 99.9 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.95 0.796 . . . . 0.0 110.717 -172.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 13.5 tmm? -61.7 -49.6 75.82 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 174.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.3 t -55.0 -52.02 64.42 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.911 -175.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -50.61 -55.06 18.04 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.06 1.344 . . . . 0.0 110.772 172.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 tp -56.72 -38.35 72.22 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.2 m -71.55 -53.4 13.92 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.11 0.481 . . . . 0.0 109.738 -178.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.3 m -64.35 -27.58 69.11 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 124.413 1.085 . . . . 0.0 110.663 -174.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 44.9 ttt180 -52.75 -25.47 11.28 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.217 -0.896 . . . . 0.0 111.273 173.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.6 p -50.38 -43.16 54.32 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 120.221 1.373 . . . . 0.0 111.29 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.7 mt -102.87 18.79 20.68 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.107 0.963 . . . . 0.0 110.132 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.21 31.25 72.79 Favored Glycine 0 CA--C 1.522 0.503 0 O-C-N 121.632 -0.668 . . . . 0.0 112.866 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 65.7 mt -98.43 139.16 34.59 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.784 0.833 . . . . 0.0 108.823 178.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 39.2 tp -63.59 108.31 1.36 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 165.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.22 129.09 22.96 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 108.925 -1.67 . . . . 0.0 108.925 167.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.57 153.54 48.69 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 174.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.2 t -128.96 100.83 5.81 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -146.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.7 mt -83.72 161.02 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 N-CA-C 105.383 -2.08 . . . . 0.0 105.383 173.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -40.87 -55.31 3.39 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 124.289 0.947 . . . . 0.0 112.854 -163.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.83 -43.91 12.9 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 127.234 2.214 . . . . 0.0 109.63 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -115.31 125.97 53.9 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.182 0.593 . . . . 0.0 109.791 -151.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.1 t -73.12 129.31 37.78 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 163.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -118.94 172.5 7.5 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 171.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.0 m -143.54 126.14 15.94 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 106.332 -1.729 . . . . 0.0 106.332 -173.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.4 m -135.53 152.99 32.44 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-N 118.423 0.556 . . . . 0.0 109.514 175.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 38.2 tttm -76.3 141.64 41.56 Favored 'General case' 0 N--CA 1.436 -1.157 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 174.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.4 m80 70.81 -63.94 0.39 Allowed 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 125.046 1.338 . . . . 0.0 109.925 -176.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.079 0 O-C-N 124.401 1.063 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.529 0 CA-C-O 116.77 -1.586 . . . . 0.0 108.021 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -176.31 -49.99 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 119.821 1.191 . . . . 0.0 110.423 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.4 t -64.42 114.04 4.05 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.014 0.926 . . . . 0.0 112.337 -164.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -75.81 112.26 12.01 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 159.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 48.9 tp -48.6 -42.45 34.0 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.535 1.134 . . . . 0.0 113.342 178.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.18 -54.11 48.43 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 118.81 0.732 . . . . 0.0 109.848 -178.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -60.47 -44.53 95.79 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.5 t -51.38 -57.55 8.65 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.543 0.687 . . . . 0.0 109.866 177.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -61.66 -34.82 76.4 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-O 117.984 -1.008 . . . . 0.0 111.458 -178.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 44.1 tp -63.0 -45.14 93.83 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.89 1.223 . . . . 0.0 110.637 175.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.0 m -64.89 -47.35 78.13 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.8 m -64.03 -43.82 94.41 Favored 'General case' 0 CA--C 1.535 0.365 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 -178.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -44.91 -53.61 7.41 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 125.688 1.595 . . . . 0.0 109.538 168.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 12.8 m -54.98 -44.21 74.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 118.235 0.47 . . . . 0.0 111.111 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.4 mt -75.28 -7.41 53.85 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.399 0.68 . . . . 0.0 112.454 177.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.97 43.84 25.81 Favored Glycine 0 C--N 1.334 0.457 0 CA-C-O 122.174 0.874 . . . . 0.0 111.298 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 54.1 mt -136.55 157.39 46.88 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 126.418 1.887 . . . . 0.0 108.403 -177.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.1 tp -90.78 108.01 19.56 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.67 1.988 . . . . 0.0 107.224 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.33 136.05 27.96 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.657 -0.782 . . . . 0.0 111.716 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 pptp? -134.57 153.47 51.94 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 166.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.6 t -134.08 96.87 3.72 Favored 'General case' 0 CA--C 1.518 -0.271 0 O-C-N 121.972 -0.455 . . . . 0.0 111.297 -154.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 6.2 mt -86.56 65.46 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 -177.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.72 -73.33 0.25 Allowed Glycine 0 CA--C 1.528 0.877 0 C-N-CA 124.374 0.988 . . . . 0.0 112.633 172.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.89 -49.96 7.47 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 126.217 1.807 . . . . 0.0 110.808 165.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -88.88 99.55 12.48 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -160.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 33.8 t -63.48 132.03 50.05 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 106.949 -1.501 . . . . 0.0 106.949 161.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -128.39 171.73 11.77 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 104.646 -2.353 . . . . 0.0 104.646 174.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -146.3 86.44 1.69 Allowed 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 -169.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -71.94 163.62 3.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 178.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.0 ttmm -95.67 -22.43 17.57 Favored 'General case' 0 N--CA 1.437 -1.122 0 O-C-N 121.476 -0.765 . . . . 0.0 111.318 174.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 13.5 m170 -127.1 147.54 50.17 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 -173.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.356 0.85 0 O-C-N 124.12 0.888 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.513 0 N-CA-C 105.358 -2.09 . . . . 0.0 105.358 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -150.77 -59.99 0.18 Allowed 'General case' 0 CA--C 1.533 0.321 0 O-C-N 124.088 0.867 . . . . 0.0 111.456 -156.475 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.9 t -64.57 110.87 2.47 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -163.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -75.18 84.07 2.37 Favored 'General case' 0 CA--C 1.527 0.08 0 O-C-N 121.466 -0.771 . . . . 0.0 109.688 173.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.1 tp -35.99 -48.2 0.57 Allowed 'General case' 0 C--O 1.224 -0.275 0 C-N-CA 125.782 1.633 . . . . 0.0 113.768 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 70.4 mtm180 -55.34 -48.68 73.83 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 122.163 -0.336 . . . . 0.0 111.045 -176.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -65.41 -50.19 66.41 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 45.7 t -47.27 -52.67 15.47 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 121.646 0.736 . . . . 0.0 110.464 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -51.82 -47.09 64.49 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 124.121 0.968 . . . . 0.0 111.609 177.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 37.1 tp -67.27 -48.6 67.22 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 122.611 0.364 . . . . 0.0 110.186 -176.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.7 m -64.16 -41.03 97.31 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -174.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.0 m -64.92 -46.57 81.09 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 176.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.3 ttp-105 -58.12 -34.45 70.24 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 121.933 -0.48 . . . . 0.0 109.91 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.9 m -57.49 -29.46 64.29 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.679 0.672 . . . . 0.0 111.546 177.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 57.7 mt -99.9 14.48 30.3 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.185 0.994 . . . . 0.0 110.825 176.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.04 7.99 68.13 Favored Glycine 0 CA--C 1.527 0.811 0 O-C-N 120.996 -1.065 . . . . 0.0 113.235 -178.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 32.1 mt -92.05 145.22 24.69 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 122.179 0.99 . . . . 0.0 109.798 -175.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.5 tp -76.41 107.6 8.79 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 125.37 1.468 . . . . 0.0 107.193 170.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -90.2 138.26 14.4 Favored Glycine 0 C--N 1.331 0.29 0 CA-C-O 118.902 -0.944 . . . . 0.0 111.838 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.94 159.38 38.04 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 173.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 95.9 m -83.44 126.59 32.92 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 121.199 -0.938 . . . . 0.0 110.921 -176.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 14.8 mm -85.03 162.01 3.0 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 152.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -39.24 -56.72 2.26 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 124.921 1.248 . . . . 0.0 113.738 -171.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.37 -43.07 15.08 Favored 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 124.79 1.236 . . . . 0.0 108.606 -179.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.6 mttm -118.5 151.67 37.41 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 123.106 0.562 . . . . 0.0 110.902 -151.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.9 t -66.54 131.24 45.59 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 154.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -104.18 167.35 9.81 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 105.534 -2.025 . . . . 0.0 105.534 164.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 66.7 m -141.12 114.18 8.54 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 103.696 -2.705 . . . . 0.0 103.696 168.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.0 m -108.67 152.23 10.71 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.681 0 N-CA-C 106.519 -1.659 . . . . 0.0 106.519 168.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.07 122.7 22.21 Favored 'General case' 0 N--CA 1.432 -1.375 0 O-C-N 120.959 -1.088 . . . . 0.0 110.305 -173.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 24.8 t-80 -52.5 160.38 0.86 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.012 1.325 . . . . 0.0 111.593 174.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 0.988 0 O-C-N 123.675 0.609 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.338 0 N-CA-C 106.039 -1.837 . . . . 0.0 106.039 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 44.4 t80 70.67 -53.26 0.66 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 120.651 1.569 . . . . 0.0 110.477 -170.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.7 t -61.91 123.24 17.51 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 106.361 -1.718 . . . . 0.0 106.361 168.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -93.83 130.44 39.86 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 123.732 0.813 . . . . 0.0 108.94 -176.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 31.7 tp -58.95 -45.39 90.57 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.541 0.337 . . . . 0.0 111.39 -173.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -61.99 -42.71 99.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 -176.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -58.37 -52.24 66.42 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.9 t -53.32 -55.92 20.89 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.652 -176.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -55.81 -46.59 78.0 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.318 1.047 . . . . 0.0 111.767 177.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.0 tt -56.78 -42.07 78.78 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 121.754 -0.591 . . . . 0.0 110.4 178.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 m -66.8 -50.39 62.8 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.4 m -63.52 -33.41 75.53 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.914 1.285 . . . . 0.0 109.616 -173.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.46 -26.75 21.57 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.517 1.527 . . . . 0.0 110.502 177.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.0 m -53.63 -36.92 62.56 Favored 'General case' 0 C--O 1.225 -0.198 0 O-C-N 121.025 -1.047 . . . . 0.0 112.961 175.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 mt -111.99 22.61 14.67 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.125 0.57 . . . . 0.0 109.929 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 58.47 26.33 59.33 Favored Glycine 0 CA--C 1.526 0.773 0 CA-C-O 122.04 0.8 . . . . 0.0 113.084 -179.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.4 mt -92.95 156.65 16.78 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 122.064 0.935 . . . . 0.0 108.766 178.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 tt -98.7 95.89 7.55 Favored 'General case' 0 N--CA 1.441 -0.921 0 C-N-CA 129.346 3.058 . . . . 0.0 106.514 -170.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.42 131.19 29.53 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.522 -0.847 . . . . 0.0 111.909 -177.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.424 ' NZ ' ' OE1' ' A' ' 27' ' ' GLU . 13.0 pttp -135.51 134.95 40.03 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 159.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 57.2 m -74.93 114.64 13.63 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 174.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.4 mt -83.44 162.57 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 N-CA-C 105.26 -2.126 . . . . 0.0 105.26 166.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -34.85 -57.3 0.79 Allowed Glycine 0 CA--C 1.525 0.674 0 C-N-CA 125.27 1.414 . . . . 0.0 112.987 -166.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.46 -43.21 19.19 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 127.837 2.455 . . . . 0.0 109.82 -172.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.22 164.35 38.92 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -160.233 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.6 t -64.96 133.14 51.11 Favored 'General case' 0 C--N 1.333 -0.114 0 C-N-CA 124.008 0.923 . . . . 0.0 110.225 174.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.424 ' OE1' ' NZ ' ' A' ' 20' ' ' LYS . 5.1 tm-20 -118.38 170.94 8.5 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 106.472 -1.677 . . . . 0.0 106.472 161.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 94.9 m -146.12 82.81 1.61 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 -168.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -72.69 150.47 8.3 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 -176.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.6 ttpt -81.3 150.35 28.54 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 118.895 -1.122 . . . . 0.0 111.854 -164.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 68.48 66.82 0.32 Allowed 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 125.271 1.428 . . . . 0.0 109.34 -177.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.363 1.175 0 O-C-N 124.464 1.103 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.537 0 N-CA-C 104.79 -2.3 . . . . 0.0 104.79 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -143.93 -48.52 0.28 Allowed 'General case' 0 C--N 1.333 -0.142 0 O-C-N 124.551 1.157 . . . . 0.0 109.828 -155.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.0 t -63.15 122.52 16.31 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 120.343 -0.543 . . . . 0.0 109.68 177.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 64.9 t-20 -74.87 76.08 2.14 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.154 0.582 . . . . 0.0 109.652 -176.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 32.7 tp -44.48 -45.19 9.05 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.485 1.114 . . . . 0.0 111.648 -179.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 69.2 ttp85 -56.79 -49.68 74.6 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 122.352 0.261 . . . . 0.0 111.338 -177.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -69.21 -49.31 57.6 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.7 t -46.23 -51.04 15.09 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 124.244 1.017 . . . . 0.0 110.595 -175.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -55.05 -45.02 75.22 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.77 -179.634 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 32.0 tp -70.11 -47.3 62.4 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.141 0.576 . . . . 0.0 109.79 -174.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 p -64.18 -45.82 86.71 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 -176.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.0 m -64.34 -40.31 95.63 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.2 ttp-105 -62.54 -41.75 99.08 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -178.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.5 m -57.32 -35.04 69.36 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.188 0.449 . . . . 0.0 111.422 175.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.6 mt -85.08 5.18 30.75 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.598 0.759 . . . . 0.0 111.669 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 61.54 47.17 92.17 Favored Glycine 0 C--N 1.334 0.461 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 23.5 mt -131.46 148.88 52.68 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 126.507 1.923 . . . . 0.0 108.582 175.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.8 tp -82.16 107.13 14.62 Favored 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 171.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.03 129.71 29.63 Favored Glycine 0 N--CA 1.451 -0.307 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 178.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.17 131.32 40.28 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 176.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 m -80.27 133.28 35.97 Favored 'General case' 0 CA--C 1.515 -0.373 0 O-C-N 121.084 -1.01 . . . . 0.0 109.734 177.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.9 mm -84.34 160.44 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.683 0 N-CA-C 104.324 -2.473 . . . . 0.0 104.324 149.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.21 -47.78 41.43 Favored Glycine 0 CA--C 1.528 0.862 0 O-C-N 121.449 -0.782 . . . . 0.0 112.355 -171.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.93 -44.65 47.44 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 127.034 2.134 . . . . 0.0 107.765 -172.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -155.01 152.99 30.31 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-O 121.529 0.68 . . . . 0.0 110.883 -151.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.9 t -70.93 140.78 51.07 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 124.348 1.059 . . . . 0.0 111.182 -178.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -128.23 171.97 11.47 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 106.53 -1.655 . . . . 0.0 106.53 163.327 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 86.4 m -146.08 102.38 3.62 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 -170.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.2 m -89.03 166.81 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 172.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm -77.88 162.33 26.92 Favored 'General case' 0 N--CA 1.44 -0.963 0 O-C-N 120.752 -1.218 . . . . 0.0 108.941 172.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 22.4 m170 -61.42 89.09 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.247 0.619 . . . . 0.0 109.343 -176.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 1.004 0 O-C-N 124.413 1.071 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.851 0 CA-C-O 116.472 -1.728 . . . . 0.0 108.388 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -137.34 136.15 37.68 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 120.331 1.423 . . . . 0.0 107.695 -175.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.4 t -127.86 127.77 44.03 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 118.489 0.586 . . . . 0.0 110.663 -157.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 62.7 t-20 -74.72 85.5 2.15 Favored 'General case' 0 N--CA 1.463 0.203 0 O-C-N 121.631 -0.668 . . . . 0.0 109.416 179.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.9 tp -48.11 -43.77 31.25 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.702 0.801 . . . . 0.0 111.969 176.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -66.12 -45.78 79.88 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.859 -0.526 . . . . 0.0 110.297 -172.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -60.13 -49.16 78.74 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 175.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.1 t -51.0 -54.43 24.61 Favored 'General case' 0 CA--C 1.523 -0.077 0 CA-C-O 121.309 0.576 . . . . 0.0 110.787 -176.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -53.83 -47.29 71.08 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 124.45 1.1 . . . . 0.0 110.801 176.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 41.9 tp -60.74 -42.75 97.99 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 119.178 -0.439 . . . . 0.0 111.61 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.91 -51.0 52.87 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 119.1 0.864 . . . . 0.0 109.611 179.079 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.1 m -63.58 -31.8 73.08 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 124.101 0.96 . . . . 0.0 109.018 -171.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -49.25 -29.89 6.41 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.356 -0.831 . . . . 0.0 111.942 172.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 80.1 p -52.68 -40.71 63.16 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 120.175 1.352 . . . . 0.0 111.483 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.4 mt -104.5 21.35 16.9 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.826 0.85 . . . . 0.0 109.953 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.2 33.71 86.82 Favored Glycine 0 C--N 1.335 0.509 0 CA-C-O 122.209 0.894 . . . . 0.0 111.882 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.9 mt -102.39 132.34 48.46 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-O 121.866 0.841 . . . . 0.0 109.373 -178.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.3 tp -68.01 94.61 0.5 Allowed 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 125.668 1.587 . . . . 0.0 106.955 170.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.47 123.7 29.84 Favored Glycine 0 N--CA 1.448 -0.535 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 170.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.2 143.62 46.5 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 106.789 -1.56 . . . . 0.0 106.789 173.35 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 t -129.29 96.36 4.28 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 -145.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.4 mt -83.06 159.87 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 N-CA-C 104.109 -2.552 . . . . 0.0 104.109 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -46.31 -49.9 14.1 Favored Glycine 0 CA--C 1.53 0.972 0 CA-C-O 122.504 1.058 . . . . 0.0 113.45 -162.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.47 -24.24 24.19 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 130.814 3.646 . . . . 0.0 115.241 -177.115 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.5 mmtm -138.91 118.16 12.71 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.049 0.94 . . . . 0.0 112.402 -170.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.2 t -64.29 124.46 21.79 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 155.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -117.67 172.05 7.62 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 105.832 -1.914 . . . . 0.0 105.832 171.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.0 m -142.56 98.75 3.36 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.751 1.62 . . . . 0.0 107.655 -172.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -83.04 173.26 0.96 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 172.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.7 ttmp? -79.75 140.2 37.01 Favored 'General case' 0 N--CA 1.444 -0.762 0 O-C-N 119.975 -1.703 . . . . 0.0 109.913 170.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -48.43 -39.56 23.15 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.542 0.61 . . . . 0.0 111.018 169.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 1.002 0 O-C-N 122.736 0.023 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.25 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 62.52 31.03 17.18 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 119.364 0.984 . . . . 0.0 113.35 173.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.1 t -64.97 133.77 52.45 Favored 'General case' 0 C--O 1.234 0.24 0 O-C-N 121.936 -0.478 . . . . 0.0 109.747 176.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 63.8 t-20 -74.64 83.69 2.07 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 122.112 0.958 . . . . 0.0 108.891 178.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 24.2 tp -56.44 -34.89 67.27 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.642 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.71 -48.79 79.14 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.875 0.761 . . . . 0.0 110.739 177.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -58.38 -49.28 77.82 Favored 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 109.047 -0.724 . . . . 0.0 109.047 177.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.6 t -51.52 -52.75 44.31 Favored 'General case' 0 C--O 1.227 -0.116 0 CA-C-O 121.022 0.439 . . . . 0.0 110.542 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -52.37 -48.46 65.58 Favored 'General case' 0 N--CA 1.444 -0.759 0 C-N-CA 123.129 0.572 . . . . 0.0 111.481 175.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.0 tp -63.1 -49.6 73.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.436 0.562 . . . . 0.0 111.197 -176.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.1 m -64.71 -42.37 95.31 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 121.376 -0.828 . . . . 0.0 109.695 -177.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 87.2 m -63.9 -42.85 97.34 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.3 ttt85 -54.86 -46.91 74.76 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.0 m -58.24 -35.18 71.32 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 117.949 0.34 . . . . 0.0 111.05 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.5 mt -84.92 1.73 45.98 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.543 0.737 . . . . 0.0 111.851 176.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.97 47.7 64.31 Favored Glycine 0 C--N 1.334 0.422 0 O-C-N 120.71 -1.244 . . . . 0.0 110.148 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.9 mt -136.49 177.69 7.65 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 128.13 2.572 . . . . 0.0 107.48 176.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -125.13 110.76 14.5 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 126.29 1.836 . . . . 0.0 106.914 -175.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -73.46 123.59 8.38 Favored Glycine 0 N--CA 1.449 -0.491 0 CA-C-O 119.451 -0.639 . . . . 0.0 112.445 -173.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.4 ' NZ ' ' OE1' ' A' ' 27' ' ' GLU . 1.9 pptp? -134.99 133.48 39.5 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 106.006 -1.85 . . . . 0.0 106.006 167.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 30.2 t -103.78 136.84 42.71 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -165.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 23.2 mt -97.85 163.33 2.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 125.68 1.592 . . . . 0.0 107.274 176.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -12.55 -70.55 0.01 OUTLIER Glycine 0 CA--C 1.532 1.141 0 C-N-CA 127.839 2.638 . . . . 0.0 116.352 -176.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.92 -47.9 9.22 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 126.639 1.976 . . . . 0.0 108.927 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -136.93 149.39 47.55 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.969 0.89 . . . . 0.0 113.159 -146.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.5 t -64.87 139.59 58.78 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.161 1.784 . . . . 0.0 111.307 -178.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.4 ' OE1' ' NZ ' ' A' ' 20' ' ' LYS . 4.0 tm-20 -122.95 172.76 8.25 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 105.241 -2.133 . . . . 0.0 105.241 160.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 94.4 m -145.87 83.69 1.65 Allowed 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 -164.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 31.4 m -72.28 157.17 6.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -177.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 43.9 tptt -85.09 67.11 10.07 Favored 'General case' 0 N--CA 1.437 -1.082 0 O-C-N 121.35 -0.844 . . . . 0.0 112.368 -167.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 26.13 49.44 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.873 2.469 . . . . 0.0 114.696 157.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 0.941 0 O-C-N 123.874 0.734 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.565 0 N-CA-C 103.629 -2.73 . . . . 0.0 103.629 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 37.7 p90 44.87 -178.43 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.703 0 O-C-N 125.888 1.992 . . . . 0.0 111.2 -131.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.6 t -66.17 114.82 5.57 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 123.478 0.711 . . . . 0.0 111.106 -178.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -74.58 98.98 3.5 Favored 'General case' 0 C--N 1.333 -0.111 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 170.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.8 tp -50.48 -37.05 36.59 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.965 0.906 . . . . 0.0 112.333 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.38 -52.08 44.31 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 121.358 -0.839 . . . . 0.0 110.506 -176.062 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -61.61 -42.98 99.64 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.2 t -50.76 -57.44 8.34 Favored 'General case' 0 CA--C 1.523 -0.083 0 CA-C-O 121.487 0.66 . . . . 0.0 109.226 177.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -60.99 -37.33 82.1 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 122.827 0.451 . . . . 0.0 111.93 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 31.2 tp -60.93 -43.03 99.19 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.095 0.861 . . . . 0.0 110.468 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.5 m -67.1 -44.78 79.09 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.8 m -63.77 -41.24 98.0 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -177.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.81 -30.93 4.4 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 125.315 1.446 . . . . 0.0 111.164 172.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.0 t -51.69 -44.3 63.07 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.696 1.135 . . . . 0.0 109.825 -177.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 57.5 mt -108.69 25.22 11.99 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.97 0.908 . . . . 0.0 110.266 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 61.01 27.16 66.7 Favored Glycine 0 CA--C 1.526 0.753 0 CA-C-O 121.858 0.699 . . . . 0.0 113.386 177.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.8 mt -91.64 172.24 8.63 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 123.897 0.879 . . . . 0.0 109.391 177.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.1 tt -126.2 97.64 5.16 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 127.292 2.237 . . . . 0.0 106.269 -161.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.32 125.06 11.56 Favored Glycine 0 CA--C 1.526 0.763 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.581 -168.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.5 mtpm? -124.73 120.0 30.53 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 126.134 1.774 . . . . 0.0 107.925 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.0 m -74.78 130.53 39.64 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 6.2 mt -111.73 66.42 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 125.391 1.476 . . . . 0.0 107.54 169.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.99 -88.8 0.48 Allowed Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 126.429 1.966 . . . . 0.0 110.319 173.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.74 -45.25 21.58 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 176.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.9 mttp -88.99 157.09 18.5 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.25 0.62 . . . . 0.0 109.714 -162.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.7 t -101.81 123.82 46.41 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 164.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -104.88 170.2 8.01 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 167.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 92.2 m -149.57 85.12 1.43 Allowed 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.943 1.697 . . . . 0.0 110.253 -169.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.6 m -76.23 166.09 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 O-C-N 120.69 -1.256 . . . . 0.0 110.294 177.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.4 mtmt -79.49 160.65 26.47 Favored 'General case' 0 N--CA 1.439 -0.979 0 O-C-N 121.145 -0.972 . . . . 0.0 111.797 -174.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 64.9 t-80 58.41 61.8 2.16 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.884 1.274 . . . . 0.0 109.405 -178.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.083 0 O-C-N 124.167 0.917 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.177 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -75.23 71.81 2.27 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 119.605 1.093 . . . . 0.0 110.084 -178.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 40.9 t -64.89 127.75 32.9 Favored 'General case' 0 C--N 1.333 -0.126 0 O-C-N 121.928 -0.482 . . . . 0.0 110.372 178.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -74.66 86.18 2.14 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 176.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.2 tp -53.87 -37.4 63.67 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.676 0.79 . . . . 0.0 111.601 176.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.62 -49.19 78.73 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.722 0.692 . . . . 0.0 109.917 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -59.21 -52.35 66.08 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 178.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.7 t -51.95 -50.06 61.94 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 122.023 0.916 . . . . 0.0 110.852 -176.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -54.42 -46.87 73.28 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.395 176.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.92 -49.76 71.38 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.084 0.554 . . . . 0.0 111.493 -177.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.6 p -64.55 -42.27 95.79 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.44 -0.787 . . . . 0.0 109.222 -176.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.1 m -63.78 -42.97 97.65 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.01 -42.43 94.27 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 -178.07 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.9 m -55.88 -43.51 77.25 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 120.82 -1.175 . . . . 0.0 111.232 175.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.9 mt -72.91 -4.71 33.69 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 122.751 0.42 . . . . 0.0 111.648 175.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.02 14.84 82.21 Favored Glycine 0 CA--C 1.524 0.625 0 O-C-N 121.184 -0.947 . . . . 0.0 111.866 -178.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 24.0 mt -100.76 -179.73 4.16 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 125.884 1.674 . . . . 0.0 107.884 177.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -121.62 104.39 9.59 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 -171.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -77.15 130.77 10.65 Favored Glycine 0 C--N 1.332 0.351 0 CA-C-O 119.428 -0.651 . . . . 0.0 113.239 -170.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.88 130.76 27.8 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 106.474 -1.676 . . . . 0.0 106.474 168.228 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.6 t -99.71 124.96 45.47 Favored 'General case' 0 CA--C 1.518 -0.271 0 O-C-N 121.933 -0.479 . . . . 0.0 111.125 -174.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.6 mt -84.85 161.98 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 172.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -45.57 -36.23 6.03 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.444 1.021 . . . . 0.0 114.195 -177.024 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -57.83 3.67 Favored 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 127.933 2.493 . . . . 0.0 107.872 -179.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.65 155.9 30.85 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -152.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.5 t -66.59 133.03 49.47 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 124.15 0.98 . . . . 0.0 110.877 171.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.9 172.08 9.67 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 164.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 76.8 m -145.81 89.98 1.95 Allowed 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 126.507 1.923 . . . . 0.0 106.31 -167.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.6 m -70.19 146.81 11.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 174.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.9 ttpp -90.12 68.14 7.07 Favored 'General case' 0 N--CA 1.435 -1.215 0 O-C-N 121.37 -0.832 . . . . 0.0 111.137 -164.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -103.31 48.83 0.84 Allowed 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 161.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 0.98 0 O-C-N 124.326 1.016 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.763 0 N-CA-C 105.956 -1.868 . . . . 0.0 105.956 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -65.02 156.95 29.71 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 120.217 1.372 . . . . 0.0 107.667 162.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.0 t -64.69 109.46 2.03 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.108 0.48 . . . . 0.0 110.033 176.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -74.64 99.89 3.79 Favored 'General case' 0 C--N 1.334 -0.088 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 170.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 56.0 tp -39.51 -46.91 1.8 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.784 1.634 . . . . 0.0 113.291 174.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.8 ttt85 -64.02 -44.45 92.54 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 119.006 0.821 . . . . 0.0 109.797 -174.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -61.75 -48.25 81.52 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 174.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 54.1 t -53.16 -55.06 27.13 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.834 0.826 . . . . 0.0 109.582 -176.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.3 mm-40 -57.24 -46.15 83.27 Favored 'General case' 0 N--CA 1.44 -0.958 0 O-C-N 121.888 -0.508 . . . . 0.0 110.888 178.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 46.6 tp -62.74 -46.45 88.02 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.686 0.675 . . . . 0.0 111.482 -176.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.4 p -64.98 -45.13 86.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -178.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 88.4 m -62.95 -42.8 99.93 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -41.53 77.3 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 177.128 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.9 m -68.54 -27.21 65.89 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 177.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 69.1 mt -80.18 -3.85 50.66 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.545 0.612 . . . . 0.0 111.534 167.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 75.32 29.13 60.61 Favored Glycine 0 C--N 1.337 0.591 0 CA-C-N 119.299 0.954 . . . . 0.0 111.444 -177.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 30.8 mt -123.55 -176.44 3.45 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.847 2.059 . . . . 0.0 108.17 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.9 tp -135.45 113.95 11.65 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 126.193 1.797 . . . . 0.0 107.992 -166.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.14 144.76 45.22 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 121.441 -0.409 . . . . 0.0 112.997 -165.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -127.99 87.11 2.56 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 128.16 2.584 . . . . 0.0 105.375 171.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -78.28 98.11 5.8 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 123.602 0.761 . . . . 0.0 110.728 -176.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.4 mt -87.96 161.34 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 N-CA-C 106.703 -1.592 . . . . 0.0 106.703 164.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.36 -53.53 23.8 Favored Glycine 0 CA--C 1.523 0.544 0 O-C-N 121.989 -0.444 . . . . 0.0 113.293 -166.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.4 -26.13 26.61 Favored 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 124.859 1.263 . . . . 0.0 110.435 179.702 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -129.02 110.47 12.08 Favored 'General case' 0 C--O 1.226 -0.14 0 C-N-CA 123.368 0.667 . . . . 0.0 110.162 -156.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 31.6 t -76.42 117.67 18.32 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 164.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -103.49 170.95 7.64 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 171.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.8 m -148.48 84.67 1.49 Allowed 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.669 1.588 . . . . 0.0 109.165 -171.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.7 m -70.7 154.84 7.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 118.941 -1.104 . . . . 0.0 109.306 178.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -82.84 75.22 9.75 Favored 'General case' 0 N--CA 1.436 -1.134 0 O-C-N 121.368 -0.832 . . . . 0.0 109.671 -178.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 23.8 t-80 48.76 -106.93 0.2 Allowed 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.729 1.612 . . . . 0.0 110.093 -177.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 0.965 0 O-C-N 123.605 0.566 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.875 0 CA-C-O 116.033 -1.937 . . . . 0.0 105.997 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 50.6 t80 61.78 -71.78 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 120.091 1.314 . . . . 0.0 107.615 -153.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.3 t -62.62 107.45 0.95 Allowed 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 164.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 32.9 t-20 -96.15 129.22 43.51 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 103.415 -2.809 . . . . 0.0 103.415 145.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.0 tp -51.68 -39.46 58.29 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 118.535 0.607 . . . . 0.0 110.305 177.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -61.25 -38.54 87.04 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-O 118.584 -0.722 . . . . 0.0 112.143 176.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 58.5 ttp -63.94 -49.96 70.56 Favored 'General case' 0 CA--C 1.528 0.101 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.1 t -52.95 -54.75 30.38 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-O 121.289 0.566 . . . . 0.0 110.07 179.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -61.84 -35.9 79.63 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-O 118.554 -0.736 . . . . 0.0 112.519 -179.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.6 tt -63.82 -43.84 95.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 119.605 1.093 . . . . 0.0 109.535 176.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.3 t -64.37 -48.76 74.26 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 -178.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.8 m -63.42 -42.52 98.71 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 -177.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -39.1 68.02 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 124.253 1.021 . . . . 0.0 108.644 176.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.4 m -68.93 -25.12 64.42 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.637 -0.665 . . . . 0.0 112.66 177.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.7 mt -89.02 -0.02 57.07 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.682 0.793 . . . . 0.0 111.743 168.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.84 35.06 65.78 Favored Glycine 0 CA--C 1.525 0.682 0 O-C-N 121.24 -0.912 . . . . 0.0 112.646 -177.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 35.3 mt -129.1 172.82 11.03 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 126.496 1.918 . . . . 0.0 109.72 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.0 tp -116.44 110.93 19.29 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 126.574 1.95 . . . . 0.0 109.228 -171.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -74.48 132.06 13.98 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 114.336 0.494 . . . . 0.0 114.336 -169.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? -124.38 108.99 12.76 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 126.448 1.899 . . . . 0.0 107.429 171.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.5 t -76.01 112.5 12.5 Favored 'General case' 0 C--N 1.332 -0.152 0 O-C-N 122.038 -0.414 . . . . 0.0 111.242 -178.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.2 mm -88.46 65.92 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 C-N-CA 125.565 1.546 . . . . 0.0 107.676 177.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.62 -88.12 0.17 Allowed Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 125.829 1.68 . . . . 0.0 110.791 175.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.29 -42.98 34.82 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 106.352 -1.722 . . . . 0.0 106.352 178.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -102.38 162.93 12.53 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.507 1.123 . . . . 0.0 108.799 -159.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.2 t -112.02 122.36 47.56 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 175.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -104.58 169.84 8.23 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 106.19 -1.781 . . . . 0.0 106.19 167.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 90.2 m -149.11 85.18 1.46 Allowed 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.867 1.667 . . . . 0.0 110.167 -167.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.2 m -76.43 148.61 6.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 O-C-N 120.876 -1.14 . . . . 0.0 110.601 -178.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -92.04 61.88 4.11 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -61.57 -28.72 69.54 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 119.378 -0.344 . . . . 0.0 110.773 -175.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 0.967 0 O-C-N 123.612 0.57 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 116.506 -1.711 . . . . 0.0 106.655 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 54.92 47.76 21.5 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 119.294 0.952 . . . . 0.0 111.099 171.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.3 t -66.52 117.03 8.14 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.278 -0.419 . . . . 0.0 109.901 -179.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -99.3 104.08 15.96 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 169.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 49.5 tp -39.54 -46.26 1.71 Allowed 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 125.691 1.596 . . . . 0.0 113.453 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.72 -52.5 59.91 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.492 0.717 . . . . 0.0 111.815 178.161 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -63.31 -47.36 82.58 Favored 'General case' 0 N--CA 1.457 -0.079 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 178.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 34.8 t -49.78 -56.51 10.05 Favored 'General case' 0 C--O 1.224 -0.287 0 O-C-N 123.856 0.722 . . . . 0.0 109.713 -178.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -57.01 -45.09 83.31 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 124.346 1.059 . . . . 0.0 112.468 -179.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.3 tt -60.65 -44.75 96.04 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.582 0.706 . . . . 0.0 109.972 179.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.7 m -64.52 -45.6 86.5 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 97.7 m -63.15 -41.41 99.26 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 -176.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.18 -36.62 82.46 Favored 'General case' 0 C--O 1.228 -0.064 0 N-CA-C 106.938 -1.504 . . . . 0.0 106.938 -178.071 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.2 m -70.59 -14.87 62.66 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 177.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.6 mt -98.07 5.13 49.01 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.444 0.698 . . . . 0.0 110.644 168.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.05 21.01 79.28 Favored Glycine 0 CA--C 1.526 0.78 0 O-C-N 120.782 -1.199 . . . . 0.0 112.168 -177.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.1 mt -112.33 -177.7 3.23 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.122 1.769 . . . . 0.0 108.365 177.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -140.95 105.78 4.94 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -163.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.17 134.6 25.15 Favored Glycine 0 CA--C 1.528 0.844 0 C-N-CA 121.335 -0.46 . . . . 0.0 113.866 -166.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 11.9 mptt -117.21 165.63 13.2 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 127.374 2.27 . . . . 0.0 105.587 161.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 50.8 t -150.37 104.94 3.28 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.244 -0.91 . . . . 0.0 110.515 -169.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.4 mt -87.08 161.36 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 N-CA-C 105.449 -2.056 . . . . 0.0 105.449 162.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -45.32 -49.94 10.3 Favored Glycine 0 CA--C 1.527 0.785 0 CA-C-O 122.236 0.909 . . . . 0.0 114.119 -170.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.05 -33.33 22.5 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 124.182 0.993 . . . . 0.0 109.587 -177.204 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 37.3 mttp -119.3 116.21 25.76 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 125.033 1.333 . . . . 0.0 111.258 -157.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 20.3 t -66.51 127.03 30.76 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 155.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -105.54 169.09 8.67 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 105.379 -2.082 . . . . 0.0 105.379 165.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 87.9 m -148.7 84.09 1.47 Allowed 'General case' 0 C--O 1.233 0.212 0 C-N-CA 124.904 1.282 . . . . 0.0 109.335 -177.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -71.41 146.78 11.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 O-C-N 121.175 -0.953 . . . . 0.0 108.905 -177.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? -84.71 71.35 10.83 Favored 'General case' 0 N--CA 1.441 -0.876 0 O-C-N 120.854 -1.154 . . . . 0.0 112.606 -160.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 46.9 t-80 -152.1 47.07 0.77 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.584 0.754 . . . . 0.0 110.102 178.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 0.981 0 O-C-N 123.493 0.496 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.153 0 CA-C-O 116.37 -1.776 . . . . 0.0 106.247 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -68.61 85.77 0.3 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 120.687 1.585 . . . . 0.0 107.24 164.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 18.4 t -67.28 110.97 3.74 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 105.735 -1.95 . . . . 0.0 105.735 168.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 51.3 t-20 -74.51 85.5 2.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.739 0.304 . . . . 0.0 110.594 -166.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.5 tp -51.71 -38.27 54.46 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 124.466 1.106 . . . . 0.0 111.494 -178.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 40.8 mtp85 -58.24 -52.3 66.14 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 64.6 ttp -64.3 -49.7 70.76 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 -179.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.3 t -49.9 -52.77 30.45 Favored 'General case' 0 C--N 1.334 -0.067 0 C-N-CA 123.008 0.523 . . . . 0.0 110.261 -176.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -69.21 -15.52 63.4 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.8 tp -80.54 -52.47 7.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 119.817 1.19 . . . . 0.0 109.36 168.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.1 p -63.91 -41.45 97.67 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.604 -0.685 . . . . 0.0 109.432 -172.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 83.5 m -64.07 -40.23 95.81 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 176.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.7 ttm105 -65.28 -35.64 81.64 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -175.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.2 m -55.82 -33.05 64.09 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.536 0.607 . . . . 0.0 111.562 172.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 42.5 mt -90.69 6.76 42.69 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.795 0.838 . . . . 0.0 111.302 177.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.16 19.7 78.69 Favored Glycine 0 CA--C 1.526 0.754 0 O-C-N 121.32 -0.863 . . . . 0.0 113.299 -178.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 37.3 mt -111.75 170.1 8.37 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.743 1.217 . . . . 0.0 109.976 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -115.61 104.16 11.43 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 126.252 1.821 . . . . 0.0 107.89 -170.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.59 128.92 38.94 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-N 116.477 -0.329 . . . . 0.0 113.061 -173.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.2 mtpm? -121.11 116.44 24.99 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.549 -1.648 . . . . 0.0 106.549 166.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -94.44 100.67 12.63 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 117.896 0.316 . . . . 0.0 110.148 -169.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.2 mt -90.25 162.29 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -171.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -39.93 -49.59 3.41 Favored Glycine 0 CA--C 1.525 0.704 0 C-N-CA 125.162 1.363 . . . . 0.0 113.854 -171.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.21 -42.24 14.88 Favored 'General case' 0 N--CA 1.439 -1.003 0 C-N-CA 125.782 1.633 . . . . 0.0 107.518 -171.318 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -156.23 159.86 39.3 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.985 0.914 . . . . 0.0 111.531 -153.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.7 t -79.32 125.19 29.18 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.07 169.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -105.41 170.78 7.68 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 167.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.3 m -148.57 84.89 1.49 Allowed 'General case' 0 C--O 1.232 0.155 0 C-N-CA 125.115 1.366 . . . . 0.0 110.59 -167.398 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.4 m -76.08 144.72 11.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 O-C-N 120.945 -1.097 . . . . 0.0 111.281 -175.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt -89.21 69.66 8.26 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 173.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -50.65 -36.65 36.59 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.781 0.832 . . . . 0.0 112.475 -166.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 0.953 0 O-C-N 123.823 0.702 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.421 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -125.9 84.48 2.28 Favored 'General case' 0 N--CA 1.457 -0.083 0 C-N-CA 124.065 0.946 . . . . 0.0 108.57 -176.167 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 41.9 t -64.65 126.52 28.17 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 123.426 0.691 . . . . 0.0 112.377 -172.896 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 55.3 t-20 -74.34 83.12 1.91 Allowed 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 167.106 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 49.3 tp -51.51 -36.8 46.23 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.935 0.894 . . . . 0.0 111.034 178.604 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.74 -52.38 65.75 Favored 'General case' 0 N--CA 1.458 -0.073 0 CA-C-N 118.776 0.717 . . . . 0.0 110.222 179.36 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 15.5 tmm? -64.32 -46.16 84.72 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -178.405 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 11.4 t -49.79 -57.64 6.95 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 177.565 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -58.79 -40.99 85.64 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 118.522 -0.751 . . . . 0.0 112.078 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.9 tt -60.64 -43.66 97.31 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.605 1.093 . . . . 0.0 110.015 178.149 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.1 t -64.07 -46.48 84.15 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 -178.242 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.8 m -63.23 -45.86 89.66 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -176.755 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -38.97 67.51 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 125.339 1.456 . . . . 0.0 108.817 177.702 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.1 m -67.51 -19.02 65.26 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 178.951 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.8 mt -101.13 9.21 42.25 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.837 0.855 . . . . 0.0 111.039 169.538 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.28 23.11 77.59 Favored Glycine 0 CA--C 1.526 0.756 0 O-C-N 120.878 -1.139 . . . . 0.0 112.779 -179.476 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.7 mt -109.11 175.46 5.45 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 125.562 1.545 . . . . 0.0 108.868 178.302 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.7 tt -126.82 102.86 7.22 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.983 1.713 . . . . 0.0 107.057 -167.917 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.84 120.19 20.42 Favored Glycine 0 CA--C 1.529 0.951 0 O-C-N 122.104 -0.373 . . . . 0.0 112.499 -174.811 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.4 tptt -122.17 106.29 11.02 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 104.521 -2.4 . . . . 0.0 104.521 174.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 5.1 t -110.76 124.87 52.82 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.704 0.684 . . . . 0.0 111.534 -170.213 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 22.2 mt -91.34 162.67 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 105.874 -1.899 . . . . 0.0 105.874 168.162 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -5.8 -81.04 0.01 OUTLIER Glycine 0 CA--C 1.532 1.135 0 C-N-CA 127.209 2.337 . . . . 0.0 115.441 -175.043 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.54 -38.78 16.87 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 128.496 2.718 . . . . 0.0 113.919 167.153 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -85.38 100.53 11.9 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.879 1.271 . . . . 0.0 110.433 -156.941 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.4 t -66.64 119.05 11.09 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.048 0.939 . . . . 0.0 110.513 166.018 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.62 171.52 7.32 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 104.802 -2.296 . . . . 0.0 104.802 161.503 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 94.0 m -145.95 83.2 1.63 Allowed 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.234 -2.135 . . . . 0.0 105.234 -177.694 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.3 m -73.53 144.24 12.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 C-N-CA 119.33 -0.948 . . . . 0.0 108.949 -177.455 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.6 ttpp -95.94 123.45 39.54 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-O 118.202 -0.904 . . . . 0.0 111.568 -159.755 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -79.56 -122.13 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.707 0.685 . . . . 0.0 109.454 165.775 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 0.962 0 O-C-N 123.463 0.477 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.816 0 N-CA-C 104.604 -2.369 . . . . 0.0 104.604 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 27.7 t80 59.68 -80.17 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -148.698 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.3 t -63.5 128.11 34.35 Favored 'General case' 0 C--O 1.24 0.593 0 O-C-N 121.655 -0.653 . . . . 0.0 109.443 177.589 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -93.74 89.98 6.39 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.186 1.394 . . . . 0.0 108.227 -174.472 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 28.1 tp -53.61 -33.81 56.26 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.396 1.078 . . . . 0.0 111.817 179.434 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.73 -46.68 68.27 Favored 'General case' 0 N--CA 1.453 -0.277 0 O-C-N 121.393 -0.817 . . . . 0.0 110.27 -176.76 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 13.3 tmm? -69.1 -44.61 72.12 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 176.694 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 23.3 t -50.7 -55.43 16.59 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 123.889 0.876 . . . . 0.0 110.08 -177.839 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -55.51 -39.42 70.48 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 178.97 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 39.8 tp -67.06 -44.83 79.1 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.972 -0.455 . . . . 0.0 110.618 -179.575 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.1 t -63.65 -44.97 92.27 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 -179.206 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 88.6 m -62.82 -43.65 98.25 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 -177.47 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.8 tpt85 -57.99 -44.49 87.19 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 177.722 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -55.86 -44.51 78.12 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 118.01 0.368 . . . . 0.0 110.039 177.732 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.8 mt -74.95 -3.33 31.57 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.284 0.634 . . . . 0.0 111.6 178.563 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.11 40.19 43.1 Favored Glycine 0 C--N 1.333 0.415 0 CA-C-O 122.313 0.952 . . . . 0.0 110.775 179.292 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 16.8 mt -131.37 -174.26 3.35 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 127.987 2.515 . . . . 0.0 107.303 177.363 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 47.9 tp -145.82 117.18 7.95 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 125.945 1.698 . . . . 0.0 107.517 -168.103 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.68 162.97 49.47 Favored Glycine 0 CA--C 1.533 1.186 0 N-CA-C 115.535 0.974 . . . . 0.0 115.535 -161.829 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -145.04 166.64 24.76 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 127.91 2.484 . . . . 0.0 106.902 157.802 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -121.54 120.35 34.6 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 121.465 -0.772 . . . . 0.0 109.524 177.681 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 56.7 mt -84.49 163.33 2.82 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 156.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -39.87 -59.01 2.14 Favored Glycine 0 CA--C 1.529 0.919 0 C-N-CA 124.468 1.033 . . . . 0.0 114.013 -171.556 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.83 -33.59 45.89 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.449 1.5 . . . . 0.0 108.596 -177.261 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.4 ttpm? -140.77 124.15 16.75 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.724 0.297 . . . . 0.0 111.011 -130.717 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.5 t -65.03 134.01 52.91 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.173 0.989 . . . . 0.0 110.5 173.248 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.3 tm-20 -106.31 166.5 10.48 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 105.544 -2.021 . . . . 0.0 105.544 164.314 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 84.2 m -149.74 84.97 1.41 Allowed 'General case' 0 C--O 1.235 0.315 0 C-N-CA 125.474 1.51 . . . . 0.0 110.598 -178.691 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.0 m -71.13 157.46 6.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 178.541 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.76 -44.62 85.32 Favored 'General case' 0 N--CA 1.441 -0.884 0 O-C-N 120.592 -1.318 . . . . 0.0 109.837 174.53 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.409 ' H ' ' HN1' ' A' ' 32' ' ' NH2 . 12.0 t-80 -155.67 -22.81 0.11 Allowed 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 160.079 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . 0.409 ' HN1' ' H ' ' A' ' 31' ' ' HIS . . . . . . . . 0 C--N 1.361 1.078 0 CA-C-N 116.043 -0.526 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.552 0 CA-C-O 116.001 -1.952 . . . . 0.0 107.648 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -168.73 32.87 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.871 1.214 . . . . 0.0 112.048 176.528 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.1 t -68.83 115.46 8.18 Favored 'General case' 0 C--N 1.331 -0.199 0 O-C-N 120.956 -1.09 . . . . 0.0 110.063 177.311 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -74.12 95.74 2.61 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 174.851 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.8 tp -50.46 -36.71 34.72 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 124.659 1.184 . . . . 0.0 112.352 177.718 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.17 -48.85 69.38 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 121.209 -0.932 . . . . 0.0 109.238 -177.906 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 12.2 tmm? -55.11 -48.25 73.87 Favored 'General case' 0 C--N 1.335 -0.049 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 174.281 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.8 t -56.73 -58.34 8.5 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.271 0.557 . . . . 0.0 110.518 -175.793 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -49.77 -45.76 49.96 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 125.08 1.352 . . . . 0.0 110.822 175.728 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.4 tp -63.46 -42.4 98.62 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 121.627 -0.671 . . . . 0.0 110.989 -177.576 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -64.62 -51.99 59.79 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 178.43 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.8 m -64.13 -34.36 77.89 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 123.944 0.898 . . . . 0.0 110.147 -170.713 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -47.04 -37.96 10.2 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 123.592 0.757 . . . . 0.0 111.216 170.402 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.3 t -56.2 -34.6 66.42 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.671 0.669 . . . . 0.0 110.742 -176.467 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 68.7 mt -104.34 15.18 28.79 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.675 0.79 . . . . 0.0 110.647 177.58 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 59.77 19.98 51.16 Favored Glycine 0 CA--C 1.523 0.555 0 C-N-CA 124.135 0.874 . . . . 0.0 113.342 -177.757 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 45.9 mt -89.41 171.2 9.91 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 178.375 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -113.41 106.76 14.96 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 105.84 -1.911 . . . . 0.0 105.84 -169.61 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.15 108.53 2.21 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-O 119.399 -0.667 . . . . 0.0 111.755 -174.008 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.22 121.42 41.02 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 172.187 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.1 m -75.26 125.07 28.21 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 168.726 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.7 mt -82.44 160.75 3.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 104.333 -2.469 . . . . 0.0 104.333 146.009 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.49 -46.86 45.52 Favored Glycine 0 CA--C 1.528 0.864 0 O-C-N 121.568 -0.708 . . . . 0.0 113.299 -161.909 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.56 -36.49 18.87 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.89 2.476 . . . . 0.0 111.369 178.812 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -135.21 138.3 43.48 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-O 121.549 0.69 . . . . 0.0 112.107 -153.744 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.8 t -68.7 129.64 40.52 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 118.495 -0.764 . . . . 0.0 111.108 171.642 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -115.95 173.63 6.46 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 105.636 -1.987 . . . . 0.0 105.636 156.073 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -137.0 84.98 2.1 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 125.769 1.628 . . . . 0.0 107.833 -171.327 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.0 m -68.82 151.01 10.44 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.493 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -178.832 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.5 tttp -87.43 84.1 7.22 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 121.37 -0.831 . . . . 0.0 110.628 -165.76 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 75.21 -65.62 0.33 Allowed 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.724 1.61 . . . . 0.0 109.675 170.483 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.102 0 O-C-N 124.431 1.082 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.941 0 CA-C-O 116.575 -1.679 . . . . 0.0 106.978 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -75.09 68.33 1.87 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 120.401 1.455 . . . . 0.0 109.135 174.598 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.0 t -79.61 73.49 6.3 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.572 0.701 . . . . 0.0 109.207 179.333 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 59.3 t-20 -74.51 85.68 2.05 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 121.837 -0.54 . . . . 0.0 110.392 -168.742 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 40.2 tp -53.64 -33.81 56.45 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.172 0.989 . . . . 0.0 111.921 -179.608 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.28 -57.77 8.46 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.425 -0.797 . . . . 0.0 110.554 178.693 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -61.88 -42.9 99.62 Favored 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 -178.337 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 38.8 t -48.63 -60.83 2.39 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.045 0.938 . . . . 0.0 108.854 178.832 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -60.72 -34.99 75.22 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -177.425 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.6 tt -63.52 -43.0 98.44 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.42 1.009 . . . . 0.0 110.677 175.237 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.5 t -64.37 -45.68 86.67 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.497 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 63.2 m -63.61 -41.51 98.29 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 -176.642 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.79 -50.18 69.12 Favored 'General case' 0 C--N 1.339 0.11 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 173.486 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.9 m -58.7 -33.35 70.08 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 179.354 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.8 mt -87.22 -4.56 59.1 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.315 0.646 . . . . 0.0 112.177 178.11 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.87 52.52 32.79 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 110.16 -1.176 . . . . 0.0 110.16 -176.921 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 28.2 mt -142.39 174.46 10.61 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 129.895 3.278 . . . . 0.0 107.82 177.552 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.5 tt -130.0 113.92 15.17 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 127.893 2.477 . . . . 0.0 106.715 -172.111 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -77.71 138.09 21.07 Favored Glycine 0 CA--C 1.53 0.984 0 N-CA-C 114.597 0.599 . . . . 0.0 114.597 -168.608 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -117.47 167.49 11.24 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 127.231 2.212 . . . . 0.0 107.868 167.765 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.2 t -112.58 130.8 55.9 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.656 0.782 . . . . 0.0 110.597 173.797 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.5 mt -111.13 163.62 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 C-N-CA 126.914 2.086 . . . . 0.0 106.996 168.111 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -27.07 -63.27 0.08 OUTLIER Glycine 0 CA--C 1.535 1.321 0 C-N-CA 126.228 1.871 . . . . 0.0 116.481 -175.513 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.19 -34.18 22.11 Favored 'General case' 0 N--CA 1.443 -0.776 0 O-C-N 121.063 -1.257 . . . . 0.0 109.345 -178.064 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -147.98 152.59 37.74 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.124 0.57 . . . . 0.0 112.512 -129.357 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.0 t -65.06 144.48 57.23 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.661 1.584 . . . . 0.0 111.504 173.009 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -114.93 168.71 9.66 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 157.048 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 98.6 m -147.01 84.35 1.59 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 126.081 1.752 . . . . 0.0 110.648 178.497 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -82.79 158.32 3.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 -174.718 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.1 tptt -61.97 -45.31 94.21 Favored 'General case' 0 N--CA 1.44 -0.935 0 O-C-N 120.815 -1.178 . . . . 0.0 109.876 165.065 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -137.04 -54.83 0.71 Allowed 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 177.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.36 1.056 0 CA-C-N 114.553 -1.203 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.85 0 N-CA-C 104.493 -2.41 . . . . 0.0 104.493 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -58.74 -55.14 38.9 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 150.449 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.1 t -64.01 127.99 33.85 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.236 -177.4 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -91.46 112.34 24.22 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 126.256 1.822 . . . . 0.0 108.277 176.029 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 30.6 tp -48.47 -44.73 35.95 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 123.166 0.586 . . . . 0.0 112.291 179.547 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -64.25 -37.34 87.14 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 120.139 -0.624 . . . . 0.0 111.033 -172.452 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.3 tmm? -60.86 -51.06 70.91 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 174.775 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.0 t -57.47 -56.93 15.53 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.88 -175.51 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -45.79 -50.62 13.83 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 126.031 1.732 . . . . 0.0 110.354 171.741 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 31.5 tp -62.49 -30.67 71.44 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 121.768 -0.583 . . . . 0.0 111.518 -177.289 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.3 t -71.73 -56.46 5.75 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 119.004 0.82 . . . . 0.0 109.053 172.014 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.2 m -63.81 -28.36 69.81 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.597 1.559 . . . . 0.0 110.639 -167.442 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.2 ttp85 -41.22 -46.02 3.03 Favored 'General case' 0 C--O 1.226 -0.136 0 C-N-CA 125.927 1.691 . . . . 0.0 110.422 168.333 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.6 m -55.18 -31.12 61.13 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.626 0.648 . . . . 0.0 112.286 -175.431 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.7 mt -106.53 9.48 31.52 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 123.711 0.804 . . . . 0.0 111.074 -178.059 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 56.6 54.57 35.3 Favored Glycine 0 C--N 1.339 0.74 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 -177.575 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 39.0 mt -127.15 140.55 52.18 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 125.393 1.477 . . . . 0.0 108.092 175.576 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.5 tp -72.11 121.42 19.22 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 125.843 1.657 . . . . 0.0 107.043 168.703 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.35 128.76 16.35 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 111.521 -0.631 . . . . 0.0 111.521 -178.645 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -107.91 94.6 5.16 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 126.904 2.082 . . . . 0.0 107.241 177.231 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.1 103.08 4.43 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 172.074 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 22.8 mt -82.74 161.15 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 N-CA-C 104.1 -2.556 . . . . 0.0 104.1 167.402 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -45.46 -47.75 11.88 Favored Glycine 0 CA--C 1.527 0.784 0 O-C-N 122.022 -0.424 . . . . 0.0 112.536 -166.878 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.438 ' OD2' ' NZ ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -81.94 -41.96 20.11 Favored 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 128.202 2.601 . . . . 0.0 109.227 -172.426 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.438 ' NZ ' ' OD2' ' A' ' 24' ' ' ASP . 5.1 ptpp? -155.87 161.39 40.6 Favored 'General case' 0 C--O 1.227 -0.118 0 CA-C-O 121.246 0.546 . . . . 0.0 112.314 -153.737 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.9 t -88.28 129.89 35.25 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.014 0.926 . . . . 0.0 110.744 179.078 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -117.26 172.43 7.31 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 168.032 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 82.3 m -147.8 100.84 3.26 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.401 1.08 . . . . 0.0 108.78 -169.895 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.8 m -97.22 154.24 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 O-C-N 121.012 -1.055 . . . . 0.0 109.133 176.515 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.5 ttmm -85.79 -43.29 13.45 Favored 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 121.673 -0.642 . . . . 0.0 109.901 170.648 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.453 ' CD2' ' HN2' ' A' ' 32' ' ' NH2 . 58.8 t60 50.48 -135.93 1.31 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.511 0.724 . . . . 0.0 109.559 -178.383 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' NH2 . . . . . 0.453 ' HN2' ' CD2' ' A' ' 31' ' ' HIS . . . . . . . . 0 C--N 1.357 0.903 0 O-C-N 123.59 0.556 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.966 0.412 . . . . 0.0 110.387 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.6 tp -53.93 -37.03 63.43 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.94 0.896 . . . . 0.0 112.103 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 72.6 ttt-85 -64.61 -48.84 73.42 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 119.62 1.1 . . . . 0.0 109.596 -178.093 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -61.95 -46.2 90.35 Favored 'General case' 0 N--CA 1.457 -0.117 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.4 t -56.42 -52.52 64.34 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 110.428 -0.212 . . . . 0.0 110.428 -178.481 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -51.49 -49.95 60.83 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 118.314 -0.851 . . . . 0.0 110.422 173.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.7 tp -58.28 -52.41 65.69 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 119.236 0.925 . . . . 0.0 110.909 -177.297 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.8 m -64.69 -42.84 95.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.535 0.683 . . . . 0.0 109.458 -172.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.5 m -64.29 -43.1 95.81 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 175.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -66.23 -32.01 73.18 Favored 'General case' 0 C--O 1.226 -0.146 0 N-CA-C 107.165 -1.421 . . . . 0.0 107.165 -170.842 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.0 m -56.37 -33.41 65.69 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.142 0.428 . . . . 0.0 111.162 173.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 40.3 mt -91.86 12.29 22.05 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.9 0.88 . . . . 0.0 110.764 174.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.39 -20.61 36.6 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 125.139 1.352 . . . . 0.0 112.533 -177.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.0 mt -83.47 178.01 8.2 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.389 -1.065 . . . . 0.0 110.294 -152.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 13.3 tp -109.24 94.83 5.25 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.983 2.513 . . . . 0.0 107.347 -177.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -64.51 130.5 37.44 Favored Glycine 0 CA--C 1.523 0.534 0 CA-C-O 119.431 -0.65 . . . . 0.0 111.794 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.91 138.68 42.64 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 168.595 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -111.81 108.02 17.28 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 119.263 -0.399 . . . . 0.0 110.588 -155.081 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.5 mt -86.17 161.63 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -172.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -40.07 -49.97 3.52 Favored Glycine 0 CA--C 1.525 0.682 0 C-N-CA 125.283 1.421 . . . . 0.0 113.908 -172.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.74 -46.21 14.57 Favored 'General case' 0 N--CA 1.44 -0.941 0 C-N-CA 126.137 1.775 . . . . 0.0 108.875 -176.068 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -156.68 159.73 38.67 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -156.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 18.0 t -71.59 141.51 50.03 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.92 0.888 . . . . 0.0 111.173 175.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -127.67 172.6 10.63 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 167.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.5 m -145.01 97.36 3.0 Favored 'General case' 0 C--N 1.334 -0.068 0 C-N-CA 126.443 1.897 . . . . 0.0 107.241 -167.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -74.94 164.62 3.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 169.129 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.2 tttt . . . . . 0 N--CA 1.436 -1.147 0 O-C-N 121.342 -0.849 . . . . 0.0 110.196 178.249 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.5 t30 . . . . . 0 N--CA 1.45 -0.463 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 45.7 tp -46.08 -47.25 17.2 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.567 1.147 . . . . 0.0 112.084 174.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.1 ttm180 -60.19 -46.78 88.55 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.771 0.319 . . . . 0.0 110.22 -169.296 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 16.8 tmm? -67.9 -45.73 73.61 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 123.288 0.635 . . . . 0.0 109.342 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.1 t -53.97 -42.69 69.24 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.658 0.742 . . . . 0.0 111.231 -175.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -51.1 -33.73 27.4 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.918 1.287 . . . . 0.0 112.636 173.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.57 -46.35 59.66 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 123.886 0.874 . . . . 0.0 109.295 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.2 m -64.56 -53.28 50.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -176.18 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 97.2 m -64.8 -28.4 69.54 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.9 1.28 . . . . 0.0 110.943 -174.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.1 ttm105 -59.03 -20.16 50.56 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 117.938 -1.03 . . . . 0.0 111.123 177.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.6 p -50.53 -47.88 57.36 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 120.112 1.324 . . . . 0.0 110.899 175.158 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 81.9 mt -100.03 22.34 11.42 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.58 0.752 . . . . 0.0 109.424 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.12 20.25 60.22 Favored Glycine 0 C--N 1.334 0.463 0 C-N-CA 123.873 0.749 . . . . 0.0 113.042 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 33.5 mt -84.72 145.46 27.92 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.6 tt -76.68 97.85 4.57 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 105.237 -2.135 . . . . 0.0 105.237 175.029 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.5 148.12 48.03 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.715 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.443 ' NZ ' ' OE2' ' A' ' 27' ' ' GLU . 14.8 tptp -165.38 94.39 0.62 Allowed 'General case' 0 N--CA 1.425 -1.696 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 -140.408 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.7 t -74.53 116.62 15.42 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.243 -1.536 . . . . 0.0 110.973 -176.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 11.6 mm -84.68 161.24 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 162.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -25.31 -69.27 0.04 OUTLIER Glycine 0 CA--C 1.529 0.91 0 C-N-CA 125.886 1.708 . . . . 0.0 114.291 -169.34 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.73 -44.0 12.9 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 127.995 2.518 . . . . 0.0 108.928 179.354 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.1 mttm -108.78 129.38 55.38 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.006 0.522 . . . . 0.0 109.64 -151.144 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.3 t -65.04 118.91 9.83 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 164.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.443 ' OE2' ' NZ ' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -120.74 172.2 8.05 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 179.445 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 24.6 m -146.38 114.28 6.51 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 -165.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.5 m -103.03 145.46 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 171.478 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.7 tttm . . . . . 0 N--CA 1.437 -1.111 0 O-C-N 121.134 -0.979 . . . . 0.0 109.722 -178.448 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 64.3 t-20 . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 121.119 0.485 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.5 tp -49.63 -38.36 31.73 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.895 1.278 . . . . 0.0 112.148 176.03 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -64.54 -49.8 69.84 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.388 -0.82 . . . . 0.0 109.91 -177.068 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -65.42 -46.29 80.56 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.4 t -46.53 -50.81 16.64 Favored 'General case' 0 C--O 1.226 -0.139 0 C-N-CA 123.53 0.732 . . . . 0.0 109.846 178.595 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -58.27 -37.08 74.27 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 123.773 0.829 . . . . 0.0 112.94 177.41 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.8 tp -66.39 -45.73 79.02 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 119.799 1.181 . . . . 0.0 110.708 176.427 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.43 -45.49 87.3 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.3 m -63.45 -42.06 98.65 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.29 -31.91 70.7 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.5 m -71.52 -18.77 62.25 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 121.111 -0.993 . . . . 0.0 113.298 176.617 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 46.0 mt -93.85 6.21 49.14 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.892 0.877 . . . . 0.0 110.686 165.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.15 9.08 87.23 Favored Glycine 0 CA--C 1.527 0.822 0 O-C-N 120.743 -1.223 . . . . 0.0 113.126 -177.02 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 33.7 mt -105.15 148.92 26.36 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.267 1.427 . . . . 0.0 111.431 -171.348 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -79.6 124.09 28.21 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 127.145 2.178 . . . . 0.0 107.264 171.121 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -87.94 131.07 10.42 Favored Glycine 0 CA--C 1.525 0.711 0 CA-C-N 118.052 0.387 . . . . 0.0 112.945 -177.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -113.43 166.03 11.89 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 128.147 2.579 . . . . 0.0 109.09 175.042 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 33.4 t -119.4 130.18 55.18 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 169.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 4.5 mt -105.18 161.61 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 N-CA-C 105.804 -1.924 . . . . 0.0 105.804 161.37 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -46.33 -43.53 14.41 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 123.754 0.692 . . . . 0.0 113.531 -173.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -75.05 -47.0 31.12 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 126.383 1.873 . . . . 0.0 108.873 -175.17 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -156.51 164.01 38.72 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -153.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 14.7 t -64.73 138.0 58.13 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.617 1.167 . . . . 0.0 109.406 164.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.16 170.1 8.53 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 164.816 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 77.2 m -145.5 124.77 12.97 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 178.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.3 m -128.73 150.11 34.09 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.566 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 172.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.436 -1.142 0 O-C-N 120.732 -1.23 . . . . 0.0 111.598 -168.373 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.3 t30 . . . . . 0 N--CA 1.455 -0.182 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.6 tp -59.2 -35.33 73.41 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.82 0.848 . . . . 0.0 112.204 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -56.08 24.08 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 121.15 -0.969 . . . . 0.0 110.551 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 15.6 tmm? -54.58 -45.7 73.6 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 177.462 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.8 t -57.65 -57.52 12.38 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.85 -174.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -58.9 -40.06 83.33 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 122.09 -0.381 . . . . 0.0 110.737 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -57.13 -40.13 76.54 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 121.626 -0.671 . . . . 0.0 110.972 176.055 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.4 t -68.15 -51.67 43.36 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 176.233 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.6 m -64.15 -29.4 70.52 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.485 1.114 . . . . 0.0 110.82 -171.216 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.16 -46.37 12.01 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.512 1.125 . . . . 0.0 109.505 169.288 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -56.91 -28.29 61.78 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.105 0.411 . . . . 0.0 112.102 -175.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 mt -105.33 5.86 32.24 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 124.088 0.955 . . . . 0.0 111.15 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 56.2 52.59 48.54 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 -176.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 38.3 mt -126.75 142.27 51.59 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 125.415 1.486 . . . . 0.0 108.056 175.002 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.0 tt -76.39 109.64 10.26 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 105.704 -1.961 . . . . 0.0 105.704 170.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.27 134.07 28.75 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 177.076 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.47 165.39 21.71 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 167.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.7 t -132.07 102.98 6.03 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 122.075 -0.391 . . . . 0.0 110.013 -157.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.6 mt -82.99 161.31 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 N-CA-C 104.657 -2.349 . . . . 0.0 104.657 175.166 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -40.31 -55.6 3.01 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 123.966 0.793 . . . . 0.0 112.577 -166.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.03 -44.51 15.13 Favored 'General case' 0 N--CA 1.439 -0.988 0 C-N-CA 128.411 2.684 . . . . 0.0 107.697 -176.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -122.79 127.96 49.8 Favored 'General case' 0 C--N 1.334 -0.08 0 C-N-CA 124.037 0.935 . . . . 0.0 110.181 -145.003 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.6 t -64.62 140.89 58.91 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 161.068 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -140.29 172.09 13.23 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 106.857 -1.535 . . . . 0.0 106.857 167.679 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 65.7 m -145.83 108.69 4.54 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 -162.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.2 m -110.16 146.67 15.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 123.706 0.802 . . . . 0.0 109.727 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.6 tttp . . . . . 0 N--CA 1.445 -0.717 0 O-C-N 120.955 -1.091 . . . . 0.0 109.667 176.462 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.5 t30 . . . . . 0 N--CA 1.457 -0.096 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 38.4 tp -58.31 -38.48 77.18 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.414 0.686 . . . . 0.0 111.9 -178.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -51.33 69.52 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.555 0.616 . . . . 0.0 110.008 -178.391 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.0 -49.76 75.74 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.182 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.4 t -50.75 -52.71 37.94 Favored 'General case' 0 N--CA 1.46 0.055 0 CA-C-O 121.791 0.805 . . . . 0.0 110.337 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -60.19 -39.3 86.04 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 123.176 0.59 . . . . 0.0 111.284 177.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 40.5 tp -60.32 -43.24 96.54 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.676 -0.64 . . . . 0.0 111.204 176.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.78 -44.74 84.88 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.26 -0.9 . . . . 0.0 109.779 175.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -64.07 -36.04 82.7 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.538 0.335 . . . . 0.0 110.316 -173.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.4 ttt85 -45.13 -37.07 4.07 Favored 'General case' 0 C--N 1.341 0.211 0 C-N-CA 124.237 1.015 . . . . 0.0 111.163 170.21 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.3 t -55.81 -33.07 64.11 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.699 0.681 . . . . 0.0 111.027 -175.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.0 mt -107.64 15.38 24.75 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.778 0.831 . . . . 0.0 110.615 178.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.26 24.97 66.03 Favored Glycine 0 CA--C 1.524 0.624 0 O-C-N 121.387 -0.821 . . . . 0.0 113.152 -178.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 57.6 mt -98.81 162.37 13.14 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 123.78 0.832 . . . . 0.0 109.505 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 tt -105.51 104.43 14.16 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.99 1.716 . . . . 0.0 107.687 -174.033 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.96 123.79 31.02 Favored Glycine 0 CA--C 1.524 0.641 0 CA-C-O 119.306 -0.719 . . . . 0.0 112.148 -178.668 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.458 ' NZ ' ' OE1' ' A' ' 27' ' ' GLU . 2.2 pptp? -135.77 130.82 34.66 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 170.302 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 21.6 t -102.48 119.91 39.63 Favored 'General case' 0 N--CA 1.461 0.079 0 N-CA-C 112.486 0.551 . . . . 0.0 112.486 -166.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 13.5 mt -84.11 66.99 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 C-N-CA 125.591 1.556 . . . . 0.0 106.838 176.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.14 -84.1 0.51 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 125.524 1.535 . . . . 0.0 110.339 174.565 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.06 -45.44 18.31 Favored 'General case' 0 N--CA 1.44 -0.938 0 C-N-CA 125.61 1.564 . . . . 0.0 107.186 175.567 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.4 mttp -95.23 115.88 28.01 Favored 'General case' 0 C--O 1.227 -0.094 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 -155.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 20.1 t -64.53 119.05 9.72 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 165.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.458 ' OE1' ' NZ ' ' A' ' 20' ' ' LYS . 1.3 tm-20 -109.18 173.8 6.16 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 165.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 99.0 m -145.75 83.37 1.65 Allowed 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.616 1.567 . . . . 0.0 107.524 -167.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.4 m -76.46 144.25 12.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 C-N-CA 119.489 -0.884 . . . . 0.0 109.058 -173.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp . . . . . 0 N--CA 1.429 -1.489 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 175.15 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 . . . . . 0 C--O 1.23 0.049 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 35.7 tp -50.04 -35.77 26.27 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.77 1.228 . . . . 0.0 112.112 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.7 mmm-85 -67.45 -46.1 74.05 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.253 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -62.91 -46.61 87.02 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.151 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 35.9 t -47.84 -52.66 18.21 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.714 0.769 . . . . 0.0 109.783 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -61.04 -32.8 72.41 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 123.65 0.78 . . . . 0.0 112.242 177.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 37.2 tp -66.4 -44.06 84.09 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.805 1.184 . . . . 0.0 111.126 175.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.31 -43.29 95.17 Favored 'General case' 0 C--N 1.332 -0.189 0 O-C-N 120.997 -1.064 . . . . 0.0 108.875 176.831 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 65.2 m -64.38 -40.63 96.21 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.952 -0.547 . . . . 0.0 109.576 -177.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.6 ttt85 -47.56 -49.49 26.37 Favored 'General case' 0 C--N 1.343 0.29 0 CA-C-N 119.261 0.937 . . . . 0.0 109.961 168.766 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.9 m -59.77 -31.25 69.5 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.837 -0.125 . . . . 0.0 110.917 -175.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 53.6 mt -89.61 -1.88 58.15 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.697 0.799 . . . . 0.0 112.304 175.155 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.13 28.89 70.98 Favored Glycine 0 CA--C 1.526 0.765 0 O-C-N 120.657 -1.277 . . . . 0.0 112.511 -177.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 52.2 mt -117.64 177.43 4.76 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 126.797 2.039 . . . . 0.0 108.474 -179.138 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -122.02 111.43 17.03 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 126.961 2.105 . . . . 0.0 107.445 -171.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -73.28 119.65 6.77 Favored Glycine 0 CA--C 1.523 0.534 0 CA-C-O 119.321 -0.711 . . . . 0.0 111.589 -174.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -137.19 149.39 47.2 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 170.603 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -123.88 121.02 34.26 Favored 'General case' 0 N--CA 1.462 0.126 0 O-C-N 121.327 -0.858 . . . . 0.0 112.978 -159.177 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.1 mm -84.5 67.03 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 175.001 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.08 -88.06 0.19 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 126.539 2.019 . . . . 0.0 110.674 173.468 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.56 -29.83 56.81 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.7 mttp -108.7 108.05 18.74 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.238 1.015 . . . . 0.0 109.789 -159.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.3 t -64.09 131.59 47.99 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 165.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -132.54 172.97 11.82 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 106.033 -1.839 . . . . 0.0 106.033 166.175 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 79.6 m -131.42 88.38 2.58 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 126.789 2.036 . . . . 0.0 106.157 -170.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.5 m -71.54 164.82 3.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 173.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.4 tptp . . . . . 0 N--CA 1.433 -1.322 0 O-C-N 120.778 -1.201 . . . . 0.0 110.476 179.688 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 . . . . . 0 N--CA 1.454 -0.258 0 N-CA-C 108.512 -0.922 . . . . 0.0 108.512 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 44.1 tp -34.96 -53.42 0.57 Allowed 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 125.235 1.414 . . . . 0.0 114.672 -171.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 -45.99 -47.42 16.72 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-N 118.358 0.526 . . . . 0.0 111.813 -176.399 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 49.8 ttm -63.75 -53.41 51.47 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 -176.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.8 t -49.83 -54.69 17.77 Favored 'General case' 0 C--O 1.231 0.087 0 CA-C-O 121.593 0.711 . . . . 0.0 110.705 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -49.48 -51.54 35.39 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 125.401 1.481 . . . . 0.0 110.324 176.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 47.2 tp -61.5 -47.78 84.05 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.092 0.557 . . . . 0.0 111.051 -177.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 p -64.52 -47.53 78.49 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -175.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.418 ' SG ' ' HA2' ' A' ' 19' ' ' GLY . 72.1 m -64.41 -39.84 94.62 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -178.106 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.48 -38.76 75.06 Favored 'General case' 0 C--O 1.228 -0.074 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 m -63.61 -28.51 69.97 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.063 -0.398 . . . . 0.0 111.591 178.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 43.0 mt -88.24 3.52 49.16 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.889 0.876 . . . . 0.0 111.302 171.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 69.92 29.59 70.76 Favored Glycine 0 C--N 1.336 0.533 0 O-C-N 120.988 -1.07 . . . . 0.0 112.227 -177.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 70.6 mt -118.37 152.69 35.35 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 125.917 1.687 . . . . 0.0 109.064 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.0 tp -85.93 96.73 9.9 Favored 'General case' 0 N--CA 1.442 -0.835 0 C-N-CA 127.067 2.147 . . . . 0.0 106.86 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.418 ' HA2' ' SG ' ' A' ' 12' ' ' CYS . . . -65.91 114.4 6.56 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.483 -0.865 . . . . 0.0 111.264 -178.073 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.64 112.77 25.28 Favored 'General case' 0 N--CA 1.438 -1.072 0 N-CA-C 104.881 -2.266 . . . . 0.0 104.881 173.782 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.6 t -77.15 113.15 14.58 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 124.378 1.071 . . . . 0.0 109.29 177.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 30.1 mm -84.49 159.79 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 160.074 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -49.18 -48.2 32.73 Favored Glycine 0 C--O 1.224 -0.488 0 CA-C-O 121.982 0.768 . . . . 0.0 112.96 -159.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.2 -36.42 18.0 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 130.225 3.41 . . . . 0.0 115.964 177.694 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.0 tptt -133.93 129.5 36.4 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 -161.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.3 t -68.48 126.64 30.29 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 118.171 -0.919 . . . . 0.0 109.767 170.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -108.94 172.12 7.03 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 105.679 -1.971 . . . . 0.0 105.679 163.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.0 m -145.04 84.67 1.72 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 -168.212 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -70.07 172.1 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.2 mttt . . . . . 0 N--CA 1.43 -1.428 0 O-C-N 120.308 -1.495 . . . . 0.0 111.557 -172.747 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.5 t30 . . . . . 0 N--CA 1.456 -0.161 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 45.0 tp -51.07 -43.84 61.07 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 123.829 0.852 . . . . 0.0 112.16 177.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 63.8 ttp85 -62.83 -42.86 99.9 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.95 0.796 . . . . 0.0 110.717 -172.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 13.5 tmm? -61.7 -49.6 75.82 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 174.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.3 t -55.0 -52.02 64.42 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.911 -175.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -50.61 -55.06 18.04 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.06 1.344 . . . . 0.0 110.772 172.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 tp -56.72 -38.35 72.22 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.2 m -71.55 -53.4 13.92 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.11 0.481 . . . . 0.0 109.738 -178.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.3 m -64.35 -27.58 69.11 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 124.413 1.085 . . . . 0.0 110.663 -174.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 44.9 ttt180 -52.75 -25.47 11.28 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.217 -0.896 . . . . 0.0 111.273 173.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.6 p -50.38 -43.16 54.32 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 120.221 1.373 . . . . 0.0 111.29 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.7 mt -102.87 18.79 20.68 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.107 0.963 . . . . 0.0 110.132 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.21 31.25 72.79 Favored Glycine 0 CA--C 1.522 0.503 0 O-C-N 121.632 -0.668 . . . . 0.0 112.866 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 65.7 mt -98.43 139.16 34.59 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.784 0.833 . . . . 0.0 108.823 178.05 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 39.2 tp -63.59 108.31 1.36 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 165.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.22 129.09 22.96 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 108.925 -1.67 . . . . 0.0 108.925 167.241 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.57 153.54 48.69 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 174.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.2 t -128.96 100.83 5.81 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -146.098 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.7 mt -83.72 161.02 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 N-CA-C 105.383 -2.08 . . . . 0.0 105.383 173.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -40.87 -55.31 3.39 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 124.289 0.947 . . . . 0.0 112.854 -163.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.83 -43.91 12.9 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 127.234 2.214 . . . . 0.0 109.63 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -115.31 125.97 53.9 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.182 0.593 . . . . 0.0 109.791 -151.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.1 t -73.12 129.31 37.78 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 163.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -118.94 172.5 7.5 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 171.363 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.0 m -143.54 126.14 15.94 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 106.332 -1.729 . . . . 0.0 106.332 -173.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.4 m -135.53 152.99 32.44 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-N 118.423 0.556 . . . . 0.0 109.514 175.517 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 38.2 tttm . . . . . 0 N--CA 1.436 -1.157 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 174.665 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.8 t30 . . . . . 0 CA--C 1.53 0.196 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 48.9 tp -48.6 -42.45 34.0 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.535 1.134 . . . . 0.0 113.342 178.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.18 -54.11 48.43 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 118.81 0.732 . . . . 0.0 109.848 -178.279 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -60.47 -44.53 95.79 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.5 t -51.38 -57.55 8.65 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.543 0.687 . . . . 0.0 109.866 177.182 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -61.66 -34.82 76.4 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-O 117.984 -1.008 . . . . 0.0 111.458 -178.672 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 44.1 tp -63.0 -45.14 93.83 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.89 1.223 . . . . 0.0 110.637 175.534 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.0 m -64.89 -47.35 78.13 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.8 m -64.03 -43.82 94.41 Favored 'General case' 0 CA--C 1.535 0.365 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 -178.539 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -44.91 -53.61 7.41 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 125.688 1.595 . . . . 0.0 109.538 168.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 12.8 m -54.98 -44.21 74.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 118.235 0.47 . . . . 0.0 111.111 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.4 mt -75.28 -7.41 53.85 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.399 0.68 . . . . 0.0 112.454 177.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.97 43.84 25.81 Favored Glycine 0 C--N 1.334 0.457 0 CA-C-O 122.174 0.874 . . . . 0.0 111.298 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 54.1 mt -136.55 157.39 46.88 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 126.418 1.887 . . . . 0.0 108.403 -177.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.1 tp -90.78 108.01 19.56 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.67 1.988 . . . . 0.0 107.224 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.33 136.05 27.96 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.657 -0.782 . . . . 0.0 111.716 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 pptp? -134.57 153.47 51.94 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 166.053 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.6 t -134.08 96.87 3.72 Favored 'General case' 0 CA--C 1.518 -0.271 0 O-C-N 121.972 -0.455 . . . . 0.0 111.297 -154.112 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 6.2 mt -86.56 65.46 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 -177.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.72 -73.33 0.25 Allowed Glycine 0 CA--C 1.528 0.877 0 C-N-CA 124.374 0.988 . . . . 0.0 112.633 172.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.89 -49.96 7.47 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 126.217 1.807 . . . . 0.0 110.808 165.451 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -88.88 99.55 12.48 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -160.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 33.8 t -63.48 132.03 50.05 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 106.949 -1.501 . . . . 0.0 106.949 161.164 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -128.39 171.73 11.77 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 104.646 -2.353 . . . . 0.0 104.646 174.168 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -146.3 86.44 1.69 Allowed 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 -169.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -71.94 163.62 3.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 178.201 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.0 ttmm . . . . . 0 N--CA 1.437 -1.122 0 O-C-N 121.476 -0.765 . . . . 0.0 111.318 174.59 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 41.7 t30 . . . . . 0 CA--C 1.527 0.08 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.1 tp -35.99 -48.2 0.57 Allowed 'General case' 0 C--O 1.224 -0.275 0 C-N-CA 125.782 1.633 . . . . 0.0 113.768 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 70.4 mtm180 -55.34 -48.68 73.83 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 122.163 -0.336 . . . . 0.0 111.045 -176.142 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -65.41 -50.19 66.41 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 45.7 t -47.27 -52.67 15.47 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 121.646 0.736 . . . . 0.0 110.464 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -51.82 -47.09 64.49 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 124.121 0.968 . . . . 0.0 111.609 177.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 37.1 tp -67.27 -48.6 67.22 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 122.611 0.364 . . . . 0.0 110.186 -176.483 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.7 m -64.16 -41.03 97.31 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -174.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.0 m -64.92 -46.57 81.09 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 176.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.3 ttp-105 -58.12 -34.45 70.24 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 121.933 -0.48 . . . . 0.0 109.91 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.9 m -57.49 -29.46 64.29 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.679 0.672 . . . . 0.0 111.546 177.398 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 57.7 mt -99.9 14.48 30.3 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.185 0.994 . . . . 0.0 110.825 176.068 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.04 7.99 68.13 Favored Glycine 0 CA--C 1.527 0.811 0 O-C-N 120.996 -1.065 . . . . 0.0 113.235 -178.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 32.1 mt -92.05 145.22 24.69 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 122.179 0.99 . . . . 0.0 109.798 -175.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.5 tp -76.41 107.6 8.79 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 125.37 1.468 . . . . 0.0 107.193 170.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -90.2 138.26 14.4 Favored Glycine 0 C--N 1.331 0.29 0 CA-C-O 118.902 -0.944 . . . . 0.0 111.838 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.94 159.38 38.04 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 173.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 95.9 m -83.44 126.59 32.92 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 121.199 -0.938 . . . . 0.0 110.921 -176.094 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 14.8 mm -85.03 162.01 3.0 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 152.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -39.24 -56.72 2.26 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 124.921 1.248 . . . . 0.0 113.738 -171.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.37 -43.07 15.08 Favored 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 124.79 1.236 . . . . 0.0 108.606 -179.112 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.6 mttm -118.5 151.67 37.41 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 123.106 0.562 . . . . 0.0 110.902 -151.084 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.9 t -66.54 131.24 45.59 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 154.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -104.18 167.35 9.81 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 105.534 -2.025 . . . . 0.0 105.534 164.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 66.7 m -141.12 114.18 8.54 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 103.696 -2.705 . . . . 0.0 103.696 168.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.0 m -108.67 152.23 10.71 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.681 0 N-CA-C 106.519 -1.659 . . . . 0.0 106.519 168.115 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.432 -1.375 0 O-C-N 120.959 -1.088 . . . . 0.0 110.305 -173.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 . . . . . 0 N--CA 1.452 -0.336 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 31.7 tp -58.95 -45.39 90.57 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.541 0.337 . . . . 0.0 111.39 -173.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -61.99 -42.71 99.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 -176.246 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -58.37 -52.24 66.42 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.068 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.9 t -53.32 -55.92 20.89 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.652 -176.591 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -55.81 -46.59 78.0 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.318 1.047 . . . . 0.0 111.767 177.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.0 tt -56.78 -42.07 78.78 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 121.754 -0.591 . . . . 0.0 110.4 178.304 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 m -66.8 -50.39 62.8 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.4 m -63.52 -33.41 75.53 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.914 1.285 . . . . 0.0 109.616 -173.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.46 -26.75 21.57 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.517 1.527 . . . . 0.0 110.502 177.324 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.0 m -53.63 -36.92 62.56 Favored 'General case' 0 C--O 1.225 -0.198 0 O-C-N 121.025 -1.047 . . . . 0.0 112.961 175.353 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 mt -111.99 22.61 14.67 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.125 0.57 . . . . 0.0 109.929 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 58.47 26.33 59.33 Favored Glycine 0 CA--C 1.526 0.773 0 CA-C-O 122.04 0.8 . . . . 0.0 113.084 -179.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.4 mt -92.95 156.65 16.78 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 122.064 0.935 . . . . 0.0 108.766 178.261 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 tt -98.7 95.89 7.55 Favored 'General case' 0 N--CA 1.441 -0.921 0 C-N-CA 129.346 3.058 . . . . 0.0 106.514 -170.282 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.42 131.19 29.53 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.522 -0.847 . . . . 0.0 111.909 -177.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.44 ' NZ ' ' OE1' ' A' ' 27' ' ' GLU . 13.0 pttp -135.51 134.95 40.03 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 159.49 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 57.2 m -74.93 114.64 13.63 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 174.344 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.4 mt -83.44 162.57 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 N-CA-C 105.26 -2.126 . . . . 0.0 105.26 166.136 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -34.85 -57.3 0.79 Allowed Glycine 0 CA--C 1.525 0.674 0 C-N-CA 125.27 1.414 . . . . 0.0 112.987 -166.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.46 -43.21 19.19 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 127.837 2.455 . . . . 0.0 109.82 -172.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.22 164.35 38.92 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -160.233 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.6 t -64.96 133.14 51.11 Favored 'General case' 0 C--N 1.333 -0.114 0 C-N-CA 124.008 0.923 . . . . 0.0 110.225 174.708 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.44 ' OE1' ' NZ ' ' A' ' 20' ' ' LYS . 5.1 tm-20 -118.38 170.94 8.5 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 106.472 -1.677 . . . . 0.0 106.472 161.852 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 94.9 m -146.12 82.81 1.61 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 -168.376 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -72.69 150.47 8.3 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 -176.441 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.6 ttpt . . . . . 0 N--CA 1.433 -1.292 0 C-N-CA 118.895 -1.122 . . . . 0.0 111.854 -164.464 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 64.9 t-20 . . . . . 0 N--CA 1.451 -0.395 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 32.7 tp -44.48 -45.19 9.05 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.485 1.114 . . . . 0.0 111.648 -179.739 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 69.2 ttp85 -56.79 -49.68 74.6 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 122.352 0.261 . . . . 0.0 111.338 -177.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -69.21 -49.31 57.6 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.628 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.7 t -46.23 -51.04 15.09 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 124.244 1.017 . . . . 0.0 110.595 -175.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -55.05 -45.02 75.22 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.77 -179.634 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 32.0 tp -70.11 -47.3 62.4 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.141 0.576 . . . . 0.0 109.79 -174.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 p -64.18 -45.82 86.71 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 -176.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.0 m -64.34 -40.31 95.63 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.2 ttp-105 -62.54 -41.75 99.08 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -178.219 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.5 m -57.32 -35.04 69.36 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.188 0.449 . . . . 0.0 111.422 175.343 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.6 mt -85.08 5.18 30.75 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.598 0.759 . . . . 0.0 111.669 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 61.54 47.17 92.17 Favored Glycine 0 C--N 1.334 0.461 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 23.5 mt -131.46 148.88 52.68 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 126.507 1.923 . . . . 0.0 108.582 175.38 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.8 tp -82.16 107.13 14.62 Favored 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 171.134 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.03 129.71 29.63 Favored Glycine 0 N--CA 1.451 -0.307 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 178.002 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.17 131.32 40.28 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 176.222 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 m -80.27 133.28 35.97 Favored 'General case' 0 CA--C 1.515 -0.373 0 O-C-N 121.084 -1.01 . . . . 0.0 109.734 177.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.9 mm -84.34 160.44 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.683 0 N-CA-C 104.324 -2.473 . . . . 0.0 104.324 149.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.21 -47.78 41.43 Favored Glycine 0 CA--C 1.528 0.862 0 O-C-N 121.449 -0.782 . . . . 0.0 112.355 -171.488 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.93 -44.65 47.44 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 127.034 2.134 . . . . 0.0 107.765 -172.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -155.01 152.99 30.31 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-O 121.529 0.68 . . . . 0.0 110.883 -151.002 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.9 t -70.93 140.78 51.07 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 124.348 1.059 . . . . 0.0 111.182 -178.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -128.23 171.97 11.47 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 106.53 -1.655 . . . . 0.0 106.53 163.327 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 86.4 m -146.08 102.38 3.62 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 -170.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.2 m -89.03 166.81 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 172.407 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm . . . . . 0 N--CA 1.44 -0.963 0 O-C-N 120.752 -1.218 . . . . 0.0 108.941 172.179 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 62.7 t-20 . . . . . 0 N--CA 1.463 0.203 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.9 tp -48.11 -43.77 31.25 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.702 0.801 . . . . 0.0 111.969 176.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -66.12 -45.78 79.88 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.859 -0.526 . . . . 0.0 110.297 -172.124 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -60.13 -49.16 78.74 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 175.446 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.1 t -51.0 -54.43 24.61 Favored 'General case' 0 CA--C 1.523 -0.077 0 CA-C-O 121.309 0.576 . . . . 0.0 110.787 -176.896 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -53.83 -47.29 71.08 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 124.45 1.1 . . . . 0.0 110.801 176.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 41.9 tp -60.74 -42.75 97.99 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 119.178 -0.439 . . . . 0.0 111.61 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.91 -51.0 52.87 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 119.1 0.864 . . . . 0.0 109.611 179.079 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.1 m -63.58 -31.8 73.08 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 124.101 0.96 . . . . 0.0 109.018 -171.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -49.25 -29.89 6.41 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.356 -0.831 . . . . 0.0 111.942 172.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 80.1 p -52.68 -40.71 63.16 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 120.175 1.352 . . . . 0.0 111.483 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.4 mt -104.5 21.35 16.9 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.826 0.85 . . . . 0.0 109.953 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.2 33.71 86.82 Favored Glycine 0 C--N 1.335 0.509 0 CA-C-O 122.209 0.894 . . . . 0.0 111.882 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.9 mt -102.39 132.34 48.46 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-O 121.866 0.841 . . . . 0.0 109.373 -178.72 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.3 tp -68.01 94.61 0.5 Allowed 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 125.668 1.587 . . . . 0.0 106.955 170.379 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.47 123.7 29.84 Favored Glycine 0 N--CA 1.448 -0.535 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 170.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.2 143.62 46.5 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 106.789 -1.56 . . . . 0.0 106.789 173.35 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 t -129.29 96.36 4.28 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 -145.119 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.4 mt -83.06 159.87 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 N-CA-C 104.109 -2.552 . . . . 0.0 104.109 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -46.31 -49.9 14.1 Favored Glycine 0 CA--C 1.53 0.972 0 CA-C-O 122.504 1.058 . . . . 0.0 113.45 -162.285 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.47 -24.24 24.19 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 130.814 3.646 . . . . 0.0 115.241 -177.115 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.5 mmtm -138.91 118.16 12.71 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.049 0.94 . . . . 0.0 112.402 -170.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.2 t -64.29 124.46 21.79 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 155.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -117.67 172.05 7.62 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 105.832 -1.914 . . . . 0.0 105.832 171.511 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.0 m -142.56 98.75 3.36 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.751 1.62 . . . . 0.0 107.655 -172.632 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -83.04 173.26 0.96 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 172.288 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.7 ttmp? . . . . . 0 N--CA 1.444 -0.762 0 O-C-N 119.975 -1.703 . . . . 0.0 109.913 170.783 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 63.8 t-20 . . . . . 0 N--CA 1.462 0.162 0 CA-C-O 122.112 0.958 . . . . 0.0 108.891 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 24.2 tp -56.44 -34.89 67.27 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.642 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.71 -48.79 79.14 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.875 0.761 . . . . 0.0 110.739 177.818 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -58.38 -49.28 77.82 Favored 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 109.047 -0.724 . . . . 0.0 109.047 177.207 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.6 t -51.52 -52.75 44.31 Favored 'General case' 0 C--O 1.227 -0.116 0 CA-C-O 121.022 0.439 . . . . 0.0 110.542 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -52.37 -48.46 65.58 Favored 'General case' 0 N--CA 1.444 -0.759 0 C-N-CA 123.129 0.572 . . . . 0.0 111.481 175.237 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.0 tp -63.1 -49.6 73.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.436 0.562 . . . . 0.0 111.197 -176.298 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.1 m -64.71 -42.37 95.31 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 121.376 -0.828 . . . . 0.0 109.695 -177.307 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 87.2 m -63.9 -42.85 97.34 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.3 ttt85 -54.86 -46.91 74.76 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.0 m -58.24 -35.18 71.32 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 117.949 0.34 . . . . 0.0 111.05 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.5 mt -84.92 1.73 45.98 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.543 0.737 . . . . 0.0 111.851 176.479 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.97 47.7 64.31 Favored Glycine 0 C--N 1.334 0.422 0 O-C-N 120.71 -1.244 . . . . 0.0 110.148 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.9 mt -136.49 177.69 7.65 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 128.13 2.572 . . . . 0.0 107.48 176.736 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -125.13 110.76 14.5 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 126.29 1.836 . . . . 0.0 106.914 -175.436 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -73.46 123.59 8.38 Favored Glycine 0 N--CA 1.449 -0.491 0 CA-C-O 119.451 -0.639 . . . . 0.0 112.445 -173.073 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.4 ' NZ ' ' OE1' ' A' ' 27' ' ' GLU . 1.9 pptp? -134.99 133.48 39.5 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 106.006 -1.85 . . . . 0.0 106.006 167.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 30.2 t -103.78 136.84 42.71 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -165.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 23.2 mt -97.85 163.33 2.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 125.68 1.592 . . . . 0.0 107.274 176.239 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -12.55 -70.55 0.01 OUTLIER Glycine 0 CA--C 1.532 1.141 0 C-N-CA 127.839 2.638 . . . . 0.0 116.352 -176.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.92 -47.9 9.22 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 126.639 1.976 . . . . 0.0 108.927 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -136.93 149.39 47.55 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.969 0.89 . . . . 0.0 113.159 -146.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.5 t -64.87 139.59 58.78 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.161 1.784 . . . . 0.0 111.307 -178.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.4 ' OE1' ' NZ ' ' A' ' 20' ' ' LYS . 4.0 tm-20 -122.95 172.76 8.25 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 105.241 -2.133 . . . . 0.0 105.241 160.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 94.4 m -145.87 83.69 1.65 Allowed 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 -164.713 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 31.4 m -72.28 157.17 6.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -177.593 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 43.9 tptt . . . . . 0 N--CA 1.437 -1.082 0 O-C-N 121.35 -0.844 . . . . 0.0 112.368 -167.86 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 . . . . . 0 N--CA 1.458 -0.049 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.8 tp -50.48 -37.05 36.59 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.965 0.906 . . . . 0.0 112.333 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.38 -52.08 44.31 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 121.358 -0.839 . . . . 0.0 110.506 -176.062 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -61.61 -42.98 99.64 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.2 t -50.76 -57.44 8.34 Favored 'General case' 0 CA--C 1.523 -0.083 0 CA-C-O 121.487 0.66 . . . . 0.0 109.226 177.044 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -60.99 -37.33 82.1 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 122.827 0.451 . . . . 0.0 111.93 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 31.2 tp -60.93 -43.03 99.19 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.095 0.861 . . . . 0.0 110.468 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.5 m -67.1 -44.78 79.09 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.8 m -63.77 -41.24 98.0 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -177.871 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.81 -30.93 4.4 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 125.315 1.446 . . . . 0.0 111.164 172.147 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.0 t -51.69 -44.3 63.07 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.696 1.135 . . . . 0.0 109.825 -177.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 57.5 mt -108.69 25.22 11.99 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.97 0.908 . . . . 0.0 110.266 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 61.01 27.16 66.7 Favored Glycine 0 CA--C 1.526 0.753 0 CA-C-O 121.858 0.699 . . . . 0.0 113.386 177.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.8 mt -91.64 172.24 8.63 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 123.897 0.879 . . . . 0.0 109.391 177.569 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.1 tt -126.2 97.64 5.16 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 127.292 2.237 . . . . 0.0 106.269 -161.122 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.32 125.06 11.56 Favored Glycine 0 CA--C 1.526 0.763 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.581 -168.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.5 mtpm? -124.73 120.0 30.53 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 126.134 1.774 . . . . 0.0 107.925 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.0 m -74.78 130.53 39.64 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.087 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 6.2 mt -111.73 66.42 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 125.391 1.476 . . . . 0.0 107.54 169.015 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.99 -88.8 0.48 Allowed Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 126.429 1.966 . . . . 0.0 110.319 173.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.74 -45.25 21.58 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 176.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.9 mttp -88.99 157.09 18.5 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.25 0.62 . . . . 0.0 109.714 -162.105 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.7 t -101.81 123.82 46.41 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 164.185 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -104.88 170.2 8.01 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 167.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 92.2 m -149.57 85.12 1.43 Allowed 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.943 1.697 . . . . 0.0 110.253 -169.245 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.6 m -76.23 166.09 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 O-C-N 120.69 -1.256 . . . . 0.0 110.294 177.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.4 mtmt . . . . . 0 N--CA 1.439 -0.979 0 O-C-N 121.145 -0.972 . . . . 0.0 111.797 -174.327 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 . . . . . 0 CA--C 1.529 0.15 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.2 tp -53.87 -37.4 63.67 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.676 0.79 . . . . 0.0 111.601 176.157 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.62 -49.19 78.73 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.722 0.692 . . . . 0.0 109.917 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -59.21 -52.35 66.08 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 178.11 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.7 t -51.95 -50.06 61.94 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 122.023 0.916 . . . . 0.0 110.852 -176.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -54.42 -46.87 73.28 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.395 176.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.92 -49.76 71.38 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.084 0.554 . . . . 0.0 111.493 -177.457 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.6 p -64.55 -42.27 95.79 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.44 -0.787 . . . . 0.0 109.222 -176.732 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.1 m -63.78 -42.97 97.65 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.01 -42.43 94.27 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 -178.07 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.9 m -55.88 -43.51 77.25 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 120.82 -1.175 . . . . 0.0 111.232 175.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.9 mt -72.91 -4.71 33.69 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 122.751 0.42 . . . . 0.0 111.648 175.395 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.02 14.84 82.21 Favored Glycine 0 CA--C 1.524 0.625 0 O-C-N 121.184 -0.947 . . . . 0.0 111.866 -178.512 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 24.0 mt -100.76 -179.73 4.16 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 125.884 1.674 . . . . 0.0 107.884 177.628 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -121.62 104.39 9.59 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 -171.007 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -77.15 130.77 10.65 Favored Glycine 0 C--N 1.332 0.351 0 CA-C-O 119.428 -0.651 . . . . 0.0 113.239 -170.38 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.88 130.76 27.8 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 106.474 -1.676 . . . . 0.0 106.474 168.228 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.6 t -99.71 124.96 45.47 Favored 'General case' 0 CA--C 1.518 -0.271 0 O-C-N 121.933 -0.479 . . . . 0.0 111.125 -174.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.6 mt -84.85 161.98 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 172.013 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -45.57 -36.23 6.03 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.444 1.021 . . . . 0.0 114.195 -177.024 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -57.83 3.67 Favored 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 127.933 2.493 . . . . 0.0 107.872 -179.363 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.65 155.9 30.85 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -152.74 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.5 t -66.59 133.03 49.47 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 124.15 0.98 . . . . 0.0 110.877 171.387 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.9 172.08 9.67 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 164.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 76.8 m -145.81 89.98 1.95 Allowed 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 126.507 1.923 . . . . 0.0 106.31 -167.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.6 m -70.19 146.81 11.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 174.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.9 ttpp . . . . . 0 N--CA 1.435 -1.215 0 O-C-N 121.37 -0.832 . . . . 0.0 111.137 -164.293 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.6 t30 . . . . . 0 CA--C 1.527 0.07 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 56.0 tp -39.51 -46.91 1.8 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.784 1.634 . . . . 0.0 113.291 174.311 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.8 ttt85 -64.02 -44.45 92.54 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 119.006 0.821 . . . . 0.0 109.797 -174.863 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -61.75 -48.25 81.52 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 174.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 54.1 t -53.16 -55.06 27.13 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.834 0.826 . . . . 0.0 109.582 -176.257 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.3 mm-40 -57.24 -46.15 83.27 Favored 'General case' 0 N--CA 1.44 -0.958 0 O-C-N 121.888 -0.508 . . . . 0.0 110.888 178.14 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 46.6 tp -62.74 -46.45 88.02 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.686 0.675 . . . . 0.0 111.482 -176.448 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.4 p -64.98 -45.13 86.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -178.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 88.4 m -62.95 -42.8 99.93 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -41.53 77.3 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 177.128 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.9 m -68.54 -27.21 65.89 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 177.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 69.1 mt -80.18 -3.85 50.66 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.545 0.612 . . . . 0.0 111.534 167.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 75.32 29.13 60.61 Favored Glycine 0 C--N 1.337 0.591 0 CA-C-N 119.299 0.954 . . . . 0.0 111.444 -177.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 30.8 mt -123.55 -176.44 3.45 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.847 2.059 . . . . 0.0 108.17 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.9 tp -135.45 113.95 11.65 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 126.193 1.797 . . . . 0.0 107.992 -166.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.14 144.76 45.22 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 121.441 -0.409 . . . . 0.0 112.997 -165.807 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -127.99 87.11 2.56 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 128.16 2.584 . . . . 0.0 105.375 171.099 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -78.28 98.11 5.8 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 123.602 0.761 . . . . 0.0 110.728 -176.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.4 mt -87.96 161.34 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 N-CA-C 106.703 -1.592 . . . . 0.0 106.703 164.561 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.36 -53.53 23.8 Favored Glycine 0 CA--C 1.523 0.544 0 O-C-N 121.989 -0.444 . . . . 0.0 113.293 -166.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.4 -26.13 26.61 Favored 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 124.859 1.263 . . . . 0.0 110.435 179.702 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -129.02 110.47 12.08 Favored 'General case' 0 C--O 1.226 -0.14 0 C-N-CA 123.368 0.667 . . . . 0.0 110.162 -156.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 31.6 t -76.42 117.67 18.32 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 164.307 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -103.49 170.95 7.64 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 171.273 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.8 m -148.48 84.67 1.49 Allowed 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.669 1.588 . . . . 0.0 109.165 -171.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.7 m -70.7 154.84 7.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 118.941 -1.104 . . . . 0.0 109.306 178.666 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt . . . . . 0 N--CA 1.436 -1.134 0 O-C-N 121.368 -0.832 . . . . 0.0 109.671 -178.609 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 32.9 t-20 . . . . . 0 N--CA 1.45 -0.466 0 N-CA-C 103.415 -2.809 . . . . 0.0 103.415 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.0 tp -51.68 -39.46 58.29 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 118.535 0.607 . . . . 0.0 110.305 177.046 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -61.25 -38.54 87.04 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-O 118.584 -0.722 . . . . 0.0 112.143 176.284 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 58.5 ttp -63.94 -49.96 70.56 Favored 'General case' 0 CA--C 1.528 0.101 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.1 t -52.95 -54.75 30.38 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-O 121.289 0.566 . . . . 0.0 110.07 179.026 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -61.84 -35.9 79.63 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-O 118.554 -0.736 . . . . 0.0 112.519 -179.537 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.6 tt -63.82 -43.84 95.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 119.605 1.093 . . . . 0.0 109.535 176.106 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.3 t -64.37 -48.76 74.26 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 -178.1 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.8 m -63.42 -42.52 98.71 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 -177.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -39.1 68.02 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 124.253 1.021 . . . . 0.0 108.644 176.784 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.4 m -68.93 -25.12 64.42 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.637 -0.665 . . . . 0.0 112.66 177.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.7 mt -89.02 -0.02 57.07 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.682 0.793 . . . . 0.0 111.743 168.682 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.84 35.06 65.78 Favored Glycine 0 CA--C 1.525 0.682 0 O-C-N 121.24 -0.912 . . . . 0.0 112.646 -177.364 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 35.3 mt -129.1 172.82 11.03 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 126.496 1.918 . . . . 0.0 109.72 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.0 tp -116.44 110.93 19.29 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 126.574 1.95 . . . . 0.0 109.228 -171.257 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -74.48 132.06 13.98 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 114.336 0.494 . . . . 0.0 114.336 -169.628 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? -124.38 108.99 12.76 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 126.448 1.899 . . . . 0.0 107.429 171.095 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.5 t -76.01 112.5 12.5 Favored 'General case' 0 C--N 1.332 -0.152 0 O-C-N 122.038 -0.414 . . . . 0.0 111.242 -178.341 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.2 mm -88.46 65.92 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 C-N-CA 125.565 1.546 . . . . 0.0 107.676 177.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.62 -88.12 0.17 Allowed Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 125.829 1.68 . . . . 0.0 110.791 175.677 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.29 -42.98 34.82 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 106.352 -1.722 . . . . 0.0 106.352 178.565 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -102.38 162.93 12.53 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.507 1.123 . . . . 0.0 108.799 -159.041 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.2 t -112.02 122.36 47.56 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 175.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -104.58 169.84 8.23 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 106.19 -1.781 . . . . 0.0 106.19 167.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 90.2 m -149.11 85.18 1.46 Allowed 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.867 1.667 . . . . 0.0 110.167 -167.331 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.2 m -76.43 148.61 6.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 O-C-N 120.876 -1.14 . . . . 0.0 110.601 -178.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt . . . . . 0 N--CA 1.435 -1.194 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -179.555 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 . . . . . 0 N--CA 1.452 -0.369 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 49.5 tp -39.54 -46.26 1.71 Allowed 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 125.691 1.596 . . . . 0.0 113.453 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.72 -52.5 59.91 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.492 0.717 . . . . 0.0 111.815 178.161 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -63.31 -47.36 82.58 Favored 'General case' 0 N--CA 1.457 -0.079 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 178.439 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 34.8 t -49.78 -56.51 10.05 Favored 'General case' 0 C--O 1.224 -0.287 0 O-C-N 123.856 0.722 . . . . 0.0 109.713 -178.634 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -57.01 -45.09 83.31 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 124.346 1.059 . . . . 0.0 112.468 -179.174 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.3 tt -60.65 -44.75 96.04 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.582 0.706 . . . . 0.0 109.972 179.456 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.7 m -64.52 -45.6 86.5 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 97.7 m -63.15 -41.41 99.26 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 -176.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.18 -36.62 82.46 Favored 'General case' 0 C--O 1.228 -0.064 0 N-CA-C 106.938 -1.504 . . . . 0.0 106.938 -178.071 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.2 m -70.59 -14.87 62.66 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 177.514 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.6 mt -98.07 5.13 49.01 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.444 0.698 . . . . 0.0 110.644 168.615 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.05 21.01 79.28 Favored Glycine 0 CA--C 1.526 0.78 0 O-C-N 120.782 -1.199 . . . . 0.0 112.168 -177.49 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.1 mt -112.33 -177.7 3.23 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.122 1.769 . . . . 0.0 108.365 177.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -140.95 105.78 4.94 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -163.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.17 134.6 25.15 Favored Glycine 0 CA--C 1.528 0.844 0 C-N-CA 121.335 -0.46 . . . . 0.0 113.866 -166.066 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 11.9 mptt -117.21 165.63 13.2 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 127.374 2.27 . . . . 0.0 105.587 161.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 50.8 t -150.37 104.94 3.28 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.244 -0.91 . . . . 0.0 110.515 -169.739 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.4 mt -87.08 161.36 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 N-CA-C 105.449 -2.056 . . . . 0.0 105.449 162.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -45.32 -49.94 10.3 Favored Glycine 0 CA--C 1.527 0.785 0 CA-C-O 122.236 0.909 . . . . 0.0 114.119 -170.116 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.05 -33.33 22.5 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 124.182 0.993 . . . . 0.0 109.587 -177.204 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 37.3 mttp -119.3 116.21 25.76 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 125.033 1.333 . . . . 0.0 111.258 -157.678 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 20.3 t -66.51 127.03 30.76 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 155.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -105.54 169.09 8.67 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 105.379 -2.082 . . . . 0.0 105.379 165.091 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 87.9 m -148.7 84.09 1.47 Allowed 'General case' 0 C--O 1.233 0.212 0 C-N-CA 124.904 1.282 . . . . 0.0 109.335 -177.408 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -71.41 146.78 11.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 O-C-N 121.175 -0.953 . . . . 0.0 108.905 -177.453 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? . . . . . 0 N--CA 1.441 -0.876 0 O-C-N 120.854 -1.154 . . . . 0.0 112.606 -160.048 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 51.3 t-20 . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.739 0.304 . . . . 0.0 110.594 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.5 tp -51.71 -38.27 54.46 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 124.466 1.106 . . . . 0.0 111.494 -178.444 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 40.8 mtp85 -58.24 -52.3 66.14 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 64.6 ttp -64.3 -49.7 70.76 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 -179.17 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.3 t -49.9 -52.77 30.45 Favored 'General case' 0 C--N 1.334 -0.067 0 C-N-CA 123.008 0.523 . . . . 0.0 110.261 -176.388 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -69.21 -15.52 63.4 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.8 tp -80.54 -52.47 7.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 119.817 1.19 . . . . 0.0 109.36 168.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.1 p -63.91 -41.45 97.67 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.604 -0.685 . . . . 0.0 109.432 -172.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 83.5 m -64.07 -40.23 95.81 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 176.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.7 ttm105 -65.28 -35.64 81.64 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -175.186 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.2 m -55.82 -33.05 64.09 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.536 0.607 . . . . 0.0 111.562 172.009 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 42.5 mt -90.69 6.76 42.69 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.795 0.838 . . . . 0.0 111.302 177.621 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.16 19.7 78.69 Favored Glycine 0 CA--C 1.526 0.754 0 O-C-N 121.32 -0.863 . . . . 0.0 113.299 -178.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 37.3 mt -111.75 170.1 8.37 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.743 1.217 . . . . 0.0 109.976 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -115.61 104.16 11.43 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 126.252 1.821 . . . . 0.0 107.89 -170.379 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.59 128.92 38.94 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-N 116.477 -0.329 . . . . 0.0 113.061 -173.256 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.2 mtpm? -121.11 116.44 24.99 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.549 -1.648 . . . . 0.0 106.549 166.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -94.44 100.67 12.63 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 117.896 0.316 . . . . 0.0 110.148 -169.907 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.2 mt -90.25 162.29 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -171.693 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -39.93 -49.59 3.41 Favored Glycine 0 CA--C 1.525 0.704 0 C-N-CA 125.162 1.363 . . . . 0.0 113.854 -171.846 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.21 -42.24 14.88 Favored 'General case' 0 N--CA 1.439 -1.003 0 C-N-CA 125.782 1.633 . . . . 0.0 107.518 -171.318 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -156.23 159.86 39.3 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.985 0.914 . . . . 0.0 111.531 -153.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.7 t -79.32 125.19 29.18 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.07 169.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -105.41 170.78 7.68 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 167.514 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.3 m -148.57 84.89 1.49 Allowed 'General case' 0 C--O 1.232 0.155 0 C-N-CA 125.115 1.366 . . . . 0.0 110.59 -167.398 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.4 m -76.08 144.72 11.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 O-C-N 120.945 -1.097 . . . . 0.0 111.281 -175.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt . . . . . 0 N--CA 1.433 -1.28 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 173.186 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 55.3 t-20 . . . . . 0 N--CA 1.454 -0.249 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 49.3 tp -51.51 -36.8 46.23 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.935 0.894 . . . . 0.0 111.034 178.604 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.74 -52.38 65.75 Favored 'General case' 0 N--CA 1.458 -0.073 0 CA-C-N 118.776 0.717 . . . . 0.0 110.222 179.36 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 15.5 tmm? -64.32 -46.16 84.72 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -178.405 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 11.4 t -49.79 -57.64 6.95 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 177.565 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -58.79 -40.99 85.64 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 118.522 -0.751 . . . . 0.0 112.078 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.9 tt -60.64 -43.66 97.31 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.605 1.093 . . . . 0.0 110.015 178.149 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.1 t -64.07 -46.48 84.15 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 -178.242 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.8 m -63.23 -45.86 89.66 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -176.755 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -38.97 67.51 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 125.339 1.456 . . . . 0.0 108.817 177.702 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.1 m -67.51 -19.02 65.26 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 178.951 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.8 mt -101.13 9.21 42.25 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.837 0.855 . . . . 0.0 111.039 169.538 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.28 23.11 77.59 Favored Glycine 0 CA--C 1.526 0.756 0 O-C-N 120.878 -1.139 . . . . 0.0 112.779 -179.476 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.7 mt -109.11 175.46 5.45 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 125.562 1.545 . . . . 0.0 108.868 178.302 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.7 tt -126.82 102.86 7.22 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.983 1.713 . . . . 0.0 107.057 -167.917 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.84 120.19 20.42 Favored Glycine 0 CA--C 1.529 0.951 0 O-C-N 122.104 -0.373 . . . . 0.0 112.499 -174.811 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.4 tptt -122.17 106.29 11.02 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 104.521 -2.4 . . . . 0.0 104.521 174.973 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 5.1 t -110.76 124.87 52.82 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.704 0.684 . . . . 0.0 111.534 -170.213 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 22.2 mt -91.34 162.67 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 105.874 -1.899 . . . . 0.0 105.874 168.162 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -5.8 -81.04 0.01 OUTLIER Glycine 0 CA--C 1.532 1.135 0 C-N-CA 127.209 2.337 . . . . 0.0 115.441 -175.043 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.54 -38.78 16.87 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 128.496 2.718 . . . . 0.0 113.919 167.153 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -85.38 100.53 11.9 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.879 1.271 . . . . 0.0 110.433 -156.941 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.4 t -66.64 119.05 11.09 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.048 0.939 . . . . 0.0 110.513 166.018 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.62 171.52 7.32 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 104.802 -2.296 . . . . 0.0 104.802 161.503 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 94.0 m -145.95 83.2 1.63 Allowed 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.234 -2.135 . . . . 0.0 105.234 -177.694 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.3 m -73.53 144.24 12.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 C-N-CA 119.33 -0.948 . . . . 0.0 108.949 -177.455 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.6 ttpp . . . . . 0 N--CA 1.435 -1.218 0 CA-C-O 118.202 -0.904 . . . . 0.0 111.568 -159.755 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 28.1 tp -53.61 -33.81 56.26 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.396 1.078 . . . . 0.0 111.817 179.434 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.73 -46.68 68.27 Favored 'General case' 0 N--CA 1.453 -0.277 0 O-C-N 121.393 -0.817 . . . . 0.0 110.27 -176.76 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 13.3 tmm? -69.1 -44.61 72.12 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 176.694 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 23.3 t -50.7 -55.43 16.59 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 123.889 0.876 . . . . 0.0 110.08 -177.839 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -55.51 -39.42 70.48 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 178.97 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 39.8 tp -67.06 -44.83 79.1 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.972 -0.455 . . . . 0.0 110.618 -179.575 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.1 t -63.65 -44.97 92.27 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 -179.206 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 88.6 m -62.82 -43.65 98.25 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 -177.47 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.8 tpt85 -57.99 -44.49 87.19 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 177.722 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -55.86 -44.51 78.12 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 118.01 0.368 . . . . 0.0 110.039 177.732 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.8 mt -74.95 -3.33 31.57 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.284 0.634 . . . . 0.0 111.6 178.563 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.11 40.19 43.1 Favored Glycine 0 C--N 1.333 0.415 0 CA-C-O 122.313 0.952 . . . . 0.0 110.775 179.292 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 16.8 mt -131.37 -174.26 3.35 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 127.987 2.515 . . . . 0.0 107.303 177.363 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 47.9 tp -145.82 117.18 7.95 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 125.945 1.698 . . . . 0.0 107.517 -168.103 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.68 162.97 49.47 Favored Glycine 0 CA--C 1.533 1.186 0 N-CA-C 115.535 0.974 . . . . 0.0 115.535 -161.829 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -145.04 166.64 24.76 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 127.91 2.484 . . . . 0.0 106.902 157.802 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -121.54 120.35 34.6 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 121.465 -0.772 . . . . 0.0 109.524 177.681 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 56.7 mt -84.49 163.33 2.82 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 156.961 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -39.87 -59.01 2.14 Favored Glycine 0 CA--C 1.529 0.919 0 C-N-CA 124.468 1.033 . . . . 0.0 114.013 -171.556 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.83 -33.59 45.89 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.449 1.5 . . . . 0.0 108.596 -177.261 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.4 ttpm? -140.77 124.15 16.75 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.724 0.297 . . . . 0.0 111.011 -130.717 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.5 t -65.03 134.01 52.91 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.173 0.989 . . . . 0.0 110.5 173.248 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.3 tm-20 -106.31 166.5 10.48 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 105.544 -2.021 . . . . 0.0 105.544 164.314 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 84.2 m -149.74 84.97 1.41 Allowed 'General case' 0 C--O 1.235 0.315 0 C-N-CA 125.474 1.51 . . . . 0.0 110.598 -178.691 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.0 m -71.13 157.46 6.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 178.541 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.441 -0.884 0 O-C-N 120.592 -1.318 . . . . 0.0 109.837 174.53 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 . . . . . 0 N--CA 1.456 -0.165 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.8 tp -50.46 -36.71 34.72 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 124.659 1.184 . . . . 0.0 112.352 177.718 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.17 -48.85 69.38 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 121.209 -0.932 . . . . 0.0 109.238 -177.906 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 12.2 tmm? -55.11 -48.25 73.87 Favored 'General case' 0 C--N 1.335 -0.049 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 174.281 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.8 t -56.73 -58.34 8.5 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.271 0.557 . . . . 0.0 110.518 -175.793 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -49.77 -45.76 49.96 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 125.08 1.352 . . . . 0.0 110.822 175.728 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.4 tp -63.46 -42.4 98.62 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 121.627 -0.671 . . . . 0.0 110.989 -177.576 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -64.62 -51.99 59.79 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 178.43 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.8 m -64.13 -34.36 77.89 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 123.944 0.898 . . . . 0.0 110.147 -170.713 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -47.04 -37.96 10.2 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 123.592 0.757 . . . . 0.0 111.216 170.402 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.3 t -56.2 -34.6 66.42 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.671 0.669 . . . . 0.0 110.742 -176.467 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 68.7 mt -104.34 15.18 28.79 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.675 0.79 . . . . 0.0 110.647 177.58 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 59.77 19.98 51.16 Favored Glycine 0 CA--C 1.523 0.555 0 C-N-CA 124.135 0.874 . . . . 0.0 113.342 -177.757 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 45.9 mt -89.41 171.2 9.91 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 178.375 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -113.41 106.76 14.96 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 105.84 -1.911 . . . . 0.0 105.84 -169.61 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.15 108.53 2.21 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-O 119.399 -0.667 . . . . 0.0 111.755 -174.008 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.22 121.42 41.02 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 172.187 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.1 m -75.26 125.07 28.21 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 168.726 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.7 mt -82.44 160.75 3.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 104.333 -2.469 . . . . 0.0 104.333 146.009 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.49 -46.86 45.52 Favored Glycine 0 CA--C 1.528 0.864 0 O-C-N 121.568 -0.708 . . . . 0.0 113.299 -161.909 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.56 -36.49 18.87 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.89 2.476 . . . . 0.0 111.369 178.812 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -135.21 138.3 43.48 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-O 121.549 0.69 . . . . 0.0 112.107 -153.744 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.8 t -68.7 129.64 40.52 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 118.495 -0.764 . . . . 0.0 111.108 171.642 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -115.95 173.63 6.46 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 105.636 -1.987 . . . . 0.0 105.636 156.073 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -137.0 84.98 2.1 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 125.769 1.628 . . . . 0.0 107.833 -171.327 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.0 m -68.82 151.01 10.44 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.493 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -178.832 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.5 tttp . . . . . 0 N--CA 1.43 -1.453 0 O-C-N 121.37 -0.831 . . . . 0.0 110.628 -165.76 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 59.3 t-20 . . . . . 0 N--CA 1.453 -0.295 0 CA-C-O 120.641 0.258 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 40.2 tp -53.64 -33.81 56.45 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.172 0.989 . . . . 0.0 111.921 -179.608 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.28 -57.77 8.46 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.425 -0.797 . . . . 0.0 110.554 178.693 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -61.88 -42.9 99.62 Favored 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 -178.337 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 38.8 t -48.63 -60.83 2.39 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.045 0.938 . . . . 0.0 108.854 178.832 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -60.72 -34.99 75.22 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -177.425 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.6 tt -63.52 -43.0 98.44 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.42 1.009 . . . . 0.0 110.677 175.237 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.5 t -64.37 -45.68 86.67 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.497 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 63.2 m -63.61 -41.51 98.29 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 -176.642 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.79 -50.18 69.12 Favored 'General case' 0 C--N 1.339 0.11 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 173.486 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.9 m -58.7 -33.35 70.08 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 179.354 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.8 mt -87.22 -4.56 59.1 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.315 0.646 . . . . 0.0 112.177 178.11 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.87 52.52 32.79 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 110.16 -1.176 . . . . 0.0 110.16 -176.921 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 28.2 mt -142.39 174.46 10.61 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 129.895 3.278 . . . . 0.0 107.82 177.552 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.5 tt -130.0 113.92 15.17 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 127.893 2.477 . . . . 0.0 106.715 -172.111 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -77.71 138.09 21.07 Favored Glycine 0 CA--C 1.53 0.984 0 N-CA-C 114.597 0.599 . . . . 0.0 114.597 -168.608 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -117.47 167.49 11.24 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 127.231 2.212 . . . . 0.0 107.868 167.765 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.2 t -112.58 130.8 55.9 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.656 0.782 . . . . 0.0 110.597 173.797 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.5 mt -111.13 163.62 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 C-N-CA 126.914 2.086 . . . . 0.0 106.996 168.111 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -27.07 -63.27 0.08 OUTLIER Glycine 0 CA--C 1.535 1.321 0 C-N-CA 126.228 1.871 . . . . 0.0 116.481 -175.513 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.19 -34.18 22.11 Favored 'General case' 0 N--CA 1.443 -0.776 0 O-C-N 121.063 -1.257 . . . . 0.0 109.345 -178.064 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -147.98 152.59 37.74 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.124 0.57 . . . . 0.0 112.512 -129.357 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.0 t -65.06 144.48 57.23 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.661 1.584 . . . . 0.0 111.504 173.009 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.425 ' CD ' HG13 ' A' ' 29' ' ' VAL . 9.3 tm-20 -114.93 168.71 9.66 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 157.048 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 98.6 m -147.01 84.35 1.59 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 126.081 1.752 . . . . 0.0 110.648 178.497 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.425 HG13 ' CD ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -82.79 158.32 3.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 -174.718 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.1 tptt . . . . . 0 N--CA 1.44 -0.935 0 O-C-N 120.815 -1.178 . . . . 0.0 109.876 165.065 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.0 t30 . . . . . 0 N--CA 1.463 0.203 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 30.6 tp -48.47 -44.73 35.95 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 123.166 0.586 . . . . 0.0 112.291 179.547 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -64.25 -37.34 87.14 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 120.139 -0.624 . . . . 0.0 111.033 -172.452 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.3 tmm? -60.86 -51.06 70.91 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 174.775 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.0 t -57.47 -56.93 15.53 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.88 -175.51 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -45.79 -50.62 13.83 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 126.031 1.732 . . . . 0.0 110.354 171.741 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 31.5 tp -62.49 -30.67 71.44 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 121.768 -0.583 . . . . 0.0 111.518 -177.289 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.3 t -71.73 -56.46 5.75 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 119.004 0.82 . . . . 0.0 109.053 172.014 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.2 m -63.81 -28.36 69.81 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.597 1.559 . . . . 0.0 110.639 -167.442 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.2 ttp85 -41.22 -46.02 3.03 Favored 'General case' 0 C--O 1.226 -0.136 0 C-N-CA 125.927 1.691 . . . . 0.0 110.422 168.333 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.6 m -55.18 -31.12 61.13 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.626 0.648 . . . . 0.0 112.286 -175.431 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.7 mt -106.53 9.48 31.52 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 123.711 0.804 . . . . 0.0 111.074 -178.059 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 56.6 54.57 35.3 Favored Glycine 0 C--N 1.339 0.74 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 -177.575 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 39.0 mt -127.15 140.55 52.18 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 125.393 1.477 . . . . 0.0 108.092 175.576 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.5 tp -72.11 121.42 19.22 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 125.843 1.657 . . . . 0.0 107.043 168.703 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.35 128.76 16.35 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 111.521 -0.631 . . . . 0.0 111.521 -178.645 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -107.91 94.6 5.16 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 126.904 2.082 . . . . 0.0 107.241 177.231 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.1 103.08 4.43 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 172.074 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 22.8 mt -82.74 161.15 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 N-CA-C 104.1 -2.556 . . . . 0.0 104.1 167.402 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -45.46 -47.75 11.88 Favored Glycine 0 CA--C 1.527 0.784 0 O-C-N 122.022 -0.424 . . . . 0.0 112.536 -166.878 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.94 -41.96 20.11 Favored 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 128.202 2.601 . . . . 0.0 109.227 -172.426 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.1 ptpp? -155.87 161.39 40.6 Favored 'General case' 0 C--O 1.227 -0.118 0 CA-C-O 121.246 0.546 . . . . 0.0 112.314 -153.737 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.9 t -88.28 129.89 35.25 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.014 0.926 . . . . 0.0 110.744 179.078 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -117.26 172.43 7.31 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 168.032 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 82.3 m -147.8 100.84 3.26 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.401 1.08 . . . . 0.0 108.78 -169.895 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.8 m -97.22 154.24 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 O-C-N 121.012 -1.055 . . . . 0.0 109.133 176.515 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.5 ttmm . . . . . 0 N--CA 1.443 -0.815 0 O-C-N 121.673 -0.642 . . . . 0.0 109.901 170.648 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.171 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -69.0 84.77 0.33 Allowed 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 120.64 1.564 . . . . 0.0 107.083 163.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 21.3 t -67.8 107.37 2.58 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 105.201 -2.148 . . . . 0.0 105.201 167.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 -74.22 95.2 2.58 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.966 0.412 . . . . 0.0 110.387 -163.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.6 tp -53.93 -37.03 63.43 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.94 0.896 . . . . 0.0 112.103 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 72.6 ttt-85 -64.61 -48.84 73.42 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 119.62 1.1 . . . . 0.0 109.596 -178.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -61.95 -46.2 90.35 Favored 'General case' 0 N--CA 1.457 -0.117 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.4 t -56.42 -52.52 64.34 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 110.428 -0.212 . . . . 0.0 110.428 -178.481 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -51.49 -49.95 60.83 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 118.314 -0.851 . . . . 0.0 110.422 173.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.7 tp -58.28 -52.41 65.69 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 119.236 0.925 . . . . 0.0 110.909 -177.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.8 m -64.69 -42.84 95.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.535 0.683 . . . . 0.0 109.458 -172.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.5 m -64.29 -43.1 95.81 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 175.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -66.23 -32.01 73.18 Favored 'General case' 0 C--O 1.226 -0.146 0 N-CA-C 107.165 -1.421 . . . . 0.0 107.165 -170.842 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.0 m -56.37 -33.41 65.69 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.142 0.428 . . . . 0.0 111.162 173.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 40.3 mt -91.86 12.29 22.05 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.9 0.88 . . . . 0.0 110.764 174.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.39 -20.61 36.6 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 125.139 1.352 . . . . 0.0 112.533 -177.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.0 mt -83.47 178.01 8.2 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.389 -1.065 . . . . 0.0 110.294 -152.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 13.3 tp -109.24 94.83 5.25 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.983 2.513 . . . . 0.0 107.347 -177.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -64.51 130.5 37.44 Favored Glycine 0 CA--C 1.523 0.534 0 CA-C-O 119.431 -0.65 . . . . 0.0 111.794 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.91 138.68 42.64 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 168.595 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -111.81 108.02 17.28 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 119.263 -0.399 . . . . 0.0 110.588 -155.081 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.5 mt -86.17 161.63 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -172.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -40.07 -49.97 3.52 Favored Glycine 0 CA--C 1.525 0.682 0 C-N-CA 125.283 1.421 . . . . 0.0 113.908 -172.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.74 -46.21 14.57 Favored 'General case' 0 N--CA 1.44 -0.941 0 C-N-CA 126.137 1.775 . . . . 0.0 108.875 -176.068 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -156.68 159.73 38.67 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -156.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 18.0 t -71.59 141.51 50.03 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.92 0.888 . . . . 0.0 111.173 175.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -127.67 172.6 10.63 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 167.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.5 m -145.01 97.36 3.0 Favored 'General case' 0 C--N 1.334 -0.068 0 C-N-CA 126.443 1.897 . . . . 0.0 107.241 -167.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -74.94 164.62 3.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 169.129 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.2 tttt -84.74 -76.68 0.3 Allowed 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 121.342 -0.849 . . . . 0.0 110.196 178.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 21.9 m170 -80.25 162.13 24.78 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.355 0.843 0 O-C-N 123.891 0.744 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.128 0 N-CA-C 105.747 -1.946 . . . . 0.0 105.747 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 51.8 t80 67.86 -56.89 0.47 Allowed 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 119.537 1.062 . . . . 0.0 109.365 -157.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.5 t -61.69 128.78 37.9 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 162.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -129.2 117.81 21.35 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 127.13 2.172 . . . . 0.0 107.335 -158.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 45.7 tp -46.08 -47.25 17.2 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.567 1.147 . . . . 0.0 112.084 174.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.1 ttm180 -60.19 -46.78 88.55 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.771 0.319 . . . . 0.0 110.22 -169.296 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 16.8 tmm? -67.9 -45.73 73.61 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 123.288 0.635 . . . . 0.0 109.342 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.1 t -53.97 -42.69 69.24 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.658 0.742 . . . . 0.0 111.231 -175.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -51.1 -33.73 27.4 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.918 1.287 . . . . 0.0 112.636 173.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.57 -46.35 59.66 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 123.886 0.874 . . . . 0.0 109.295 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.2 m -64.56 -53.28 50.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -176.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 97.2 m -64.8 -28.4 69.54 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.9 1.28 . . . . 0.0 110.943 -174.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.1 ttm105 -59.03 -20.16 50.56 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 117.938 -1.03 . . . . 0.0 111.123 177.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.6 p -50.53 -47.88 57.36 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 120.112 1.324 . . . . 0.0 110.899 175.158 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 81.9 mt -100.03 22.34 11.42 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.58 0.752 . . . . 0.0 109.424 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.12 20.25 60.22 Favored Glycine 0 C--N 1.334 0.463 0 C-N-CA 123.873 0.749 . . . . 0.0 113.042 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 33.5 mt -84.72 145.46 27.92 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.6 tt -76.68 97.85 4.57 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 105.237 -2.135 . . . . 0.0 105.237 175.029 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.5 148.12 48.03 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.715 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.443 ' NZ ' ' OE2' ' A' ' 27' ' ' GLU . 14.8 tptp -165.38 94.39 0.62 Allowed 'General case' 0 N--CA 1.425 -1.696 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 -140.408 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.7 t -74.53 116.62 15.42 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.243 -1.536 . . . . 0.0 110.973 -176.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 11.6 mm -84.68 161.24 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 162.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -25.31 -69.27 0.04 OUTLIER Glycine 0 CA--C 1.529 0.91 0 C-N-CA 125.886 1.708 . . . . 0.0 114.291 -169.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.73 -44.0 12.9 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 127.995 2.518 . . . . 0.0 108.928 179.354 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.1 mttm -108.78 129.38 55.38 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.006 0.522 . . . . 0.0 109.64 -151.144 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.3 t -65.04 118.91 9.83 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 164.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.443 ' OE2' ' NZ ' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -120.74 172.2 8.05 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 179.445 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 24.6 m -146.38 114.28 6.51 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 -165.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.5 m -103.03 145.46 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 171.478 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.7 tttm -82.46 80.4 8.63 Favored 'General case' 0 N--CA 1.437 -1.111 0 O-C-N 121.134 -0.979 . . . . 0.0 109.722 -178.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 72.43 -65.67 0.34 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.769 1.628 . . . . 0.0 109.668 175.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.067 0 O-C-N 124.281 0.988 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.045 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -75.14 63.21 1.28 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 120.137 1.335 . . . . 0.0 111.066 -178.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.4 t -71.89 89.3 1.07 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 176.074 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 64.3 t-20 -74.28 85.39 1.92 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.119 0.485 . . . . 0.0 110.363 -170.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.5 tp -49.63 -38.36 31.73 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.895 1.278 . . . . 0.0 112.148 176.03 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -64.54 -49.8 69.84 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.388 -0.82 . . . . 0.0 109.91 -177.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -65.42 -46.29 80.56 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.4 t -46.53 -50.81 16.64 Favored 'General case' 0 C--O 1.226 -0.139 0 C-N-CA 123.53 0.732 . . . . 0.0 109.846 178.595 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -58.27 -37.08 74.27 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 123.773 0.829 . . . . 0.0 112.94 177.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.8 tp -66.39 -45.73 79.02 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 119.799 1.181 . . . . 0.0 110.708 176.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.43 -45.49 87.3 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.3 m -63.45 -42.06 98.65 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.29 -31.91 70.7 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.5 m -71.52 -18.77 62.25 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 121.111 -0.993 . . . . 0.0 113.298 176.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 46.0 mt -93.85 6.21 49.14 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.892 0.877 . . . . 0.0 110.686 165.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.15 9.08 87.23 Favored Glycine 0 CA--C 1.527 0.822 0 O-C-N 120.743 -1.223 . . . . 0.0 113.126 -177.02 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 33.7 mt -105.15 148.92 26.36 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.267 1.427 . . . . 0.0 111.431 -171.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -79.6 124.09 28.21 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 127.145 2.178 . . . . 0.0 107.264 171.121 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -87.94 131.07 10.42 Favored Glycine 0 CA--C 1.525 0.711 0 CA-C-N 118.052 0.387 . . . . 0.0 112.945 -177.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -113.43 166.03 11.89 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 128.147 2.579 . . . . 0.0 109.09 175.042 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 33.4 t -119.4 130.18 55.18 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 169.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 4.5 mt -105.18 161.61 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 N-CA-C 105.804 -1.924 . . . . 0.0 105.804 161.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -46.33 -43.53 14.41 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 123.754 0.692 . . . . 0.0 113.531 -173.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -75.05 -47.0 31.12 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 126.383 1.873 . . . . 0.0 108.873 -175.17 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -156.51 164.01 38.72 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -153.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 14.7 t -64.73 138.0 58.13 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.617 1.167 . . . . 0.0 109.406 164.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.16 170.1 8.53 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 164.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 77.2 m -145.5 124.77 12.97 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 178.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.3 m -128.73 150.11 34.09 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.566 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 172.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -72.44 125.0 26.33 Favored 'General case' 0 N--CA 1.436 -1.142 0 O-C-N 120.732 -1.23 . . . . 0.0 111.598 -168.373 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 48.5 m80 -37.54 145.17 0.07 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.463 1.505 . . . . 0.0 111.403 169.184 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 0.995 0 O-C-N 123.917 0.761 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.977 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -67.42 -46.62 72.61 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 160.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -63.65 132.61 51.64 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 168.394 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -98.56 119.24 36.94 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 126.23 1.812 . . . . 0.0 108.494 171.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.6 tp -59.2 -35.33 73.41 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.82 0.848 . . . . 0.0 112.204 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -56.08 24.08 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 121.15 -0.969 . . . . 0.0 110.551 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 15.6 tmm? -54.58 -45.7 73.6 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 177.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.8 t -57.65 -57.52 12.38 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.85 -174.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -58.9 -40.06 83.33 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 122.09 -0.381 . . . . 0.0 110.737 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -57.13 -40.13 76.54 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 121.626 -0.671 . . . . 0.0 110.972 176.055 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.4 t -68.15 -51.67 43.36 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 176.233 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.6 m -64.15 -29.4 70.52 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.485 1.114 . . . . 0.0 110.82 -171.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.16 -46.37 12.01 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.512 1.125 . . . . 0.0 109.505 169.288 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -56.91 -28.29 61.78 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.105 0.411 . . . . 0.0 112.102 -175.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 mt -105.33 5.86 32.24 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 124.088 0.955 . . . . 0.0 111.15 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 56.2 52.59 48.54 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 -176.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 38.3 mt -126.75 142.27 51.59 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 125.415 1.486 . . . . 0.0 108.056 175.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.0 tt -76.39 109.64 10.26 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 105.704 -1.961 . . . . 0.0 105.704 170.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.27 134.07 28.75 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 177.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.47 165.39 21.71 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 167.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.7 t -132.07 102.98 6.03 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 122.075 -0.391 . . . . 0.0 110.013 -157.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.6 mt -82.99 161.31 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 N-CA-C 104.657 -2.349 . . . . 0.0 104.657 175.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -40.31 -55.6 3.01 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 123.966 0.793 . . . . 0.0 112.577 -166.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.03 -44.51 15.13 Favored 'General case' 0 N--CA 1.439 -0.988 0 C-N-CA 128.411 2.684 . . . . 0.0 107.697 -176.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -122.79 127.96 49.8 Favored 'General case' 0 C--N 1.334 -0.08 0 C-N-CA 124.037 0.935 . . . . 0.0 110.181 -145.003 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.6 t -64.62 140.89 58.91 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 161.068 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -140.29 172.09 13.23 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 106.857 -1.535 . . . . 0.0 106.857 167.679 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 65.7 m -145.83 108.69 4.54 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 -162.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.2 m -110.16 146.67 15.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 123.706 0.802 . . . . 0.0 109.727 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.6 tttp -85.65 50.06 1.89 Allowed 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 120.955 -1.091 . . . . 0.0 109.667 176.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -72.38 75.54 1.02 Allowed 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.402 1.081 . . . . 0.0 108.407 -178.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 1.009 0 O-C-N 124.334 1.021 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.746 0 N-CA-C 104.954 -2.239 . . . . 0.0 104.954 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.28 -52.43 52.85 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 157.256 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 44.8 t -66.04 124.38 22.4 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 174.464 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -108.65 114.69 28.7 Favored 'General case' 0 C--N 1.333 -0.119 0 C-N-CA 125.84 1.656 . . . . 0.0 107.583 169.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 38.4 tp -58.31 -38.48 77.18 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.414 0.686 . . . . 0.0 111.9 -178.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -51.33 69.52 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.555 0.616 . . . . 0.0 110.008 -178.391 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.0 -49.76 75.74 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.182 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.4 t -50.75 -52.71 37.94 Favored 'General case' 0 N--CA 1.46 0.055 0 CA-C-O 121.791 0.805 . . . . 0.0 110.337 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -60.19 -39.3 86.04 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 123.176 0.59 . . . . 0.0 111.284 177.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 40.5 tp -60.32 -43.24 96.54 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.676 -0.64 . . . . 0.0 111.204 176.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.78 -44.74 84.88 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.26 -0.9 . . . . 0.0 109.779 175.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -64.07 -36.04 82.7 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.538 0.335 . . . . 0.0 110.316 -173.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.4 ttt85 -45.13 -37.07 4.07 Favored 'General case' 0 C--N 1.341 0.211 0 C-N-CA 124.237 1.015 . . . . 0.0 111.163 170.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.3 t -55.81 -33.07 64.11 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.699 0.681 . . . . 0.0 111.027 -175.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.0 mt -107.64 15.38 24.75 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.778 0.831 . . . . 0.0 110.615 178.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.26 24.97 66.03 Favored Glycine 0 CA--C 1.524 0.624 0 O-C-N 121.387 -0.821 . . . . 0.0 113.152 -178.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 57.6 mt -98.81 162.37 13.14 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 123.78 0.832 . . . . 0.0 109.505 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 tt -105.51 104.43 14.16 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.99 1.716 . . . . 0.0 107.687 -174.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.96 123.79 31.02 Favored Glycine 0 CA--C 1.524 0.641 0 CA-C-O 119.306 -0.719 . . . . 0.0 112.148 -178.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.458 ' NZ ' ' OE1' ' A' ' 27' ' ' GLU . 2.2 pptp? -135.77 130.82 34.66 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 170.302 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 21.6 t -102.48 119.91 39.63 Favored 'General case' 0 N--CA 1.461 0.079 0 N-CA-C 112.486 0.551 . . . . 0.0 112.486 -166.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 13.5 mt -84.11 66.99 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 C-N-CA 125.591 1.556 . . . . 0.0 106.838 176.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.14 -84.1 0.51 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 125.524 1.535 . . . . 0.0 110.339 174.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.06 -45.44 18.31 Favored 'General case' 0 N--CA 1.44 -0.938 0 C-N-CA 125.61 1.564 . . . . 0.0 107.186 175.567 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.4 mttp -95.23 115.88 28.01 Favored 'General case' 0 C--O 1.227 -0.094 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 -155.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 20.1 t -64.53 119.05 9.72 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 165.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.458 ' OE1' ' NZ ' ' A' ' 20' ' ' LYS . 1.3 tm-20 -109.18 173.8 6.16 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 165.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 99.0 m -145.75 83.37 1.65 Allowed 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.616 1.567 . . . . 0.0 107.524 -167.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.4 m -76.46 144.25 12.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 C-N-CA 119.489 -0.884 . . . . 0.0 109.058 -173.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -81.18 94.41 6.65 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 175.15 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 10.8 t-160 -72.72 -118.52 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 160.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 0.979 0 O-C-N 123.25 0.344 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.559 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -72.31 104.84 3.85 Favored 'General case' 0 C--N 1.334 -0.078 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 172.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.2 t -83.58 83.96 7.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.989 0.423 . . . . 0.0 111.111 -173.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -73.3 90.67 1.65 Allowed 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 169.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 35.7 tp -50.04 -35.77 26.27 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.77 1.228 . . . . 0.0 112.112 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.7 mmm-85 -67.45 -46.1 74.05 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.253 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -62.91 -46.61 87.02 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.151 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 35.9 t -47.84 -52.66 18.21 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.714 0.769 . . . . 0.0 109.783 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -61.04 -32.8 72.41 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 123.65 0.78 . . . . 0.0 112.242 177.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 37.2 tp -66.4 -44.06 84.09 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.805 1.184 . . . . 0.0 111.126 175.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.31 -43.29 95.17 Favored 'General case' 0 C--N 1.332 -0.189 0 O-C-N 120.997 -1.064 . . . . 0.0 108.875 176.831 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 65.2 m -64.38 -40.63 96.21 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.952 -0.547 . . . . 0.0 109.576 -177.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.6 ttt85 -47.56 -49.49 26.37 Favored 'General case' 0 C--N 1.343 0.29 0 CA-C-N 119.261 0.937 . . . . 0.0 109.961 168.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.9 m -59.77 -31.25 69.5 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.837 -0.125 . . . . 0.0 110.917 -175.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 53.6 mt -89.61 -1.88 58.15 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.697 0.799 . . . . 0.0 112.304 175.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.13 28.89 70.98 Favored Glycine 0 CA--C 1.526 0.765 0 O-C-N 120.657 -1.277 . . . . 0.0 112.511 -177.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 52.2 mt -117.64 177.43 4.76 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 126.797 2.039 . . . . 0.0 108.474 -179.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -122.02 111.43 17.03 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 126.961 2.105 . . . . 0.0 107.445 -171.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -73.28 119.65 6.77 Favored Glycine 0 CA--C 1.523 0.534 0 CA-C-O 119.321 -0.711 . . . . 0.0 111.589 -174.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -137.19 149.39 47.2 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 170.603 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -123.88 121.02 34.26 Favored 'General case' 0 N--CA 1.462 0.126 0 O-C-N 121.327 -0.858 . . . . 0.0 112.978 -159.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.1 mm -84.5 67.03 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 175.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.08 -88.06 0.19 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 126.539 2.019 . . . . 0.0 110.674 173.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.56 -29.83 56.81 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.7 mttp -108.7 108.05 18.74 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.238 1.015 . . . . 0.0 109.789 -159.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.3 t -64.09 131.59 47.99 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 165.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -132.54 172.97 11.82 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 106.033 -1.839 . . . . 0.0 106.033 166.175 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 79.6 m -131.42 88.38 2.58 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 126.789 2.036 . . . . 0.0 106.157 -170.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.5 m -71.54 164.82 3.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 173.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.4 tptp -65.56 -52.28 53.55 Favored 'General case' 0 N--CA 1.433 -1.322 0 O-C-N 120.778 -1.201 . . . . 0.0 110.476 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 30.6 m80 -140.99 164.15 31.05 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 106.857 -1.535 . . . . 0.0 106.857 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.355 0.827 0 O-C-N 124.187 0.929 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.942 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -145.05 -39.24 0.26 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 124.625 1.17 . . . . 0.0 112.604 -161.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 t -64.29 127.22 30.54 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.677 0.791 . . . . 0.0 110.557 -170.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -100.56 108.74 20.74 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 108.512 -0.922 . . . . 0.0 108.512 175.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 44.1 tp -34.96 -53.42 0.57 Allowed 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 125.235 1.414 . . . . 0.0 114.672 -171.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 -45.99 -47.42 16.72 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-N 118.358 0.526 . . . . 0.0 111.813 -176.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 49.8 ttm -63.75 -53.41 51.47 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 -176.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.8 t -49.83 -54.69 17.77 Favored 'General case' 0 C--O 1.231 0.087 0 CA-C-O 121.593 0.711 . . . . 0.0 110.705 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -49.48 -51.54 35.39 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 125.401 1.481 . . . . 0.0 110.324 176.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 47.2 tp -61.5 -47.78 84.05 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.092 0.557 . . . . 0.0 111.051 -177.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 p -64.52 -47.53 78.49 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -175.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.418 ' SG ' ' HA2' ' A' ' 19' ' ' GLY . 72.1 m -64.41 -39.84 94.62 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -178.106 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.48 -38.76 75.06 Favored 'General case' 0 C--O 1.228 -0.074 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 m -63.61 -28.51 69.97 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.063 -0.398 . . . . 0.0 111.591 178.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 43.0 mt -88.24 3.52 49.16 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.889 0.876 . . . . 0.0 111.302 171.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 69.92 29.59 70.76 Favored Glycine 0 C--N 1.336 0.533 0 O-C-N 120.988 -1.07 . . . . 0.0 112.227 -177.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 70.6 mt -118.37 152.69 35.35 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 125.917 1.687 . . . . 0.0 109.064 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.0 tp -85.93 96.73 9.9 Favored 'General case' 0 N--CA 1.442 -0.835 0 C-N-CA 127.067 2.147 . . . . 0.0 106.86 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.418 ' HA2' ' SG ' ' A' ' 12' ' ' CYS . . . -65.91 114.4 6.56 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.483 -0.865 . . . . 0.0 111.264 -178.073 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.64 112.77 25.28 Favored 'General case' 0 N--CA 1.438 -1.072 0 N-CA-C 104.881 -2.266 . . . . 0.0 104.881 173.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.6 t -77.15 113.15 14.58 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 124.378 1.071 . . . . 0.0 109.29 177.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 30.1 mm -84.49 159.79 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 160.074 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -49.18 -48.2 32.73 Favored Glycine 0 C--O 1.224 -0.488 0 CA-C-O 121.982 0.768 . . . . 0.0 112.96 -159.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.2 -36.42 18.0 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 130.225 3.41 . . . . 0.0 115.964 177.694 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.0 tptt -133.93 129.5 36.4 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 -161.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.3 t -68.48 126.64 30.29 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 118.171 -0.919 . . . . 0.0 109.767 170.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -108.94 172.12 7.03 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 105.679 -1.971 . . . . 0.0 105.679 163.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.0 m -145.04 84.67 1.72 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 -168.212 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -70.07 172.1 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -84.75 155.83 21.69 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.308 -1.495 . . . . 0.0 111.557 -172.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -32.62 90.53 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.188 1.395 . . . . 0.0 109.713 154.128 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 0.953 0 O-C-N 124.189 0.931 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.633 0 N-CA-C 104.673 -2.343 . . . . 0.0 104.673 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -63.27 -58.81 5.93 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 154.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.1 t -63.84 136.29 57.28 Favored 'General case' 0 C--O 1.239 0.544 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 176.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -98.7 110.47 23.06 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 126.374 1.87 . . . . 0.0 108.201 175.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 45.0 tp -51.07 -43.84 61.07 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 123.829 0.852 . . . . 0.0 112.16 177.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 63.8 ttp85 -62.83 -42.86 99.9 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.95 0.796 . . . . 0.0 110.717 -172.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 13.5 tmm? -61.7 -49.6 75.82 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 174.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.3 t -55.0 -52.02 64.42 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.911 -175.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -50.61 -55.06 18.04 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.06 1.344 . . . . 0.0 110.772 172.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 tp -56.72 -38.35 72.22 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.2 m -71.55 -53.4 13.92 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.11 0.481 . . . . 0.0 109.738 -178.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.3 m -64.35 -27.58 69.11 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 124.413 1.085 . . . . 0.0 110.663 -174.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 44.9 ttt180 -52.75 -25.47 11.28 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.217 -0.896 . . . . 0.0 111.273 173.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.6 p -50.38 -43.16 54.32 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 120.221 1.373 . . . . 0.0 111.29 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.7 mt -102.87 18.79 20.68 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.107 0.963 . . . . 0.0 110.132 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.21 31.25 72.79 Favored Glycine 0 CA--C 1.522 0.503 0 O-C-N 121.632 -0.668 . . . . 0.0 112.866 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 65.7 mt -98.43 139.16 34.59 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.784 0.833 . . . . 0.0 108.823 178.05 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 39.2 tp -63.59 108.31 1.36 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 165.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.22 129.09 22.96 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 108.925 -1.67 . . . . 0.0 108.925 167.241 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.57 153.54 48.69 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 174.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.2 t -128.96 100.83 5.81 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -146.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.7 mt -83.72 161.02 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 N-CA-C 105.383 -2.08 . . . . 0.0 105.383 173.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -40.87 -55.31 3.39 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 124.289 0.947 . . . . 0.0 112.854 -163.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.83 -43.91 12.9 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 127.234 2.214 . . . . 0.0 109.63 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -115.31 125.97 53.9 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.182 0.593 . . . . 0.0 109.791 -151.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.1 t -73.12 129.31 37.78 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 163.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -118.94 172.5 7.5 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 171.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.0 m -143.54 126.14 15.94 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 106.332 -1.729 . . . . 0.0 106.332 -173.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.4 m -135.53 152.99 32.44 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-N 118.423 0.556 . . . . 0.0 109.514 175.517 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 38.2 tttm -76.3 141.64 41.56 Favored 'General case' 0 N--CA 1.436 -1.157 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 174.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.4 m80 70.81 -63.94 0.39 Allowed 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 125.046 1.338 . . . . 0.0 109.925 -176.314 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.079 0 O-C-N 124.401 1.063 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.529 0 CA-C-O 116.77 -1.586 . . . . 0.0 108.021 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -176.31 -49.99 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 119.821 1.191 . . . . 0.0 110.423 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.4 t -64.42 114.04 4.05 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.014 0.926 . . . . 0.0 112.337 -164.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -75.81 112.26 12.01 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 159.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 48.9 tp -48.6 -42.45 34.0 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.535 1.134 . . . . 0.0 113.342 178.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.18 -54.11 48.43 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 118.81 0.732 . . . . 0.0 109.848 -178.279 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -60.47 -44.53 95.79 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.5 t -51.38 -57.55 8.65 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.543 0.687 . . . . 0.0 109.866 177.182 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -61.66 -34.82 76.4 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-O 117.984 -1.008 . . . . 0.0 111.458 -178.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 44.1 tp -63.0 -45.14 93.83 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.89 1.223 . . . . 0.0 110.637 175.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.0 m -64.89 -47.35 78.13 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.8 m -64.03 -43.82 94.41 Favored 'General case' 0 CA--C 1.535 0.365 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 -178.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -44.91 -53.61 7.41 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 125.688 1.595 . . . . 0.0 109.538 168.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 12.8 m -54.98 -44.21 74.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 118.235 0.47 . . . . 0.0 111.111 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.4 mt -75.28 -7.41 53.85 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.399 0.68 . . . . 0.0 112.454 177.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.97 43.84 25.81 Favored Glycine 0 C--N 1.334 0.457 0 CA-C-O 122.174 0.874 . . . . 0.0 111.298 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 54.1 mt -136.55 157.39 46.88 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 126.418 1.887 . . . . 0.0 108.403 -177.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.1 tp -90.78 108.01 19.56 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.67 1.988 . . . . 0.0 107.224 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.33 136.05 27.96 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.657 -0.782 . . . . 0.0 111.716 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 pptp? -134.57 153.47 51.94 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 166.053 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.6 t -134.08 96.87 3.72 Favored 'General case' 0 CA--C 1.518 -0.271 0 O-C-N 121.972 -0.455 . . . . 0.0 111.297 -154.112 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 6.2 mt -86.56 65.46 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 -177.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.72 -73.33 0.25 Allowed Glycine 0 CA--C 1.528 0.877 0 C-N-CA 124.374 0.988 . . . . 0.0 112.633 172.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.89 -49.96 7.47 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 126.217 1.807 . . . . 0.0 110.808 165.451 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -88.88 99.55 12.48 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -160.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 33.8 t -63.48 132.03 50.05 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 106.949 -1.501 . . . . 0.0 106.949 161.164 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -128.39 171.73 11.77 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 104.646 -2.353 . . . . 0.0 104.646 174.168 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -146.3 86.44 1.69 Allowed 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 -169.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -71.94 163.62 3.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 178.201 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.0 ttmm -95.67 -22.43 17.57 Favored 'General case' 0 N--CA 1.437 -1.122 0 O-C-N 121.476 -0.765 . . . . 0.0 111.318 174.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 13.5 m170 -127.1 147.54 50.17 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 -173.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.356 0.85 0 O-C-N 124.12 0.888 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.513 0 N-CA-C 105.358 -2.09 . . . . 0.0 105.358 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -150.77 -59.99 0.18 Allowed 'General case' 0 CA--C 1.533 0.321 0 O-C-N 124.088 0.867 . . . . 0.0 111.456 -156.475 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.9 t -64.57 110.87 2.47 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -163.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -75.18 84.07 2.37 Favored 'General case' 0 CA--C 1.527 0.08 0 O-C-N 121.466 -0.771 . . . . 0.0 109.688 173.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.1 tp -35.99 -48.2 0.57 Allowed 'General case' 0 C--O 1.224 -0.275 0 C-N-CA 125.782 1.633 . . . . 0.0 113.768 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 70.4 mtm180 -55.34 -48.68 73.83 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 122.163 -0.336 . . . . 0.0 111.045 -176.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -65.41 -50.19 66.41 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 45.7 t -47.27 -52.67 15.47 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 121.646 0.736 . . . . 0.0 110.464 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -51.82 -47.09 64.49 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 124.121 0.968 . . . . 0.0 111.609 177.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 37.1 tp -67.27 -48.6 67.22 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 122.611 0.364 . . . . 0.0 110.186 -176.483 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.7 m -64.16 -41.03 97.31 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -174.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.0 m -64.92 -46.57 81.09 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 176.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.3 ttp-105 -58.12 -34.45 70.24 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 121.933 -0.48 . . . . 0.0 109.91 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.9 m -57.49 -29.46 64.29 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.679 0.672 . . . . 0.0 111.546 177.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 57.7 mt -99.9 14.48 30.3 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.185 0.994 . . . . 0.0 110.825 176.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.04 7.99 68.13 Favored Glycine 0 CA--C 1.527 0.811 0 O-C-N 120.996 -1.065 . . . . 0.0 113.235 -178.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 32.1 mt -92.05 145.22 24.69 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 122.179 0.99 . . . . 0.0 109.798 -175.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.5 tp -76.41 107.6 8.79 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 125.37 1.468 . . . . 0.0 107.193 170.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -90.2 138.26 14.4 Favored Glycine 0 C--N 1.331 0.29 0 CA-C-O 118.902 -0.944 . . . . 0.0 111.838 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.94 159.38 38.04 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 173.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 95.9 m -83.44 126.59 32.92 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 121.199 -0.938 . . . . 0.0 110.921 -176.094 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 14.8 mm -85.03 162.01 3.0 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 152.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -39.24 -56.72 2.26 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 124.921 1.248 . . . . 0.0 113.738 -171.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.37 -43.07 15.08 Favored 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 124.79 1.236 . . . . 0.0 108.606 -179.112 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.6 mttm -118.5 151.67 37.41 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 123.106 0.562 . . . . 0.0 110.902 -151.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.9 t -66.54 131.24 45.59 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 154.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -104.18 167.35 9.81 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 105.534 -2.025 . . . . 0.0 105.534 164.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 66.7 m -141.12 114.18 8.54 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 103.696 -2.705 . . . . 0.0 103.696 168.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.0 m -108.67 152.23 10.71 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.681 0 N-CA-C 106.519 -1.659 . . . . 0.0 106.519 168.115 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.07 122.7 22.21 Favored 'General case' 0 N--CA 1.432 -1.375 0 O-C-N 120.959 -1.088 . . . . 0.0 110.305 -173.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 24.8 t-80 -52.5 160.38 0.86 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.012 1.325 . . . . 0.0 111.593 174.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 0.988 0 O-C-N 123.675 0.609 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.338 0 N-CA-C 106.039 -1.837 . . . . 0.0 106.039 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 44.4 t80 70.67 -53.26 0.66 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 120.651 1.569 . . . . 0.0 110.477 -170.502 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.7 t -61.91 123.24 17.51 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 106.361 -1.718 . . . . 0.0 106.361 168.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -93.83 130.44 39.86 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 123.732 0.813 . . . . 0.0 108.94 -176.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 31.7 tp -58.95 -45.39 90.57 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.541 0.337 . . . . 0.0 111.39 -173.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -61.99 -42.71 99.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 -176.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -58.37 -52.24 66.42 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.068 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.9 t -53.32 -55.92 20.89 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.652 -176.591 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -55.81 -46.59 78.0 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.318 1.047 . . . . 0.0 111.767 177.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.0 tt -56.78 -42.07 78.78 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 121.754 -0.591 . . . . 0.0 110.4 178.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 m -66.8 -50.39 62.8 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.4 m -63.52 -33.41 75.53 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.914 1.285 . . . . 0.0 109.616 -173.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.46 -26.75 21.57 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.517 1.527 . . . . 0.0 110.502 177.324 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.0 m -53.63 -36.92 62.56 Favored 'General case' 0 C--O 1.225 -0.198 0 O-C-N 121.025 -1.047 . . . . 0.0 112.961 175.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 mt -111.99 22.61 14.67 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.125 0.57 . . . . 0.0 109.929 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 58.47 26.33 59.33 Favored Glycine 0 CA--C 1.526 0.773 0 CA-C-O 122.04 0.8 . . . . 0.0 113.084 -179.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.4 mt -92.95 156.65 16.78 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 122.064 0.935 . . . . 0.0 108.766 178.261 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 tt -98.7 95.89 7.55 Favored 'General case' 0 N--CA 1.441 -0.921 0 C-N-CA 129.346 3.058 . . . . 0.0 106.514 -170.282 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.42 131.19 29.53 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.522 -0.847 . . . . 0.0 111.909 -177.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.44 ' NZ ' ' OE1' ' A' ' 27' ' ' GLU . 13.0 pttp -135.51 134.95 40.03 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 159.49 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 57.2 m -74.93 114.64 13.63 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 174.344 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.4 mt -83.44 162.57 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 N-CA-C 105.26 -2.126 . . . . 0.0 105.26 166.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -34.85 -57.3 0.79 Allowed Glycine 0 CA--C 1.525 0.674 0 C-N-CA 125.27 1.414 . . . . 0.0 112.987 -166.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.46 -43.21 19.19 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 127.837 2.455 . . . . 0.0 109.82 -172.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.22 164.35 38.92 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -160.233 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.6 t -64.96 133.14 51.11 Favored 'General case' 0 C--N 1.333 -0.114 0 C-N-CA 124.008 0.923 . . . . 0.0 110.225 174.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.44 ' OE1' ' NZ ' ' A' ' 20' ' ' LYS . 5.1 tm-20 -118.38 170.94 8.5 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 106.472 -1.677 . . . . 0.0 106.472 161.852 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 94.9 m -146.12 82.81 1.61 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 -168.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -72.69 150.47 8.3 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 -176.441 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.6 ttpt -81.3 150.35 28.54 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 118.895 -1.122 . . . . 0.0 111.854 -164.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 68.48 66.82 0.32 Allowed 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 125.271 1.428 . . . . 0.0 109.34 -177.255 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.363 1.175 0 O-C-N 124.464 1.103 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.537 0 N-CA-C 104.79 -2.3 . . . . 0.0 104.79 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -143.93 -48.52 0.28 Allowed 'General case' 0 C--N 1.333 -0.142 0 O-C-N 124.551 1.157 . . . . 0.0 109.828 -155.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.0 t -63.15 122.52 16.31 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 120.343 -0.543 . . . . 0.0 109.68 177.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 64.9 t-20 -74.87 76.08 2.14 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.154 0.582 . . . . 0.0 109.652 -176.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 32.7 tp -44.48 -45.19 9.05 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.485 1.114 . . . . 0.0 111.648 -179.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 69.2 ttp85 -56.79 -49.68 74.6 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 122.352 0.261 . . . . 0.0 111.338 -177.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -69.21 -49.31 57.6 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.7 t -46.23 -51.04 15.09 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 124.244 1.017 . . . . 0.0 110.595 -175.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -55.05 -45.02 75.22 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.77 -179.634 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 32.0 tp -70.11 -47.3 62.4 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.141 0.576 . . . . 0.0 109.79 -174.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 p -64.18 -45.82 86.71 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 -176.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.0 m -64.34 -40.31 95.63 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.2 ttp-105 -62.54 -41.75 99.08 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -178.219 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.5 m -57.32 -35.04 69.36 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.188 0.449 . . . . 0.0 111.422 175.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.6 mt -85.08 5.18 30.75 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.598 0.759 . . . . 0.0 111.669 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 61.54 47.17 92.17 Favored Glycine 0 C--N 1.334 0.461 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 23.5 mt -131.46 148.88 52.68 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 126.507 1.923 . . . . 0.0 108.582 175.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.8 tp -82.16 107.13 14.62 Favored 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 171.134 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.03 129.71 29.63 Favored Glycine 0 N--CA 1.451 -0.307 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 178.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.17 131.32 40.28 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 176.222 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 m -80.27 133.28 35.97 Favored 'General case' 0 CA--C 1.515 -0.373 0 O-C-N 121.084 -1.01 . . . . 0.0 109.734 177.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.9 mm -84.34 160.44 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.683 0 N-CA-C 104.324 -2.473 . . . . 0.0 104.324 149.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.21 -47.78 41.43 Favored Glycine 0 CA--C 1.528 0.862 0 O-C-N 121.449 -0.782 . . . . 0.0 112.355 -171.488 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.93 -44.65 47.44 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 127.034 2.134 . . . . 0.0 107.765 -172.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -155.01 152.99 30.31 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-O 121.529 0.68 . . . . 0.0 110.883 -151.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.9 t -70.93 140.78 51.07 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 124.348 1.059 . . . . 0.0 111.182 -178.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -128.23 171.97 11.47 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 106.53 -1.655 . . . . 0.0 106.53 163.327 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 86.4 m -146.08 102.38 3.62 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 -170.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.2 m -89.03 166.81 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 172.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm -77.88 162.33 26.92 Favored 'General case' 0 N--CA 1.44 -0.963 0 O-C-N 120.752 -1.218 . . . . 0.0 108.941 172.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 22.4 m170 -61.42 89.09 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.247 0.619 . . . . 0.0 109.343 -176.444 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 1.004 0 O-C-N 124.413 1.071 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.851 0 CA-C-O 116.472 -1.728 . . . . 0.0 108.388 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -137.34 136.15 37.68 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 120.331 1.423 . . . . 0.0 107.695 -175.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.4 t -127.86 127.77 44.03 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 118.489 0.586 . . . . 0.0 110.663 -157.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 62.7 t-20 -74.72 85.5 2.15 Favored 'General case' 0 N--CA 1.463 0.203 0 O-C-N 121.631 -0.668 . . . . 0.0 109.416 179.029 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.9 tp -48.11 -43.77 31.25 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.702 0.801 . . . . 0.0 111.969 176.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -66.12 -45.78 79.88 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.859 -0.526 . . . . 0.0 110.297 -172.124 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -60.13 -49.16 78.74 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 175.446 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.1 t -51.0 -54.43 24.61 Favored 'General case' 0 CA--C 1.523 -0.077 0 CA-C-O 121.309 0.576 . . . . 0.0 110.787 -176.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -53.83 -47.29 71.08 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 124.45 1.1 . . . . 0.0 110.801 176.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 41.9 tp -60.74 -42.75 97.99 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 119.178 -0.439 . . . . 0.0 111.61 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.91 -51.0 52.87 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 119.1 0.864 . . . . 0.0 109.611 179.079 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.1 m -63.58 -31.8 73.08 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 124.101 0.96 . . . . 0.0 109.018 -171.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -49.25 -29.89 6.41 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.356 -0.831 . . . . 0.0 111.942 172.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 80.1 p -52.68 -40.71 63.16 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 120.175 1.352 . . . . 0.0 111.483 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.4 mt -104.5 21.35 16.9 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.826 0.85 . . . . 0.0 109.953 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.2 33.71 86.82 Favored Glycine 0 C--N 1.335 0.509 0 CA-C-O 122.209 0.894 . . . . 0.0 111.882 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.9 mt -102.39 132.34 48.46 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-O 121.866 0.841 . . . . 0.0 109.373 -178.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.3 tp -68.01 94.61 0.5 Allowed 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 125.668 1.587 . . . . 0.0 106.955 170.379 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.47 123.7 29.84 Favored Glycine 0 N--CA 1.448 -0.535 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 170.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.2 143.62 46.5 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 106.789 -1.56 . . . . 0.0 106.789 173.35 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 t -129.29 96.36 4.28 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 -145.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.4 mt -83.06 159.87 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 N-CA-C 104.109 -2.552 . . . . 0.0 104.109 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -46.31 -49.9 14.1 Favored Glycine 0 CA--C 1.53 0.972 0 CA-C-O 122.504 1.058 . . . . 0.0 113.45 -162.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.47 -24.24 24.19 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 130.814 3.646 . . . . 0.0 115.241 -177.115 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.5 mmtm -138.91 118.16 12.71 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.049 0.94 . . . . 0.0 112.402 -170.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.2 t -64.29 124.46 21.79 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 155.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -117.67 172.05 7.62 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 105.832 -1.914 . . . . 0.0 105.832 171.511 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.0 m -142.56 98.75 3.36 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.751 1.62 . . . . 0.0 107.655 -172.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -83.04 173.26 0.96 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 172.288 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.7 ttmp? -79.75 140.2 37.01 Favored 'General case' 0 N--CA 1.444 -0.762 0 O-C-N 119.975 -1.703 . . . . 0.0 109.913 170.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -48.43 -39.56 23.15 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.542 0.61 . . . . 0.0 111.018 169.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 1.002 0 O-C-N 122.736 0.023 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.25 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 62.52 31.03 17.18 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 119.364 0.984 . . . . 0.0 113.35 173.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.1 t -64.97 133.77 52.45 Favored 'General case' 0 C--O 1.234 0.24 0 O-C-N 121.936 -0.478 . . . . 0.0 109.747 176.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 63.8 t-20 -74.64 83.69 2.07 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 122.112 0.958 . . . . 0.0 108.891 178.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 24.2 tp -56.44 -34.89 67.27 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.642 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.71 -48.79 79.14 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.875 0.761 . . . . 0.0 110.739 177.818 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -58.38 -49.28 77.82 Favored 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 109.047 -0.724 . . . . 0.0 109.047 177.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.6 t -51.52 -52.75 44.31 Favored 'General case' 0 C--O 1.227 -0.116 0 CA-C-O 121.022 0.439 . . . . 0.0 110.542 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -52.37 -48.46 65.58 Favored 'General case' 0 N--CA 1.444 -0.759 0 C-N-CA 123.129 0.572 . . . . 0.0 111.481 175.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.0 tp -63.1 -49.6 73.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.436 0.562 . . . . 0.0 111.197 -176.298 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.1 m -64.71 -42.37 95.31 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 121.376 -0.828 . . . . 0.0 109.695 -177.307 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 87.2 m -63.9 -42.85 97.34 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.3 ttt85 -54.86 -46.91 74.76 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.0 m -58.24 -35.18 71.32 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 117.949 0.34 . . . . 0.0 111.05 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.5 mt -84.92 1.73 45.98 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.543 0.737 . . . . 0.0 111.851 176.479 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.97 47.7 64.31 Favored Glycine 0 C--N 1.334 0.422 0 O-C-N 120.71 -1.244 . . . . 0.0 110.148 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.9 mt -136.49 177.69 7.65 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 128.13 2.572 . . . . 0.0 107.48 176.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -125.13 110.76 14.5 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 126.29 1.836 . . . . 0.0 106.914 -175.436 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -73.46 123.59 8.38 Favored Glycine 0 N--CA 1.449 -0.491 0 CA-C-O 119.451 -0.639 . . . . 0.0 112.445 -173.073 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.4 ' NZ ' ' OE1' ' A' ' 27' ' ' GLU . 1.9 pptp? -134.99 133.48 39.5 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 106.006 -1.85 . . . . 0.0 106.006 167.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 30.2 t -103.78 136.84 42.71 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -165.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 23.2 mt -97.85 163.33 2.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 125.68 1.592 . . . . 0.0 107.274 176.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -12.55 -70.55 0.01 OUTLIER Glycine 0 CA--C 1.532 1.141 0 C-N-CA 127.839 2.638 . . . . 0.0 116.352 -176.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.92 -47.9 9.22 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 126.639 1.976 . . . . 0.0 108.927 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -136.93 149.39 47.55 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.969 0.89 . . . . 0.0 113.159 -146.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.5 t -64.87 139.59 58.78 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.161 1.784 . . . . 0.0 111.307 -178.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.4 ' OE1' ' NZ ' ' A' ' 20' ' ' LYS . 4.0 tm-20 -122.95 172.76 8.25 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 105.241 -2.133 . . . . 0.0 105.241 160.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 94.4 m -145.87 83.69 1.65 Allowed 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 -164.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 31.4 m -72.28 157.17 6.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -177.593 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 43.9 tptt -85.09 67.11 10.07 Favored 'General case' 0 N--CA 1.437 -1.082 0 O-C-N 121.35 -0.844 . . . . 0.0 112.368 -167.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 26.13 49.44 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.873 2.469 . . . . 0.0 114.696 157.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 0.941 0 O-C-N 123.874 0.734 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.565 0 N-CA-C 103.629 -2.73 . . . . 0.0 103.629 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 37.7 p90 44.87 -178.43 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.703 0 O-C-N 125.888 1.992 . . . . 0.0 111.2 -131.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.6 t -66.17 114.82 5.57 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 123.478 0.711 . . . . 0.0 111.106 -178.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -74.58 98.98 3.5 Favored 'General case' 0 C--N 1.333 -0.111 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 170.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.8 tp -50.48 -37.05 36.59 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.965 0.906 . . . . 0.0 112.333 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.38 -52.08 44.31 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 121.358 -0.839 . . . . 0.0 110.506 -176.062 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -61.61 -42.98 99.64 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.2 t -50.76 -57.44 8.34 Favored 'General case' 0 CA--C 1.523 -0.083 0 CA-C-O 121.487 0.66 . . . . 0.0 109.226 177.044 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -60.99 -37.33 82.1 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 122.827 0.451 . . . . 0.0 111.93 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 31.2 tp -60.93 -43.03 99.19 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.095 0.861 . . . . 0.0 110.468 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.5 m -67.1 -44.78 79.09 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.8 m -63.77 -41.24 98.0 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -177.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.81 -30.93 4.4 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 125.315 1.446 . . . . 0.0 111.164 172.147 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.0 t -51.69 -44.3 63.07 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.696 1.135 . . . . 0.0 109.825 -177.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 57.5 mt -108.69 25.22 11.99 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.97 0.908 . . . . 0.0 110.266 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 61.01 27.16 66.7 Favored Glycine 0 CA--C 1.526 0.753 0 CA-C-O 121.858 0.699 . . . . 0.0 113.386 177.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.8 mt -91.64 172.24 8.63 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 123.897 0.879 . . . . 0.0 109.391 177.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.1 tt -126.2 97.64 5.16 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 127.292 2.237 . . . . 0.0 106.269 -161.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.32 125.06 11.56 Favored Glycine 0 CA--C 1.526 0.763 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.581 -168.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.5 mtpm? -124.73 120.0 30.53 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 126.134 1.774 . . . . 0.0 107.925 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.0 m -74.78 130.53 39.64 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.087 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 6.2 mt -111.73 66.42 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 125.391 1.476 . . . . 0.0 107.54 169.015 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.99 -88.8 0.48 Allowed Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 126.429 1.966 . . . . 0.0 110.319 173.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.74 -45.25 21.58 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 176.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.9 mttp -88.99 157.09 18.5 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.25 0.62 . . . . 0.0 109.714 -162.105 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.7 t -101.81 123.82 46.41 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 164.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -104.88 170.2 8.01 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 167.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 92.2 m -149.57 85.12 1.43 Allowed 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.943 1.697 . . . . 0.0 110.253 -169.245 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.6 m -76.23 166.09 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 O-C-N 120.69 -1.256 . . . . 0.0 110.294 177.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.4 mtmt -79.49 160.65 26.47 Favored 'General case' 0 N--CA 1.439 -0.979 0 O-C-N 121.145 -0.972 . . . . 0.0 111.797 -174.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 64.9 t-80 58.41 61.8 2.16 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.884 1.274 . . . . 0.0 109.405 -178.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.083 0 O-C-N 124.167 0.917 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.177 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -75.23 71.81 2.27 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 119.605 1.093 . . . . 0.0 110.084 -178.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 40.9 t -64.89 127.75 32.9 Favored 'General case' 0 C--N 1.333 -0.126 0 O-C-N 121.928 -0.482 . . . . 0.0 110.372 178.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -74.66 86.18 2.14 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 176.175 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.2 tp -53.87 -37.4 63.67 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.676 0.79 . . . . 0.0 111.601 176.157 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.62 -49.19 78.73 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.722 0.692 . . . . 0.0 109.917 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -59.21 -52.35 66.08 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 178.11 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.7 t -51.95 -50.06 61.94 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 122.023 0.916 . . . . 0.0 110.852 -176.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -54.42 -46.87 73.28 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.395 176.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.92 -49.76 71.38 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.084 0.554 . . . . 0.0 111.493 -177.457 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.6 p -64.55 -42.27 95.79 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.44 -0.787 . . . . 0.0 109.222 -176.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.1 m -63.78 -42.97 97.65 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.01 -42.43 94.27 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 -178.07 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.9 m -55.88 -43.51 77.25 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 120.82 -1.175 . . . . 0.0 111.232 175.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.9 mt -72.91 -4.71 33.69 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 122.751 0.42 . . . . 0.0 111.648 175.395 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.02 14.84 82.21 Favored Glycine 0 CA--C 1.524 0.625 0 O-C-N 121.184 -0.947 . . . . 0.0 111.866 -178.512 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 24.0 mt -100.76 -179.73 4.16 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 125.884 1.674 . . . . 0.0 107.884 177.628 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -121.62 104.39 9.59 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 -171.007 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -77.15 130.77 10.65 Favored Glycine 0 C--N 1.332 0.351 0 CA-C-O 119.428 -0.651 . . . . 0.0 113.239 -170.38 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.88 130.76 27.8 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 106.474 -1.676 . . . . 0.0 106.474 168.228 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.6 t -99.71 124.96 45.47 Favored 'General case' 0 CA--C 1.518 -0.271 0 O-C-N 121.933 -0.479 . . . . 0.0 111.125 -174.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.6 mt -84.85 161.98 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 172.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -45.57 -36.23 6.03 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.444 1.021 . . . . 0.0 114.195 -177.024 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -57.83 3.67 Favored 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 127.933 2.493 . . . . 0.0 107.872 -179.363 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.65 155.9 30.85 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -152.74 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.5 t -66.59 133.03 49.47 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 124.15 0.98 . . . . 0.0 110.877 171.387 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.9 172.08 9.67 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 164.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 76.8 m -145.81 89.98 1.95 Allowed 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 126.507 1.923 . . . . 0.0 106.31 -167.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.6 m -70.19 146.81 11.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 174.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.9 ttpp -90.12 68.14 7.07 Favored 'General case' 0 N--CA 1.435 -1.215 0 O-C-N 121.37 -0.832 . . . . 0.0 111.137 -164.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -103.31 48.83 0.84 Allowed 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 161.398 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 0.98 0 O-C-N 124.326 1.016 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.763 0 N-CA-C 105.956 -1.868 . . . . 0.0 105.956 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -65.02 156.95 29.71 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 120.217 1.372 . . . . 0.0 107.667 162.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.0 t -64.69 109.46 2.03 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.108 0.48 . . . . 0.0 110.033 176.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -74.64 99.89 3.79 Favored 'General case' 0 C--N 1.334 -0.088 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 170.663 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 56.0 tp -39.51 -46.91 1.8 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.784 1.634 . . . . 0.0 113.291 174.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.8 ttt85 -64.02 -44.45 92.54 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 119.006 0.821 . . . . 0.0 109.797 -174.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -61.75 -48.25 81.52 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 174.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 54.1 t -53.16 -55.06 27.13 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.834 0.826 . . . . 0.0 109.582 -176.257 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.3 mm-40 -57.24 -46.15 83.27 Favored 'General case' 0 N--CA 1.44 -0.958 0 O-C-N 121.888 -0.508 . . . . 0.0 110.888 178.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 46.6 tp -62.74 -46.45 88.02 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.686 0.675 . . . . 0.0 111.482 -176.448 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.4 p -64.98 -45.13 86.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -178.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 88.4 m -62.95 -42.8 99.93 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -41.53 77.3 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 177.128 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.9 m -68.54 -27.21 65.89 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 177.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 69.1 mt -80.18 -3.85 50.66 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.545 0.612 . . . . 0.0 111.534 167.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 75.32 29.13 60.61 Favored Glycine 0 C--N 1.337 0.591 0 CA-C-N 119.299 0.954 . . . . 0.0 111.444 -177.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 30.8 mt -123.55 -176.44 3.45 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.847 2.059 . . . . 0.0 108.17 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.9 tp -135.45 113.95 11.65 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 126.193 1.797 . . . . 0.0 107.992 -166.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.14 144.76 45.22 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 121.441 -0.409 . . . . 0.0 112.997 -165.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -127.99 87.11 2.56 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 128.16 2.584 . . . . 0.0 105.375 171.099 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -78.28 98.11 5.8 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 123.602 0.761 . . . . 0.0 110.728 -176.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.4 mt -87.96 161.34 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 N-CA-C 106.703 -1.592 . . . . 0.0 106.703 164.561 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.36 -53.53 23.8 Favored Glycine 0 CA--C 1.523 0.544 0 O-C-N 121.989 -0.444 . . . . 0.0 113.293 -166.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.4 -26.13 26.61 Favored 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 124.859 1.263 . . . . 0.0 110.435 179.702 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -129.02 110.47 12.08 Favored 'General case' 0 C--O 1.226 -0.14 0 C-N-CA 123.368 0.667 . . . . 0.0 110.162 -156.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 31.6 t -76.42 117.67 18.32 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 164.307 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -103.49 170.95 7.64 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 171.273 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.8 m -148.48 84.67 1.49 Allowed 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.669 1.588 . . . . 0.0 109.165 -171.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.7 m -70.7 154.84 7.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 118.941 -1.104 . . . . 0.0 109.306 178.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -82.84 75.22 9.75 Favored 'General case' 0 N--CA 1.436 -1.134 0 O-C-N 121.368 -0.832 . . . . 0.0 109.671 -178.609 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 23.8 t-80 48.76 -106.93 0.2 Allowed 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.729 1.612 . . . . 0.0 110.093 -177.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 0.965 0 O-C-N 123.605 0.566 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.875 0 CA-C-O 116.033 -1.937 . . . . 0.0 105.997 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 50.6 t80 61.78 -71.78 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 120.091 1.314 . . . . 0.0 107.615 -153.293 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.3 t -62.62 107.45 0.95 Allowed 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 164.059 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 32.9 t-20 -96.15 129.22 43.51 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 103.415 -2.809 . . . . 0.0 103.415 145.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.0 tp -51.68 -39.46 58.29 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 118.535 0.607 . . . . 0.0 110.305 177.046 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -61.25 -38.54 87.04 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-O 118.584 -0.722 . . . . 0.0 112.143 176.284 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 58.5 ttp -63.94 -49.96 70.56 Favored 'General case' 0 CA--C 1.528 0.101 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.1 t -52.95 -54.75 30.38 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-O 121.289 0.566 . . . . 0.0 110.07 179.026 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -61.84 -35.9 79.63 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-O 118.554 -0.736 . . . . 0.0 112.519 -179.537 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.6 tt -63.82 -43.84 95.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 119.605 1.093 . . . . 0.0 109.535 176.106 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.3 t -64.37 -48.76 74.26 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 -178.1 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.8 m -63.42 -42.52 98.71 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 -177.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -39.1 68.02 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 124.253 1.021 . . . . 0.0 108.644 176.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.4 m -68.93 -25.12 64.42 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.637 -0.665 . . . . 0.0 112.66 177.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.7 mt -89.02 -0.02 57.07 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.682 0.793 . . . . 0.0 111.743 168.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.84 35.06 65.78 Favored Glycine 0 CA--C 1.525 0.682 0 O-C-N 121.24 -0.912 . . . . 0.0 112.646 -177.364 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 35.3 mt -129.1 172.82 11.03 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 126.496 1.918 . . . . 0.0 109.72 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.0 tp -116.44 110.93 19.29 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 126.574 1.95 . . . . 0.0 109.228 -171.257 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -74.48 132.06 13.98 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 114.336 0.494 . . . . 0.0 114.336 -169.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? -124.38 108.99 12.76 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 126.448 1.899 . . . . 0.0 107.429 171.095 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.5 t -76.01 112.5 12.5 Favored 'General case' 0 C--N 1.332 -0.152 0 O-C-N 122.038 -0.414 . . . . 0.0 111.242 -178.341 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.2 mm -88.46 65.92 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 C-N-CA 125.565 1.546 . . . . 0.0 107.676 177.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.62 -88.12 0.17 Allowed Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 125.829 1.68 . . . . 0.0 110.791 175.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.29 -42.98 34.82 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 106.352 -1.722 . . . . 0.0 106.352 178.565 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -102.38 162.93 12.53 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.507 1.123 . . . . 0.0 108.799 -159.041 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.2 t -112.02 122.36 47.56 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 175.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -104.58 169.84 8.23 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 106.19 -1.781 . . . . 0.0 106.19 167.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 90.2 m -149.11 85.18 1.46 Allowed 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.867 1.667 . . . . 0.0 110.167 -167.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.2 m -76.43 148.61 6.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 O-C-N 120.876 -1.14 . . . . 0.0 110.601 -178.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -92.04 61.88 4.11 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -61.57 -28.72 69.54 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 119.378 -0.344 . . . . 0.0 110.773 -175.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 0.967 0 O-C-N 123.612 0.57 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 116.506 -1.711 . . . . 0.0 106.655 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 54.92 47.76 21.5 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 119.294 0.952 . . . . 0.0 111.099 171.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.3 t -66.52 117.03 8.14 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.278 -0.419 . . . . 0.0 109.901 -179.264 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -99.3 104.08 15.96 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 169.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 49.5 tp -39.54 -46.26 1.71 Allowed 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 125.691 1.596 . . . . 0.0 113.453 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.72 -52.5 59.91 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.492 0.717 . . . . 0.0 111.815 178.161 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -63.31 -47.36 82.58 Favored 'General case' 0 N--CA 1.457 -0.079 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 178.439 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 34.8 t -49.78 -56.51 10.05 Favored 'General case' 0 C--O 1.224 -0.287 0 O-C-N 123.856 0.722 . . . . 0.0 109.713 -178.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -57.01 -45.09 83.31 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 124.346 1.059 . . . . 0.0 112.468 -179.174 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.3 tt -60.65 -44.75 96.04 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.582 0.706 . . . . 0.0 109.972 179.456 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.7 m -64.52 -45.6 86.5 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 97.7 m -63.15 -41.41 99.26 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 -176.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.18 -36.62 82.46 Favored 'General case' 0 C--O 1.228 -0.064 0 N-CA-C 106.938 -1.504 . . . . 0.0 106.938 -178.071 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.2 m -70.59 -14.87 62.66 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 177.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.6 mt -98.07 5.13 49.01 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.444 0.698 . . . . 0.0 110.644 168.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.05 21.01 79.28 Favored Glycine 0 CA--C 1.526 0.78 0 O-C-N 120.782 -1.199 . . . . 0.0 112.168 -177.49 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.1 mt -112.33 -177.7 3.23 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.122 1.769 . . . . 0.0 108.365 177.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -140.95 105.78 4.94 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -163.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.17 134.6 25.15 Favored Glycine 0 CA--C 1.528 0.844 0 C-N-CA 121.335 -0.46 . . . . 0.0 113.866 -166.066 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 11.9 mptt -117.21 165.63 13.2 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 127.374 2.27 . . . . 0.0 105.587 161.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 50.8 t -150.37 104.94 3.28 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.244 -0.91 . . . . 0.0 110.515 -169.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.4 mt -87.08 161.36 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 N-CA-C 105.449 -2.056 . . . . 0.0 105.449 162.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -45.32 -49.94 10.3 Favored Glycine 0 CA--C 1.527 0.785 0 CA-C-O 122.236 0.909 . . . . 0.0 114.119 -170.116 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.05 -33.33 22.5 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 124.182 0.993 . . . . 0.0 109.587 -177.204 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 37.3 mttp -119.3 116.21 25.76 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 125.033 1.333 . . . . 0.0 111.258 -157.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 20.3 t -66.51 127.03 30.76 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 155.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -105.54 169.09 8.67 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 105.379 -2.082 . . . . 0.0 105.379 165.091 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 87.9 m -148.7 84.09 1.47 Allowed 'General case' 0 C--O 1.233 0.212 0 C-N-CA 124.904 1.282 . . . . 0.0 109.335 -177.408 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -71.41 146.78 11.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 O-C-N 121.175 -0.953 . . . . 0.0 108.905 -177.453 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? -84.71 71.35 10.83 Favored 'General case' 0 N--CA 1.441 -0.876 0 O-C-N 120.854 -1.154 . . . . 0.0 112.606 -160.048 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 46.9 t-80 -152.1 47.07 0.77 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.584 0.754 . . . . 0.0 110.102 178.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 0.981 0 O-C-N 123.493 0.496 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.153 0 CA-C-O 116.37 -1.776 . . . . 0.0 106.247 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -68.61 85.77 0.3 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 120.687 1.585 . . . . 0.0 107.24 164.065 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 18.4 t -67.28 110.97 3.74 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 105.735 -1.95 . . . . 0.0 105.735 168.44 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 51.3 t-20 -74.51 85.5 2.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.739 0.304 . . . . 0.0 110.594 -166.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.5 tp -51.71 -38.27 54.46 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 124.466 1.106 . . . . 0.0 111.494 -178.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 40.8 mtp85 -58.24 -52.3 66.14 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 64.6 ttp -64.3 -49.7 70.76 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 -179.17 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.3 t -49.9 -52.77 30.45 Favored 'General case' 0 C--N 1.334 -0.067 0 C-N-CA 123.008 0.523 . . . . 0.0 110.261 -176.388 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -69.21 -15.52 63.4 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.8 tp -80.54 -52.47 7.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 119.817 1.19 . . . . 0.0 109.36 168.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.1 p -63.91 -41.45 97.67 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.604 -0.685 . . . . 0.0 109.432 -172.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 83.5 m -64.07 -40.23 95.81 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 176.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.7 ttm105 -65.28 -35.64 81.64 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -175.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.2 m -55.82 -33.05 64.09 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.536 0.607 . . . . 0.0 111.562 172.009 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 42.5 mt -90.69 6.76 42.69 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.795 0.838 . . . . 0.0 111.302 177.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.16 19.7 78.69 Favored Glycine 0 CA--C 1.526 0.754 0 O-C-N 121.32 -0.863 . . . . 0.0 113.299 -178.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 37.3 mt -111.75 170.1 8.37 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.743 1.217 . . . . 0.0 109.976 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -115.61 104.16 11.43 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 126.252 1.821 . . . . 0.0 107.89 -170.379 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.59 128.92 38.94 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-N 116.477 -0.329 . . . . 0.0 113.061 -173.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.2 mtpm? -121.11 116.44 24.99 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.549 -1.648 . . . . 0.0 106.549 166.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -94.44 100.67 12.63 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 117.896 0.316 . . . . 0.0 110.148 -169.907 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.2 mt -90.25 162.29 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -171.693 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -39.93 -49.59 3.41 Favored Glycine 0 CA--C 1.525 0.704 0 C-N-CA 125.162 1.363 . . . . 0.0 113.854 -171.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.21 -42.24 14.88 Favored 'General case' 0 N--CA 1.439 -1.003 0 C-N-CA 125.782 1.633 . . . . 0.0 107.518 -171.318 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -156.23 159.86 39.3 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.985 0.914 . . . . 0.0 111.531 -153.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.7 t -79.32 125.19 29.18 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.07 169.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -105.41 170.78 7.68 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 167.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.3 m -148.57 84.89 1.49 Allowed 'General case' 0 C--O 1.232 0.155 0 C-N-CA 125.115 1.366 . . . . 0.0 110.59 -167.398 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.4 m -76.08 144.72 11.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 O-C-N 120.945 -1.097 . . . . 0.0 111.281 -175.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt -89.21 69.66 8.26 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 173.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -50.65 -36.65 36.59 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.781 0.832 . . . . 0.0 112.475 -166.744 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 0.953 0 O-C-N 123.823 0.702 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.421 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -125.9 84.48 2.28 Favored 'General case' 0 N--CA 1.457 -0.083 0 C-N-CA 124.065 0.946 . . . . 0.0 108.57 -176.167 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 41.9 t -64.65 126.52 28.17 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 123.426 0.691 . . . . 0.0 112.377 -172.896 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 55.3 t-20 -74.34 83.12 1.91 Allowed 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 167.106 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 49.3 tp -51.51 -36.8 46.23 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.935 0.894 . . . . 0.0 111.034 178.604 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.74 -52.38 65.75 Favored 'General case' 0 N--CA 1.458 -0.073 0 CA-C-N 118.776 0.717 . . . . 0.0 110.222 179.36 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 15.5 tmm? -64.32 -46.16 84.72 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -178.405 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 11.4 t -49.79 -57.64 6.95 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 177.565 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -58.79 -40.99 85.64 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 118.522 -0.751 . . . . 0.0 112.078 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.9 tt -60.64 -43.66 97.31 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.605 1.093 . . . . 0.0 110.015 178.149 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.1 t -64.07 -46.48 84.15 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 -178.242 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.8 m -63.23 -45.86 89.66 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -176.755 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -38.97 67.51 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 125.339 1.456 . . . . 0.0 108.817 177.702 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.1 m -67.51 -19.02 65.26 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 178.951 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.8 mt -101.13 9.21 42.25 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.837 0.855 . . . . 0.0 111.039 169.538 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.28 23.11 77.59 Favored Glycine 0 CA--C 1.526 0.756 0 O-C-N 120.878 -1.139 . . . . 0.0 112.779 -179.476 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.7 mt -109.11 175.46 5.45 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 125.562 1.545 . . . . 0.0 108.868 178.302 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.7 tt -126.82 102.86 7.22 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.983 1.713 . . . . 0.0 107.057 -167.917 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.84 120.19 20.42 Favored Glycine 0 CA--C 1.529 0.951 0 O-C-N 122.104 -0.373 . . . . 0.0 112.499 -174.811 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.4 tptt -122.17 106.29 11.02 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 104.521 -2.4 . . . . 0.0 104.521 174.973 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 5.1 t -110.76 124.87 52.82 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.704 0.684 . . . . 0.0 111.534 -170.213 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 22.2 mt -91.34 162.67 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 105.874 -1.899 . . . . 0.0 105.874 168.162 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -5.8 -81.04 0.01 OUTLIER Glycine 0 CA--C 1.532 1.135 0 C-N-CA 127.209 2.337 . . . . 0.0 115.441 -175.043 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.54 -38.78 16.87 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 128.496 2.718 . . . . 0.0 113.919 167.153 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -85.38 100.53 11.9 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.879 1.271 . . . . 0.0 110.433 -156.941 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.4 t -66.64 119.05 11.09 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.048 0.939 . . . . 0.0 110.513 166.018 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.62 171.52 7.32 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 104.802 -2.296 . . . . 0.0 104.802 161.503 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 94.0 m -145.95 83.2 1.63 Allowed 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.234 -2.135 . . . . 0.0 105.234 -177.694 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.3 m -73.53 144.24 12.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 C-N-CA 119.33 -0.948 . . . . 0.0 108.949 -177.455 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.6 ttpp -95.94 123.45 39.54 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-O 118.202 -0.904 . . . . 0.0 111.568 -159.755 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -79.56 -122.13 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.707 0.685 . . . . 0.0 109.454 165.775 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 0.962 0 O-C-N 123.463 0.477 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.816 0 N-CA-C 104.604 -2.369 . . . . 0.0 104.604 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 27.7 t80 59.68 -80.17 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -148.698 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.3 t -63.5 128.11 34.35 Favored 'General case' 0 C--O 1.24 0.593 0 O-C-N 121.655 -0.653 . . . . 0.0 109.443 177.589 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -93.74 89.98 6.39 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.186 1.394 . . . . 0.0 108.227 -174.472 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 28.1 tp -53.61 -33.81 56.26 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.396 1.078 . . . . 0.0 111.817 179.434 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.73 -46.68 68.27 Favored 'General case' 0 N--CA 1.453 -0.277 0 O-C-N 121.393 -0.817 . . . . 0.0 110.27 -176.76 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 13.3 tmm? -69.1 -44.61 72.12 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 176.694 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 23.3 t -50.7 -55.43 16.59 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 123.889 0.876 . . . . 0.0 110.08 -177.839 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -55.51 -39.42 70.48 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 178.97 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 39.8 tp -67.06 -44.83 79.1 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.972 -0.455 . . . . 0.0 110.618 -179.575 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.1 t -63.65 -44.97 92.27 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 -179.206 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 88.6 m -62.82 -43.65 98.25 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 -177.47 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.8 tpt85 -57.99 -44.49 87.19 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 177.722 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -55.86 -44.51 78.12 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 118.01 0.368 . . . . 0.0 110.039 177.732 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.8 mt -74.95 -3.33 31.57 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.284 0.634 . . . . 0.0 111.6 178.563 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.11 40.19 43.1 Favored Glycine 0 C--N 1.333 0.415 0 CA-C-O 122.313 0.952 . . . . 0.0 110.775 179.292 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 16.8 mt -131.37 -174.26 3.35 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 127.987 2.515 . . . . 0.0 107.303 177.363 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 47.9 tp -145.82 117.18 7.95 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 125.945 1.698 . . . . 0.0 107.517 -168.103 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.68 162.97 49.47 Favored Glycine 0 CA--C 1.533 1.186 0 N-CA-C 115.535 0.974 . . . . 0.0 115.535 -161.829 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -145.04 166.64 24.76 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 127.91 2.484 . . . . 0.0 106.902 157.802 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -121.54 120.35 34.6 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 121.465 -0.772 . . . . 0.0 109.524 177.681 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 56.7 mt -84.49 163.33 2.82 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 156.961 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -39.87 -59.01 2.14 Favored Glycine 0 CA--C 1.529 0.919 0 C-N-CA 124.468 1.033 . . . . 0.0 114.013 -171.556 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.83 -33.59 45.89 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.449 1.5 . . . . 0.0 108.596 -177.261 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.4 ttpm? -140.77 124.15 16.75 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.724 0.297 . . . . 0.0 111.011 -130.717 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.5 t -65.03 134.01 52.91 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.173 0.989 . . . . 0.0 110.5 173.248 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.3 tm-20 -106.31 166.5 10.48 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 105.544 -2.021 . . . . 0.0 105.544 164.314 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 84.2 m -149.74 84.97 1.41 Allowed 'General case' 0 C--O 1.235 0.315 0 C-N-CA 125.474 1.51 . . . . 0.0 110.598 -178.691 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.0 m -71.13 157.46 6.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 178.541 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.76 -44.62 85.32 Favored 'General case' 0 N--CA 1.441 -0.884 0 O-C-N 120.592 -1.318 . . . . 0.0 109.837 174.53 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -155.67 -22.81 0.11 Allowed 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 160.079 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.078 0 CA-C-N 116.043 -0.526 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.552 0 CA-C-O 116.001 -1.952 . . . . 0.0 107.648 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -168.73 32.87 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.871 1.214 . . . . 0.0 112.048 176.528 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.1 t -68.83 115.46 8.18 Favored 'General case' 0 C--N 1.331 -0.199 0 O-C-N 120.956 -1.09 . . . . 0.0 110.063 177.311 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -74.12 95.74 2.61 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 174.851 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.8 tp -50.46 -36.71 34.72 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 124.659 1.184 . . . . 0.0 112.352 177.718 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.17 -48.85 69.38 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 121.209 -0.932 . . . . 0.0 109.238 -177.906 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 12.2 tmm? -55.11 -48.25 73.87 Favored 'General case' 0 C--N 1.335 -0.049 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 174.281 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.8 t -56.73 -58.34 8.5 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.271 0.557 . . . . 0.0 110.518 -175.793 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -49.77 -45.76 49.96 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 125.08 1.352 . . . . 0.0 110.822 175.728 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.4 tp -63.46 -42.4 98.62 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 121.627 -0.671 . . . . 0.0 110.989 -177.576 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -64.62 -51.99 59.79 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 178.43 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.8 m -64.13 -34.36 77.89 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 123.944 0.898 . . . . 0.0 110.147 -170.713 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -47.04 -37.96 10.2 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 123.592 0.757 . . . . 0.0 111.216 170.402 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.3 t -56.2 -34.6 66.42 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.671 0.669 . . . . 0.0 110.742 -176.467 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 68.7 mt -104.34 15.18 28.79 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.675 0.79 . . . . 0.0 110.647 177.58 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 59.77 19.98 51.16 Favored Glycine 0 CA--C 1.523 0.555 0 C-N-CA 124.135 0.874 . . . . 0.0 113.342 -177.757 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 45.9 mt -89.41 171.2 9.91 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 178.375 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -113.41 106.76 14.96 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 105.84 -1.911 . . . . 0.0 105.84 -169.61 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.15 108.53 2.21 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-O 119.399 -0.667 . . . . 0.0 111.755 -174.008 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.22 121.42 41.02 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 172.187 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.1 m -75.26 125.07 28.21 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 168.726 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.7 mt -82.44 160.75 3.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 104.333 -2.469 . . . . 0.0 104.333 146.009 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.49 -46.86 45.52 Favored Glycine 0 CA--C 1.528 0.864 0 O-C-N 121.568 -0.708 . . . . 0.0 113.299 -161.909 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.56 -36.49 18.87 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.89 2.476 . . . . 0.0 111.369 178.812 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -135.21 138.3 43.48 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-O 121.549 0.69 . . . . 0.0 112.107 -153.744 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.8 t -68.7 129.64 40.52 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 118.495 -0.764 . . . . 0.0 111.108 171.642 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -115.95 173.63 6.46 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 105.636 -1.987 . . . . 0.0 105.636 156.073 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -137.0 84.98 2.1 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 125.769 1.628 . . . . 0.0 107.833 -171.327 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.0 m -68.82 151.01 10.44 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.493 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -178.832 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.5 tttp -87.43 84.1 7.22 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 121.37 -0.831 . . . . 0.0 110.628 -165.76 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 75.21 -65.62 0.33 Allowed 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.724 1.61 . . . . 0.0 109.675 170.483 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.102 0 O-C-N 124.431 1.082 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.941 0 CA-C-O 116.575 -1.679 . . . . 0.0 106.978 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -75.09 68.33 1.87 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 120.401 1.455 . . . . 0.0 109.135 174.598 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.0 t -79.61 73.49 6.3 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.572 0.701 . . . . 0.0 109.207 179.333 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 59.3 t-20 -74.51 85.68 2.05 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 121.837 -0.54 . . . . 0.0 110.392 -168.742 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 40.2 tp -53.64 -33.81 56.45 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.172 0.989 . . . . 0.0 111.921 -179.608 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.28 -57.77 8.46 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.425 -0.797 . . . . 0.0 110.554 178.693 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -61.88 -42.9 99.62 Favored 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 -178.337 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 38.8 t -48.63 -60.83 2.39 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.045 0.938 . . . . 0.0 108.854 178.832 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -60.72 -34.99 75.22 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -177.425 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.6 tt -63.52 -43.0 98.44 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.42 1.009 . . . . 0.0 110.677 175.237 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.5 t -64.37 -45.68 86.67 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.497 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 63.2 m -63.61 -41.51 98.29 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 -176.642 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.79 -50.18 69.12 Favored 'General case' 0 C--N 1.339 0.11 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 173.486 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.9 m -58.7 -33.35 70.08 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 179.354 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.8 mt -87.22 -4.56 59.1 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.315 0.646 . . . . 0.0 112.177 178.11 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.87 52.52 32.79 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 110.16 -1.176 . . . . 0.0 110.16 -176.921 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 28.2 mt -142.39 174.46 10.61 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 129.895 3.278 . . . . 0.0 107.82 177.552 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.5 tt -130.0 113.92 15.17 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 127.893 2.477 . . . . 0.0 106.715 -172.111 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -77.71 138.09 21.07 Favored Glycine 0 CA--C 1.53 0.984 0 N-CA-C 114.597 0.599 . . . . 0.0 114.597 -168.608 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -117.47 167.49 11.24 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 127.231 2.212 . . . . 0.0 107.868 167.765 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.2 t -112.58 130.8 55.9 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.656 0.782 . . . . 0.0 110.597 173.797 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.5 mt -111.13 163.62 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 C-N-CA 126.914 2.086 . . . . 0.0 106.996 168.111 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -27.07 -63.27 0.08 OUTLIER Glycine 0 CA--C 1.535 1.321 0 C-N-CA 126.228 1.871 . . . . 0.0 116.481 -175.513 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.19 -34.18 22.11 Favored 'General case' 0 N--CA 1.443 -0.776 0 O-C-N 121.063 -1.257 . . . . 0.0 109.345 -178.064 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -147.98 152.59 37.74 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.124 0.57 . . . . 0.0 112.512 -129.357 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.0 t -65.06 144.48 57.23 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.661 1.584 . . . . 0.0 111.504 173.009 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.425 ' CD ' HG13 ' A' ' 29' ' ' VAL . 9.3 tm-20 -114.93 168.71 9.66 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 157.048 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 98.6 m -147.01 84.35 1.59 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 126.081 1.752 . . . . 0.0 110.648 178.497 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.425 HG13 ' CD ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -82.79 158.32 3.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 -174.718 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.1 tptt -61.97 -45.31 94.21 Favored 'General case' 0 N--CA 1.44 -0.935 0 O-C-N 120.815 -1.178 . . . . 0.0 109.876 165.065 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -137.04 -54.83 0.71 Allowed 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 177.975 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.36 1.056 0 CA-C-N 114.553 -1.203 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.85 0 N-CA-C 104.493 -2.41 . . . . 0.0 104.493 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -58.74 -55.14 38.9 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 150.449 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.1 t -64.01 127.99 33.85 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.236 -177.4 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -91.46 112.34 24.22 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 126.256 1.822 . . . . 0.0 108.277 176.029 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 30.6 tp -48.47 -44.73 35.95 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 123.166 0.586 . . . . 0.0 112.291 179.547 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -64.25 -37.34 87.14 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 120.139 -0.624 . . . . 0.0 111.033 -172.452 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.3 tmm? -60.86 -51.06 70.91 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 174.775 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.0 t -57.47 -56.93 15.53 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.88 -175.51 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -45.79 -50.62 13.83 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 126.031 1.732 . . . . 0.0 110.354 171.741 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 31.5 tp -62.49 -30.67 71.44 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 121.768 -0.583 . . . . 0.0 111.518 -177.289 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.3 t -71.73 -56.46 5.75 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 119.004 0.82 . . . . 0.0 109.053 172.014 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.2 m -63.81 -28.36 69.81 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.597 1.559 . . . . 0.0 110.639 -167.442 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.2 ttp85 -41.22 -46.02 3.03 Favored 'General case' 0 C--O 1.226 -0.136 0 C-N-CA 125.927 1.691 . . . . 0.0 110.422 168.333 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.6 m -55.18 -31.12 61.13 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.626 0.648 . . . . 0.0 112.286 -175.431 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.7 mt -106.53 9.48 31.52 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 123.711 0.804 . . . . 0.0 111.074 -178.059 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 56.6 54.57 35.3 Favored Glycine 0 C--N 1.339 0.74 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 -177.575 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 39.0 mt -127.15 140.55 52.18 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 125.393 1.477 . . . . 0.0 108.092 175.576 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.5 tp -72.11 121.42 19.22 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 125.843 1.657 . . . . 0.0 107.043 168.703 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.35 128.76 16.35 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 111.521 -0.631 . . . . 0.0 111.521 -178.645 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -107.91 94.6 5.16 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 126.904 2.082 . . . . 0.0 107.241 177.231 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.1 103.08 4.43 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 172.074 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 22.8 mt -82.74 161.15 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 N-CA-C 104.1 -2.556 . . . . 0.0 104.1 167.402 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -45.46 -47.75 11.88 Favored Glycine 0 CA--C 1.527 0.784 0 O-C-N 122.022 -0.424 . . . . 0.0 112.536 -166.878 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.94 -41.96 20.11 Favored 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 128.202 2.601 . . . . 0.0 109.227 -172.426 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.1 ptpp? -155.87 161.39 40.6 Favored 'General case' 0 C--O 1.227 -0.118 0 CA-C-O 121.246 0.546 . . . . 0.0 112.314 -153.737 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.9 t -88.28 129.89 35.25 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.014 0.926 . . . . 0.0 110.744 179.078 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -117.26 172.43 7.31 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 168.032 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 82.3 m -147.8 100.84 3.26 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.401 1.08 . . . . 0.0 108.78 -169.895 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.8 m -97.22 154.24 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 O-C-N 121.012 -1.055 . . . . 0.0 109.133 176.515 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.5 ttmm -85.79 -43.29 13.45 Favored 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 121.673 -0.642 . . . . 0.0 109.901 170.648 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 58.8 t60 50.48 -135.93 1.31 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.511 0.724 . . . . 0.0 109.559 -178.383 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.357 0.903 0 O-C-N 123.59 0.556 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.966 0.412 . . . . 0.0 110.387 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.6 tp -53.93 -37.03 63.43 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.94 0.896 . . . . 0.0 112.103 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 72.6 ttt-85 -64.61 -48.84 73.42 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 119.62 1.1 . . . . 0.0 109.596 -178.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -61.95 -46.2 90.35 Favored 'General case' 0 N--CA 1.457 -0.117 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.4 t -56.42 -52.52 64.34 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 110.428 -0.212 . . . . 0.0 110.428 -178.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -51.49 -49.95 60.83 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 118.314 -0.851 . . . . 0.0 110.422 173.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.7 tp -58.28 -52.41 65.69 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 119.236 0.925 . . . . 0.0 110.909 -177.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.8 m -64.69 -42.84 95.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.535 0.683 . . . . 0.0 109.458 -172.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.5 m -64.29 -43.1 95.81 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 175.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -66.23 -32.01 73.18 Favored 'General case' 0 C--O 1.226 -0.146 0 N-CA-C 107.165 -1.421 . . . . 0.0 107.165 -170.842 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.0 m -56.37 -33.41 65.69 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.142 0.428 . . . . 0.0 111.162 173.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 40.3 mt -91.86 12.29 22.05 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.9 0.88 . . . . 0.0 110.764 174.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.39 -20.61 36.6 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 125.139 1.352 . . . . 0.0 112.533 -177.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.0 mt -83.47 178.01 8.2 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.389 -1.065 . . . . 0.0 110.294 -152.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 13.3 tp -109.24 94.83 5.25 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.983 2.513 . . . . 0.0 107.347 -177.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -64.51 130.5 37.44 Favored Glycine 0 CA--C 1.523 0.534 0 CA-C-O 119.431 -0.65 . . . . 0.0 111.794 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.91 138.68 42.64 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 168.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -111.81 108.02 17.28 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 119.263 -0.399 . . . . 0.0 110.588 -155.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.5 mt -86.17 161.63 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -172.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -40.07 -49.97 3.52 Favored Glycine 0 CA--C 1.525 0.682 0 C-N-CA 125.283 1.421 . . . . 0.0 113.908 -172.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.74 -46.21 14.57 Favored 'General case' 0 N--CA 1.44 -0.941 0 C-N-CA 126.137 1.775 . . . . 0.0 108.875 -176.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -156.68 159.73 38.67 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -156.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 18.0 t -71.59 141.51 50.03 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.92 0.888 . . . . 0.0 111.173 175.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -127.67 172.6 10.63 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 167.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.5 m -145.01 97.36 3.0 Favored 'General case' 0 C--N 1.334 -0.068 0 C-N-CA 126.443 1.897 . . . . 0.0 107.241 -167.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -74.94 164.62 3.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 169.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.2 tttt . . . . . 0 N--CA 1.436 -1.147 0 O-C-N 121.342 -0.849 . . . . 0.0 110.196 178.249 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.5 t30 . . . . . 0 N--CA 1.45 -0.463 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 45.7 tp -46.08 -47.25 17.2 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.567 1.147 . . . . 0.0 112.084 174.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.1 ttm180 -60.19 -46.78 88.55 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.771 0.319 . . . . 0.0 110.22 -169.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 16.8 tmm? -67.9 -45.73 73.61 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 123.288 0.635 . . . . 0.0 109.342 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.1 t -53.97 -42.69 69.24 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.658 0.742 . . . . 0.0 111.231 -175.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -51.1 -33.73 27.4 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.918 1.287 . . . . 0.0 112.636 173.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.57 -46.35 59.66 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 123.886 0.874 . . . . 0.0 109.295 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.2 m -64.56 -53.28 50.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -176.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 97.2 m -64.8 -28.4 69.54 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.9 1.28 . . . . 0.0 110.943 -174.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.1 ttm105 -59.03 -20.16 50.56 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 117.938 -1.03 . . . . 0.0 111.123 177.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.6 p -50.53 -47.88 57.36 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 120.112 1.324 . . . . 0.0 110.899 175.158 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 81.9 mt -100.03 22.34 11.42 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.58 0.752 . . . . 0.0 109.424 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.12 20.25 60.22 Favored Glycine 0 C--N 1.334 0.463 0 C-N-CA 123.873 0.749 . . . . 0.0 113.042 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 33.5 mt -84.72 145.46 27.92 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.6 tt -76.68 97.85 4.57 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 105.237 -2.135 . . . . 0.0 105.237 175.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.5 148.12 48.03 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.715 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.443 ' NZ ' ' OE2' ' A' ' 27' ' ' GLU . 14.8 tptp -165.38 94.39 0.62 Allowed 'General case' 0 N--CA 1.425 -1.696 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 -140.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.7 t -74.53 116.62 15.42 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.243 -1.536 . . . . 0.0 110.973 -176.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 11.6 mm -84.68 161.24 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 162.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -25.31 -69.27 0.04 OUTLIER Glycine 0 CA--C 1.529 0.91 0 C-N-CA 125.886 1.708 . . . . 0.0 114.291 -169.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.73 -44.0 12.9 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 127.995 2.518 . . . . 0.0 108.928 179.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.1 mttm -108.78 129.38 55.38 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.006 0.522 . . . . 0.0 109.64 -151.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.3 t -65.04 118.91 9.83 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 164.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.443 ' OE2' ' NZ ' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -120.74 172.2 8.05 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 179.445 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 24.6 m -146.38 114.28 6.51 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 -165.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.5 m -103.03 145.46 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 171.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.7 tttm . . . . . 0 N--CA 1.437 -1.111 0 O-C-N 121.134 -0.979 . . . . 0.0 109.722 -178.448 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 64.3 t-20 . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 121.119 0.485 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.5 tp -49.63 -38.36 31.73 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.895 1.278 . . . . 0.0 112.148 176.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -64.54 -49.8 69.84 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.388 -0.82 . . . . 0.0 109.91 -177.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -65.42 -46.29 80.56 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.4 t -46.53 -50.81 16.64 Favored 'General case' 0 C--O 1.226 -0.139 0 C-N-CA 123.53 0.732 . . . . 0.0 109.846 178.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -58.27 -37.08 74.27 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 123.773 0.829 . . . . 0.0 112.94 177.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.8 tp -66.39 -45.73 79.02 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 119.799 1.181 . . . . 0.0 110.708 176.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.43 -45.49 87.3 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.3 m -63.45 -42.06 98.65 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.29 -31.91 70.7 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.5 m -71.52 -18.77 62.25 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 121.111 -0.993 . . . . 0.0 113.298 176.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 46.0 mt -93.85 6.21 49.14 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.892 0.877 . . . . 0.0 110.686 165.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.15 9.08 87.23 Favored Glycine 0 CA--C 1.527 0.822 0 O-C-N 120.743 -1.223 . . . . 0.0 113.126 -177.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 33.7 mt -105.15 148.92 26.36 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.267 1.427 . . . . 0.0 111.431 -171.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -79.6 124.09 28.21 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 127.145 2.178 . . . . 0.0 107.264 171.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -87.94 131.07 10.42 Favored Glycine 0 CA--C 1.525 0.711 0 CA-C-N 118.052 0.387 . . . . 0.0 112.945 -177.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -113.43 166.03 11.89 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 128.147 2.579 . . . . 0.0 109.09 175.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 33.4 t -119.4 130.18 55.18 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 169.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 4.5 mt -105.18 161.61 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 N-CA-C 105.804 -1.924 . . . . 0.0 105.804 161.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -46.33 -43.53 14.41 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 123.754 0.692 . . . . 0.0 113.531 -173.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -75.05 -47.0 31.12 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 126.383 1.873 . . . . 0.0 108.873 -175.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -156.51 164.01 38.72 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -153.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 14.7 t -64.73 138.0 58.13 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.617 1.167 . . . . 0.0 109.406 164.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.16 170.1 8.53 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 164.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 77.2 m -145.5 124.77 12.97 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 178.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.3 m -128.73 150.11 34.09 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.566 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 172.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.436 -1.142 0 O-C-N 120.732 -1.23 . . . . 0.0 111.598 -168.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.3 t30 . . . . . 0 N--CA 1.455 -0.182 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.6 tp -59.2 -35.33 73.41 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.82 0.848 . . . . 0.0 112.204 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -56.08 24.08 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 121.15 -0.969 . . . . 0.0 110.551 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 15.6 tmm? -54.58 -45.7 73.6 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 177.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.8 t -57.65 -57.52 12.38 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.85 -174.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -58.9 -40.06 83.33 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 122.09 -0.381 . . . . 0.0 110.737 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -57.13 -40.13 76.54 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 121.626 -0.671 . . . . 0.0 110.972 176.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.4 t -68.15 -51.67 43.36 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 176.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.6 m -64.15 -29.4 70.52 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.485 1.114 . . . . 0.0 110.82 -171.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.16 -46.37 12.01 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.512 1.125 . . . . 0.0 109.505 169.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -56.91 -28.29 61.78 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.105 0.411 . . . . 0.0 112.102 -175.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 mt -105.33 5.86 32.24 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 124.088 0.955 . . . . 0.0 111.15 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 56.2 52.59 48.54 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 -176.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 38.3 mt -126.75 142.27 51.59 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 125.415 1.486 . . . . 0.0 108.056 175.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.0 tt -76.39 109.64 10.26 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 105.704 -1.961 . . . . 0.0 105.704 170.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.27 134.07 28.75 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 177.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.47 165.39 21.71 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 167.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.7 t -132.07 102.98 6.03 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 122.075 -0.391 . . . . 0.0 110.013 -157.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.6 mt -82.99 161.31 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 N-CA-C 104.657 -2.349 . . . . 0.0 104.657 175.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -40.31 -55.6 3.01 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 123.966 0.793 . . . . 0.0 112.577 -166.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.03 -44.51 15.13 Favored 'General case' 0 N--CA 1.439 -0.988 0 C-N-CA 128.411 2.684 . . . . 0.0 107.697 -176.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -122.79 127.96 49.8 Favored 'General case' 0 C--N 1.334 -0.08 0 C-N-CA 124.037 0.935 . . . . 0.0 110.181 -145.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.6 t -64.62 140.89 58.91 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 161.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -140.29 172.09 13.23 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 106.857 -1.535 . . . . 0.0 106.857 167.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 65.7 m -145.83 108.69 4.54 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 -162.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.2 m -110.16 146.67 15.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 123.706 0.802 . . . . 0.0 109.727 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.6 tttp . . . . . 0 N--CA 1.445 -0.717 0 O-C-N 120.955 -1.091 . . . . 0.0 109.667 176.462 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.5 t30 . . . . . 0 N--CA 1.457 -0.096 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 38.4 tp -58.31 -38.48 77.18 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.414 0.686 . . . . 0.0 111.9 -178.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -51.33 69.52 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.555 0.616 . . . . 0.0 110.008 -178.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.0 -49.76 75.74 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.4 t -50.75 -52.71 37.94 Favored 'General case' 0 N--CA 1.46 0.055 0 CA-C-O 121.791 0.805 . . . . 0.0 110.337 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -60.19 -39.3 86.04 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 123.176 0.59 . . . . 0.0 111.284 177.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 40.5 tp -60.32 -43.24 96.54 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.676 -0.64 . . . . 0.0 111.204 176.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.78 -44.74 84.88 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.26 -0.9 . . . . 0.0 109.779 175.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -64.07 -36.04 82.7 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.538 0.335 . . . . 0.0 110.316 -173.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.4 ttt85 -45.13 -37.07 4.07 Favored 'General case' 0 C--N 1.341 0.211 0 C-N-CA 124.237 1.015 . . . . 0.0 111.163 170.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.3 t -55.81 -33.07 64.11 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.699 0.681 . . . . 0.0 111.027 -175.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.0 mt -107.64 15.38 24.75 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.778 0.831 . . . . 0.0 110.615 178.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.26 24.97 66.03 Favored Glycine 0 CA--C 1.524 0.624 0 O-C-N 121.387 -0.821 . . . . 0.0 113.152 -178.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 57.6 mt -98.81 162.37 13.14 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 123.78 0.832 . . . . 0.0 109.505 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 tt -105.51 104.43 14.16 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.99 1.716 . . . . 0.0 107.687 -174.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.96 123.79 31.02 Favored Glycine 0 CA--C 1.524 0.641 0 CA-C-O 119.306 -0.719 . . . . 0.0 112.148 -178.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.458 ' NZ ' ' OE1' ' A' ' 27' ' ' GLU . 2.2 pptp? -135.77 130.82 34.66 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 170.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 21.6 t -102.48 119.91 39.63 Favored 'General case' 0 N--CA 1.461 0.079 0 N-CA-C 112.486 0.551 . . . . 0.0 112.486 -166.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 13.5 mt -84.11 66.99 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 C-N-CA 125.591 1.556 . . . . 0.0 106.838 176.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.14 -84.1 0.51 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 125.524 1.535 . . . . 0.0 110.339 174.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.06 -45.44 18.31 Favored 'General case' 0 N--CA 1.44 -0.938 0 C-N-CA 125.61 1.564 . . . . 0.0 107.186 175.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.4 mttp -95.23 115.88 28.01 Favored 'General case' 0 C--O 1.227 -0.094 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 -155.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 20.1 t -64.53 119.05 9.72 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 165.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.458 ' OE1' ' NZ ' ' A' ' 20' ' ' LYS . 1.3 tm-20 -109.18 173.8 6.16 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 165.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 99.0 m -145.75 83.37 1.65 Allowed 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.616 1.567 . . . . 0.0 107.524 -167.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.4 m -76.46 144.25 12.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 C-N-CA 119.489 -0.884 . . . . 0.0 109.058 -173.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp . . . . . 0 N--CA 1.429 -1.489 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 175.15 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 . . . . . 0 C--O 1.23 0.049 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 35.7 tp -50.04 -35.77 26.27 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.77 1.228 . . . . 0.0 112.112 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.7 mmm-85 -67.45 -46.1 74.05 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.253 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -62.91 -46.61 87.02 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 35.9 t -47.84 -52.66 18.21 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.714 0.769 . . . . 0.0 109.783 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -61.04 -32.8 72.41 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 123.65 0.78 . . . . 0.0 112.242 177.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 37.2 tp -66.4 -44.06 84.09 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.805 1.184 . . . . 0.0 111.126 175.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.31 -43.29 95.17 Favored 'General case' 0 C--N 1.332 -0.189 0 O-C-N 120.997 -1.064 . . . . 0.0 108.875 176.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 65.2 m -64.38 -40.63 96.21 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.952 -0.547 . . . . 0.0 109.576 -177.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.6 ttt85 -47.56 -49.49 26.37 Favored 'General case' 0 C--N 1.343 0.29 0 CA-C-N 119.261 0.937 . . . . 0.0 109.961 168.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.9 m -59.77 -31.25 69.5 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.837 -0.125 . . . . 0.0 110.917 -175.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 53.6 mt -89.61 -1.88 58.15 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.697 0.799 . . . . 0.0 112.304 175.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.13 28.89 70.98 Favored Glycine 0 CA--C 1.526 0.765 0 O-C-N 120.657 -1.277 . . . . 0.0 112.511 -177.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 52.2 mt -117.64 177.43 4.76 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 126.797 2.039 . . . . 0.0 108.474 -179.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -122.02 111.43 17.03 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 126.961 2.105 . . . . 0.0 107.445 -171.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -73.28 119.65 6.77 Favored Glycine 0 CA--C 1.523 0.534 0 CA-C-O 119.321 -0.711 . . . . 0.0 111.589 -174.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -137.19 149.39 47.2 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 170.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -123.88 121.02 34.26 Favored 'General case' 0 N--CA 1.462 0.126 0 O-C-N 121.327 -0.858 . . . . 0.0 112.978 -159.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.1 mm -84.5 67.03 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 175.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.08 -88.06 0.19 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 126.539 2.019 . . . . 0.0 110.674 173.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.56 -29.83 56.81 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.7 mttp -108.7 108.05 18.74 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.238 1.015 . . . . 0.0 109.789 -159.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.3 t -64.09 131.59 47.99 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 165.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -132.54 172.97 11.82 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 106.033 -1.839 . . . . 0.0 106.033 166.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 79.6 m -131.42 88.38 2.58 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 126.789 2.036 . . . . 0.0 106.157 -170.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.5 m -71.54 164.82 3.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 173.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.4 tptp . . . . . 0 N--CA 1.433 -1.322 0 O-C-N 120.778 -1.201 . . . . 0.0 110.476 179.688 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 . . . . . 0 N--CA 1.454 -0.258 0 N-CA-C 108.512 -0.922 . . . . 0.0 108.512 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 44.1 tp -34.96 -53.42 0.57 Allowed 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 125.235 1.414 . . . . 0.0 114.672 -171.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 -45.99 -47.42 16.72 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-N 118.358 0.526 . . . . 0.0 111.813 -176.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 49.8 ttm -63.75 -53.41 51.47 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 -176.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.8 t -49.83 -54.69 17.77 Favored 'General case' 0 C--O 1.231 0.087 0 CA-C-O 121.593 0.711 . . . . 0.0 110.705 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -49.48 -51.54 35.39 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 125.401 1.481 . . . . 0.0 110.324 176.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 47.2 tp -61.5 -47.78 84.05 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.092 0.557 . . . . 0.0 111.051 -177.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 p -64.52 -47.53 78.49 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -175.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.418 ' SG ' ' HA2' ' A' ' 19' ' ' GLY . 72.1 m -64.41 -39.84 94.62 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -178.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.48 -38.76 75.06 Favored 'General case' 0 C--O 1.228 -0.074 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 m -63.61 -28.51 69.97 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.063 -0.398 . . . . 0.0 111.591 178.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 43.0 mt -88.24 3.52 49.16 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.889 0.876 . . . . 0.0 111.302 171.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 69.92 29.59 70.76 Favored Glycine 0 C--N 1.336 0.533 0 O-C-N 120.988 -1.07 . . . . 0.0 112.227 -177.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 70.6 mt -118.37 152.69 35.35 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 125.917 1.687 . . . . 0.0 109.064 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.0 tp -85.93 96.73 9.9 Favored 'General case' 0 N--CA 1.442 -0.835 0 C-N-CA 127.067 2.147 . . . . 0.0 106.86 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.418 ' HA2' ' SG ' ' A' ' 12' ' ' CYS . . . -65.91 114.4 6.56 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.483 -0.865 . . . . 0.0 111.264 -178.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.64 112.77 25.28 Favored 'General case' 0 N--CA 1.438 -1.072 0 N-CA-C 104.881 -2.266 . . . . 0.0 104.881 173.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.6 t -77.15 113.15 14.58 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 124.378 1.071 . . . . 0.0 109.29 177.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 30.1 mm -84.49 159.79 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 160.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -49.18 -48.2 32.73 Favored Glycine 0 C--O 1.224 -0.488 0 CA-C-O 121.982 0.768 . . . . 0.0 112.96 -159.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.2 -36.42 18.0 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 130.225 3.41 . . . . 0.0 115.964 177.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.0 tptt -133.93 129.5 36.4 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 -161.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.3 t -68.48 126.64 30.29 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 118.171 -0.919 . . . . 0.0 109.767 170.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -108.94 172.12 7.03 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 105.679 -1.971 . . . . 0.0 105.679 163.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.0 m -145.04 84.67 1.72 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 -168.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -70.07 172.1 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.2 mttt . . . . . 0 N--CA 1.43 -1.428 0 O-C-N 120.308 -1.495 . . . . 0.0 111.557 -172.747 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.5 t30 . . . . . 0 N--CA 1.456 -0.161 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 45.0 tp -51.07 -43.84 61.07 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 123.829 0.852 . . . . 0.0 112.16 177.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 63.8 ttp85 -62.83 -42.86 99.9 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.95 0.796 . . . . 0.0 110.717 -172.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 13.5 tmm? -61.7 -49.6 75.82 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 174.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.3 t -55.0 -52.02 64.42 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.911 -175.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -50.61 -55.06 18.04 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.06 1.344 . . . . 0.0 110.772 172.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 tp -56.72 -38.35 72.22 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.2 m -71.55 -53.4 13.92 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.11 0.481 . . . . 0.0 109.738 -178.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.3 m -64.35 -27.58 69.11 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 124.413 1.085 . . . . 0.0 110.663 -174.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 44.9 ttt180 -52.75 -25.47 11.28 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.217 -0.896 . . . . 0.0 111.273 173.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.6 p -50.38 -43.16 54.32 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 120.221 1.373 . . . . 0.0 111.29 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.7 mt -102.87 18.79 20.68 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.107 0.963 . . . . 0.0 110.132 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.21 31.25 72.79 Favored Glycine 0 CA--C 1.522 0.503 0 O-C-N 121.632 -0.668 . . . . 0.0 112.866 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 65.7 mt -98.43 139.16 34.59 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.784 0.833 . . . . 0.0 108.823 178.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 39.2 tp -63.59 108.31 1.36 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 165.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.22 129.09 22.96 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 108.925 -1.67 . . . . 0.0 108.925 167.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.57 153.54 48.69 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 174.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.2 t -128.96 100.83 5.81 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -146.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.7 mt -83.72 161.02 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 N-CA-C 105.383 -2.08 . . . . 0.0 105.383 173.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -40.87 -55.31 3.39 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 124.289 0.947 . . . . 0.0 112.854 -163.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.83 -43.91 12.9 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 127.234 2.214 . . . . 0.0 109.63 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -115.31 125.97 53.9 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.182 0.593 . . . . 0.0 109.791 -151.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.1 t -73.12 129.31 37.78 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 163.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -118.94 172.5 7.5 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 171.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.0 m -143.54 126.14 15.94 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 106.332 -1.729 . . . . 0.0 106.332 -173.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.4 m -135.53 152.99 32.44 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-N 118.423 0.556 . . . . 0.0 109.514 175.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 38.2 tttm . . . . . 0 N--CA 1.436 -1.157 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 174.665 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.8 t30 . . . . . 0 CA--C 1.53 0.196 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 48.9 tp -48.6 -42.45 34.0 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.535 1.134 . . . . 0.0 113.342 178.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.18 -54.11 48.43 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 118.81 0.732 . . . . 0.0 109.848 -178.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -60.47 -44.53 95.79 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.5 t -51.38 -57.55 8.65 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.543 0.687 . . . . 0.0 109.866 177.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -61.66 -34.82 76.4 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-O 117.984 -1.008 . . . . 0.0 111.458 -178.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 44.1 tp -63.0 -45.14 93.83 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.89 1.223 . . . . 0.0 110.637 175.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.0 m -64.89 -47.35 78.13 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.8 m -64.03 -43.82 94.41 Favored 'General case' 0 CA--C 1.535 0.365 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 -178.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -44.91 -53.61 7.41 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 125.688 1.595 . . . . 0.0 109.538 168.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 12.8 m -54.98 -44.21 74.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 118.235 0.47 . . . . 0.0 111.111 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.4 mt -75.28 -7.41 53.85 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.399 0.68 . . . . 0.0 112.454 177.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.97 43.84 25.81 Favored Glycine 0 C--N 1.334 0.457 0 CA-C-O 122.174 0.874 . . . . 0.0 111.298 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 54.1 mt -136.55 157.39 46.88 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 126.418 1.887 . . . . 0.0 108.403 -177.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.1 tp -90.78 108.01 19.56 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.67 1.988 . . . . 0.0 107.224 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.33 136.05 27.96 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.657 -0.782 . . . . 0.0 111.716 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 pptp? -134.57 153.47 51.94 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 166.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.6 t -134.08 96.87 3.72 Favored 'General case' 0 CA--C 1.518 -0.271 0 O-C-N 121.972 -0.455 . . . . 0.0 111.297 -154.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 6.2 mt -86.56 65.46 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 -177.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.72 -73.33 0.25 Allowed Glycine 0 CA--C 1.528 0.877 0 C-N-CA 124.374 0.988 . . . . 0.0 112.633 172.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.89 -49.96 7.47 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 126.217 1.807 . . . . 0.0 110.808 165.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -88.88 99.55 12.48 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -160.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 33.8 t -63.48 132.03 50.05 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 106.949 -1.501 . . . . 0.0 106.949 161.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -128.39 171.73 11.77 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 104.646 -2.353 . . . . 0.0 104.646 174.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -146.3 86.44 1.69 Allowed 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 -169.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -71.94 163.62 3.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 178.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.0 ttmm . . . . . 0 N--CA 1.437 -1.122 0 O-C-N 121.476 -0.765 . . . . 0.0 111.318 174.59 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 41.7 t30 . . . . . 0 CA--C 1.527 0.08 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.1 tp -35.99 -48.2 0.57 Allowed 'General case' 0 C--O 1.224 -0.275 0 C-N-CA 125.782 1.633 . . . . 0.0 113.768 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 70.4 mtm180 -55.34 -48.68 73.83 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 122.163 -0.336 . . . . 0.0 111.045 -176.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -65.41 -50.19 66.41 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 45.7 t -47.27 -52.67 15.47 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 121.646 0.736 . . . . 0.0 110.464 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -51.82 -47.09 64.49 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 124.121 0.968 . . . . 0.0 111.609 177.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 37.1 tp -67.27 -48.6 67.22 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 122.611 0.364 . . . . 0.0 110.186 -176.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.7 m -64.16 -41.03 97.31 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -174.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.0 m -64.92 -46.57 81.09 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 176.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.3 ttp-105 -58.12 -34.45 70.24 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 121.933 -0.48 . . . . 0.0 109.91 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.9 m -57.49 -29.46 64.29 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.679 0.672 . . . . 0.0 111.546 177.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 57.7 mt -99.9 14.48 30.3 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.185 0.994 . . . . 0.0 110.825 176.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.04 7.99 68.13 Favored Glycine 0 CA--C 1.527 0.811 0 O-C-N 120.996 -1.065 . . . . 0.0 113.235 -178.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 32.1 mt -92.05 145.22 24.69 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 122.179 0.99 . . . . 0.0 109.798 -175.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.5 tp -76.41 107.6 8.79 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 125.37 1.468 . . . . 0.0 107.193 170.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -90.2 138.26 14.4 Favored Glycine 0 C--N 1.331 0.29 0 CA-C-O 118.902 -0.944 . . . . 0.0 111.838 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.94 159.38 38.04 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 173.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 95.9 m -83.44 126.59 32.92 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 121.199 -0.938 . . . . 0.0 110.921 -176.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 14.8 mm -85.03 162.01 3.0 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 152.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -39.24 -56.72 2.26 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 124.921 1.248 . . . . 0.0 113.738 -171.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.37 -43.07 15.08 Favored 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 124.79 1.236 . . . . 0.0 108.606 -179.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.6 mttm -118.5 151.67 37.41 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 123.106 0.562 . . . . 0.0 110.902 -151.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.9 t -66.54 131.24 45.59 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 154.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -104.18 167.35 9.81 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 105.534 -2.025 . . . . 0.0 105.534 164.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 66.7 m -141.12 114.18 8.54 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 103.696 -2.705 . . . . 0.0 103.696 168.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.0 m -108.67 152.23 10.71 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.681 0 N-CA-C 106.519 -1.659 . . . . 0.0 106.519 168.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.432 -1.375 0 O-C-N 120.959 -1.088 . . . . 0.0 110.305 -173.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 . . . . . 0 N--CA 1.452 -0.336 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 31.7 tp -58.95 -45.39 90.57 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.541 0.337 . . . . 0.0 111.39 -173.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -61.99 -42.71 99.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 -176.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -58.37 -52.24 66.42 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.9 t -53.32 -55.92 20.89 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.652 -176.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -55.81 -46.59 78.0 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.318 1.047 . . . . 0.0 111.767 177.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.0 tt -56.78 -42.07 78.78 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 121.754 -0.591 . . . . 0.0 110.4 178.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 m -66.8 -50.39 62.8 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.4 m -63.52 -33.41 75.53 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.914 1.285 . . . . 0.0 109.616 -173.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.46 -26.75 21.57 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.517 1.527 . . . . 0.0 110.502 177.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.0 m -53.63 -36.92 62.56 Favored 'General case' 0 C--O 1.225 -0.198 0 O-C-N 121.025 -1.047 . . . . 0.0 112.961 175.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 mt -111.99 22.61 14.67 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.125 0.57 . . . . 0.0 109.929 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 58.47 26.33 59.33 Favored Glycine 0 CA--C 1.526 0.773 0 CA-C-O 122.04 0.8 . . . . 0.0 113.084 -179.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.4 mt -92.95 156.65 16.78 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 122.064 0.935 . . . . 0.0 108.766 178.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 tt -98.7 95.89 7.55 Favored 'General case' 0 N--CA 1.441 -0.921 0 C-N-CA 129.346 3.058 . . . . 0.0 106.514 -170.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.42 131.19 29.53 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.522 -0.847 . . . . 0.0 111.909 -177.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.44 ' NZ ' ' OE1' ' A' ' 27' ' ' GLU . 13.0 pttp -135.51 134.95 40.03 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 159.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 57.2 m -74.93 114.64 13.63 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 174.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.4 mt -83.44 162.57 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 N-CA-C 105.26 -2.126 . . . . 0.0 105.26 166.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -34.85 -57.3 0.79 Allowed Glycine 0 CA--C 1.525 0.674 0 C-N-CA 125.27 1.414 . . . . 0.0 112.987 -166.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.46 -43.21 19.19 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 127.837 2.455 . . . . 0.0 109.82 -172.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.22 164.35 38.92 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -160.233 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.6 t -64.96 133.14 51.11 Favored 'General case' 0 C--N 1.333 -0.114 0 C-N-CA 124.008 0.923 . . . . 0.0 110.225 174.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.44 ' OE1' ' NZ ' ' A' ' 20' ' ' LYS . 5.1 tm-20 -118.38 170.94 8.5 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 106.472 -1.677 . . . . 0.0 106.472 161.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 94.9 m -146.12 82.81 1.61 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 -168.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -72.69 150.47 8.3 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 -176.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.6 ttpt . . . . . 0 N--CA 1.433 -1.292 0 C-N-CA 118.895 -1.122 . . . . 0.0 111.854 -164.464 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 64.9 t-20 . . . . . 0 N--CA 1.451 -0.395 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 32.7 tp -44.48 -45.19 9.05 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.485 1.114 . . . . 0.0 111.648 -179.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 69.2 ttp85 -56.79 -49.68 74.6 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 122.352 0.261 . . . . 0.0 111.338 -177.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -69.21 -49.31 57.6 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.7 t -46.23 -51.04 15.09 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 124.244 1.017 . . . . 0.0 110.595 -175.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -55.05 -45.02 75.22 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.77 -179.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 32.0 tp -70.11 -47.3 62.4 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.141 0.576 . . . . 0.0 109.79 -174.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 p -64.18 -45.82 86.71 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 -176.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.0 m -64.34 -40.31 95.63 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.2 ttp-105 -62.54 -41.75 99.08 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -178.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.5 m -57.32 -35.04 69.36 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.188 0.449 . . . . 0.0 111.422 175.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.6 mt -85.08 5.18 30.75 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.598 0.759 . . . . 0.0 111.669 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 61.54 47.17 92.17 Favored Glycine 0 C--N 1.334 0.461 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 23.5 mt -131.46 148.88 52.68 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 126.507 1.923 . . . . 0.0 108.582 175.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.8 tp -82.16 107.13 14.62 Favored 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 171.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.03 129.71 29.63 Favored Glycine 0 N--CA 1.451 -0.307 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 178.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.17 131.32 40.28 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 176.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 m -80.27 133.28 35.97 Favored 'General case' 0 CA--C 1.515 -0.373 0 O-C-N 121.084 -1.01 . . . . 0.0 109.734 177.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.9 mm -84.34 160.44 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.683 0 N-CA-C 104.324 -2.473 . . . . 0.0 104.324 149.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.21 -47.78 41.43 Favored Glycine 0 CA--C 1.528 0.862 0 O-C-N 121.449 -0.782 . . . . 0.0 112.355 -171.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.93 -44.65 47.44 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 127.034 2.134 . . . . 0.0 107.765 -172.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -155.01 152.99 30.31 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-O 121.529 0.68 . . . . 0.0 110.883 -151.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.9 t -70.93 140.78 51.07 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 124.348 1.059 . . . . 0.0 111.182 -178.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -128.23 171.97 11.47 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 106.53 -1.655 . . . . 0.0 106.53 163.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 86.4 m -146.08 102.38 3.62 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 -170.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.2 m -89.03 166.81 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 172.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm . . . . . 0 N--CA 1.44 -0.963 0 O-C-N 120.752 -1.218 . . . . 0.0 108.941 172.179 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 62.7 t-20 . . . . . 0 N--CA 1.463 0.203 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.9 tp -48.11 -43.77 31.25 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.702 0.801 . . . . 0.0 111.969 176.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -66.12 -45.78 79.88 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.859 -0.526 . . . . 0.0 110.297 -172.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -60.13 -49.16 78.74 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 175.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.1 t -51.0 -54.43 24.61 Favored 'General case' 0 CA--C 1.523 -0.077 0 CA-C-O 121.309 0.576 . . . . 0.0 110.787 -176.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -53.83 -47.29 71.08 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 124.45 1.1 . . . . 0.0 110.801 176.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 41.9 tp -60.74 -42.75 97.99 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 119.178 -0.439 . . . . 0.0 111.61 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.91 -51.0 52.87 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 119.1 0.864 . . . . 0.0 109.611 179.079 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.1 m -63.58 -31.8 73.08 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 124.101 0.96 . . . . 0.0 109.018 -171.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -49.25 -29.89 6.41 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.356 -0.831 . . . . 0.0 111.942 172.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 80.1 p -52.68 -40.71 63.16 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 120.175 1.352 . . . . 0.0 111.483 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.4 mt -104.5 21.35 16.9 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.826 0.85 . . . . 0.0 109.953 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.2 33.71 86.82 Favored Glycine 0 C--N 1.335 0.509 0 CA-C-O 122.209 0.894 . . . . 0.0 111.882 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.9 mt -102.39 132.34 48.46 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-O 121.866 0.841 . . . . 0.0 109.373 -178.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.3 tp -68.01 94.61 0.5 Allowed 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 125.668 1.587 . . . . 0.0 106.955 170.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.47 123.7 29.84 Favored Glycine 0 N--CA 1.448 -0.535 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 170.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.2 143.62 46.5 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 106.789 -1.56 . . . . 0.0 106.789 173.35 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 t -129.29 96.36 4.28 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 -145.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.4 mt -83.06 159.87 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 N-CA-C 104.109 -2.552 . . . . 0.0 104.109 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -46.31 -49.9 14.1 Favored Glycine 0 CA--C 1.53 0.972 0 CA-C-O 122.504 1.058 . . . . 0.0 113.45 -162.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.47 -24.24 24.19 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 130.814 3.646 . . . . 0.0 115.241 -177.115 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.5 mmtm -138.91 118.16 12.71 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.049 0.94 . . . . 0.0 112.402 -170.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.2 t -64.29 124.46 21.79 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 155.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -117.67 172.05 7.62 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 105.832 -1.914 . . . . 0.0 105.832 171.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.0 m -142.56 98.75 3.36 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.751 1.62 . . . . 0.0 107.655 -172.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -83.04 173.26 0.96 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 172.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.7 ttmp? . . . . . 0 N--CA 1.444 -0.762 0 O-C-N 119.975 -1.703 . . . . 0.0 109.913 170.783 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 63.8 t-20 . . . . . 0 N--CA 1.462 0.162 0 CA-C-O 122.112 0.958 . . . . 0.0 108.891 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 24.2 tp -56.44 -34.89 67.27 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.642 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.71 -48.79 79.14 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.875 0.761 . . . . 0.0 110.739 177.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -58.38 -49.28 77.82 Favored 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 109.047 -0.724 . . . . 0.0 109.047 177.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.6 t -51.52 -52.75 44.31 Favored 'General case' 0 C--O 1.227 -0.116 0 CA-C-O 121.022 0.439 . . . . 0.0 110.542 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -52.37 -48.46 65.58 Favored 'General case' 0 N--CA 1.444 -0.759 0 C-N-CA 123.129 0.572 . . . . 0.0 111.481 175.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.0 tp -63.1 -49.6 73.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.436 0.562 . . . . 0.0 111.197 -176.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.1 m -64.71 -42.37 95.31 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 121.376 -0.828 . . . . 0.0 109.695 -177.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 87.2 m -63.9 -42.85 97.34 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.3 ttt85 -54.86 -46.91 74.76 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.0 m -58.24 -35.18 71.32 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 117.949 0.34 . . . . 0.0 111.05 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.5 mt -84.92 1.73 45.98 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.543 0.737 . . . . 0.0 111.851 176.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.97 47.7 64.31 Favored Glycine 0 C--N 1.334 0.422 0 O-C-N 120.71 -1.244 . . . . 0.0 110.148 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.9 mt -136.49 177.69 7.65 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 128.13 2.572 . . . . 0.0 107.48 176.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -125.13 110.76 14.5 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 126.29 1.836 . . . . 0.0 106.914 -175.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -73.46 123.59 8.38 Favored Glycine 0 N--CA 1.449 -0.491 0 CA-C-O 119.451 -0.639 . . . . 0.0 112.445 -173.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.4 ' NZ ' ' OE1' ' A' ' 27' ' ' GLU . 1.9 pptp? -134.99 133.48 39.5 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 106.006 -1.85 . . . . 0.0 106.006 167.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 30.2 t -103.78 136.84 42.71 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -165.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 23.2 mt -97.85 163.33 2.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 125.68 1.592 . . . . 0.0 107.274 176.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -12.55 -70.55 0.01 OUTLIER Glycine 0 CA--C 1.532 1.141 0 C-N-CA 127.839 2.638 . . . . 0.0 116.352 -176.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.92 -47.9 9.22 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 126.639 1.976 . . . . 0.0 108.927 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -136.93 149.39 47.55 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.969 0.89 . . . . 0.0 113.159 -146.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.5 t -64.87 139.59 58.78 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.161 1.784 . . . . 0.0 111.307 -178.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.4 ' OE1' ' NZ ' ' A' ' 20' ' ' LYS . 4.0 tm-20 -122.95 172.76 8.25 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 105.241 -2.133 . . . . 0.0 105.241 160.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 94.4 m -145.87 83.69 1.65 Allowed 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 -164.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 31.4 m -72.28 157.17 6.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -177.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 43.9 tptt . . . . . 0 N--CA 1.437 -1.082 0 O-C-N 121.35 -0.844 . . . . 0.0 112.368 -167.86 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 . . . . . 0 N--CA 1.458 -0.049 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.8 tp -50.48 -37.05 36.59 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.965 0.906 . . . . 0.0 112.333 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.38 -52.08 44.31 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 121.358 -0.839 . . . . 0.0 110.506 -176.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -61.61 -42.98 99.64 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.2 t -50.76 -57.44 8.34 Favored 'General case' 0 CA--C 1.523 -0.083 0 CA-C-O 121.487 0.66 . . . . 0.0 109.226 177.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -60.99 -37.33 82.1 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 122.827 0.451 . . . . 0.0 111.93 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 31.2 tp -60.93 -43.03 99.19 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.095 0.861 . . . . 0.0 110.468 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.5 m -67.1 -44.78 79.09 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.8 m -63.77 -41.24 98.0 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -177.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.81 -30.93 4.4 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 125.315 1.446 . . . . 0.0 111.164 172.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.0 t -51.69 -44.3 63.07 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.696 1.135 . . . . 0.0 109.825 -177.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 57.5 mt -108.69 25.22 11.99 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.97 0.908 . . . . 0.0 110.266 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 61.01 27.16 66.7 Favored Glycine 0 CA--C 1.526 0.753 0 CA-C-O 121.858 0.699 . . . . 0.0 113.386 177.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.8 mt -91.64 172.24 8.63 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 123.897 0.879 . . . . 0.0 109.391 177.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.1 tt -126.2 97.64 5.16 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 127.292 2.237 . . . . 0.0 106.269 -161.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.32 125.06 11.56 Favored Glycine 0 CA--C 1.526 0.763 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.581 -168.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.5 mtpm? -124.73 120.0 30.53 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 126.134 1.774 . . . . 0.0 107.925 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.0 m -74.78 130.53 39.64 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 6.2 mt -111.73 66.42 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 125.391 1.476 . . . . 0.0 107.54 169.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.99 -88.8 0.48 Allowed Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 126.429 1.966 . . . . 0.0 110.319 173.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.74 -45.25 21.58 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 176.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.9 mttp -88.99 157.09 18.5 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.25 0.62 . . . . 0.0 109.714 -162.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.7 t -101.81 123.82 46.41 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 164.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -104.88 170.2 8.01 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 167.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 92.2 m -149.57 85.12 1.43 Allowed 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.943 1.697 . . . . 0.0 110.253 -169.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.6 m -76.23 166.09 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 O-C-N 120.69 -1.256 . . . . 0.0 110.294 177.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.4 mtmt . . . . . 0 N--CA 1.439 -0.979 0 O-C-N 121.145 -0.972 . . . . 0.0 111.797 -174.327 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 . . . . . 0 CA--C 1.529 0.15 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.2 tp -53.87 -37.4 63.67 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.676 0.79 . . . . 0.0 111.601 176.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.62 -49.19 78.73 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.722 0.692 . . . . 0.0 109.917 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -59.21 -52.35 66.08 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 178.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.7 t -51.95 -50.06 61.94 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 122.023 0.916 . . . . 0.0 110.852 -176.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -54.42 -46.87 73.28 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.395 176.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.92 -49.76 71.38 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.084 0.554 . . . . 0.0 111.493 -177.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.6 p -64.55 -42.27 95.79 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.44 -0.787 . . . . 0.0 109.222 -176.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.1 m -63.78 -42.97 97.65 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.01 -42.43 94.27 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 -178.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.9 m -55.88 -43.51 77.25 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 120.82 -1.175 . . . . 0.0 111.232 175.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.9 mt -72.91 -4.71 33.69 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 122.751 0.42 . . . . 0.0 111.648 175.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.02 14.84 82.21 Favored Glycine 0 CA--C 1.524 0.625 0 O-C-N 121.184 -0.947 . . . . 0.0 111.866 -178.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 24.0 mt -100.76 -179.73 4.16 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 125.884 1.674 . . . . 0.0 107.884 177.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -121.62 104.39 9.59 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 -171.007 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -77.15 130.77 10.65 Favored Glycine 0 C--N 1.332 0.351 0 CA-C-O 119.428 -0.651 . . . . 0.0 113.239 -170.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.88 130.76 27.8 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 106.474 -1.676 . . . . 0.0 106.474 168.228 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.6 t -99.71 124.96 45.47 Favored 'General case' 0 CA--C 1.518 -0.271 0 O-C-N 121.933 -0.479 . . . . 0.0 111.125 -174.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.6 mt -84.85 161.98 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 172.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -45.57 -36.23 6.03 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.444 1.021 . . . . 0.0 114.195 -177.024 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -57.83 3.67 Favored 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 127.933 2.493 . . . . 0.0 107.872 -179.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.65 155.9 30.85 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -152.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.5 t -66.59 133.03 49.47 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 124.15 0.98 . . . . 0.0 110.877 171.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.9 172.08 9.67 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 164.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 76.8 m -145.81 89.98 1.95 Allowed 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 126.507 1.923 . . . . 0.0 106.31 -167.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.6 m -70.19 146.81 11.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 174.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.9 ttpp . . . . . 0 N--CA 1.435 -1.215 0 O-C-N 121.37 -0.832 . . . . 0.0 111.137 -164.293 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.6 t30 . . . . . 0 CA--C 1.527 0.07 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 56.0 tp -39.51 -46.91 1.8 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.784 1.634 . . . . 0.0 113.291 174.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.8 ttt85 -64.02 -44.45 92.54 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 119.006 0.821 . . . . 0.0 109.797 -174.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -61.75 -48.25 81.52 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 174.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 54.1 t -53.16 -55.06 27.13 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.834 0.826 . . . . 0.0 109.582 -176.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.3 mm-40 -57.24 -46.15 83.27 Favored 'General case' 0 N--CA 1.44 -0.958 0 O-C-N 121.888 -0.508 . . . . 0.0 110.888 178.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 46.6 tp -62.74 -46.45 88.02 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.686 0.675 . . . . 0.0 111.482 -176.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.4 p -64.98 -45.13 86.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -178.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 88.4 m -62.95 -42.8 99.93 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -41.53 77.3 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 177.128 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.9 m -68.54 -27.21 65.89 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 177.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 69.1 mt -80.18 -3.85 50.66 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.545 0.612 . . . . 0.0 111.534 167.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 75.32 29.13 60.61 Favored Glycine 0 C--N 1.337 0.591 0 CA-C-N 119.299 0.954 . . . . 0.0 111.444 -177.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 30.8 mt -123.55 -176.44 3.45 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.847 2.059 . . . . 0.0 108.17 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.9 tp -135.45 113.95 11.65 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 126.193 1.797 . . . . 0.0 107.992 -166.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.14 144.76 45.22 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 121.441 -0.409 . . . . 0.0 112.997 -165.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -127.99 87.11 2.56 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 128.16 2.584 . . . . 0.0 105.375 171.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -78.28 98.11 5.8 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 123.602 0.761 . . . . 0.0 110.728 -176.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.4 mt -87.96 161.34 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 N-CA-C 106.703 -1.592 . . . . 0.0 106.703 164.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.36 -53.53 23.8 Favored Glycine 0 CA--C 1.523 0.544 0 O-C-N 121.989 -0.444 . . . . 0.0 113.293 -166.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.4 -26.13 26.61 Favored 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 124.859 1.263 . . . . 0.0 110.435 179.702 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -129.02 110.47 12.08 Favored 'General case' 0 C--O 1.226 -0.14 0 C-N-CA 123.368 0.667 . . . . 0.0 110.162 -156.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 31.6 t -76.42 117.67 18.32 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 164.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -103.49 170.95 7.64 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 171.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.8 m -148.48 84.67 1.49 Allowed 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.669 1.588 . . . . 0.0 109.165 -171.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.7 m -70.7 154.84 7.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 118.941 -1.104 . . . . 0.0 109.306 178.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt . . . . . 0 N--CA 1.436 -1.134 0 O-C-N 121.368 -0.832 . . . . 0.0 109.671 -178.609 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 32.9 t-20 . . . . . 0 N--CA 1.45 -0.466 0 N-CA-C 103.415 -2.809 . . . . 0.0 103.415 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.0 tp -51.68 -39.46 58.29 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 118.535 0.607 . . . . 0.0 110.305 177.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -61.25 -38.54 87.04 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-O 118.584 -0.722 . . . . 0.0 112.143 176.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 58.5 ttp -63.94 -49.96 70.56 Favored 'General case' 0 CA--C 1.528 0.101 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.1 t -52.95 -54.75 30.38 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-O 121.289 0.566 . . . . 0.0 110.07 179.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -61.84 -35.9 79.63 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-O 118.554 -0.736 . . . . 0.0 112.519 -179.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.6 tt -63.82 -43.84 95.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 119.605 1.093 . . . . 0.0 109.535 176.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.3 t -64.37 -48.76 74.26 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 -178.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.8 m -63.42 -42.52 98.71 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 -177.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -39.1 68.02 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 124.253 1.021 . . . . 0.0 108.644 176.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.4 m -68.93 -25.12 64.42 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.637 -0.665 . . . . 0.0 112.66 177.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.7 mt -89.02 -0.02 57.07 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.682 0.793 . . . . 0.0 111.743 168.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.84 35.06 65.78 Favored Glycine 0 CA--C 1.525 0.682 0 O-C-N 121.24 -0.912 . . . . 0.0 112.646 -177.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 35.3 mt -129.1 172.82 11.03 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 126.496 1.918 . . . . 0.0 109.72 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.0 tp -116.44 110.93 19.29 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 126.574 1.95 . . . . 0.0 109.228 -171.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -74.48 132.06 13.98 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 114.336 0.494 . . . . 0.0 114.336 -169.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? -124.38 108.99 12.76 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 126.448 1.899 . . . . 0.0 107.429 171.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.5 t -76.01 112.5 12.5 Favored 'General case' 0 C--N 1.332 -0.152 0 O-C-N 122.038 -0.414 . . . . 0.0 111.242 -178.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.2 mm -88.46 65.92 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 C-N-CA 125.565 1.546 . . . . 0.0 107.676 177.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.62 -88.12 0.17 Allowed Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 125.829 1.68 . . . . 0.0 110.791 175.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.29 -42.98 34.82 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 106.352 -1.722 . . . . 0.0 106.352 178.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -102.38 162.93 12.53 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.507 1.123 . . . . 0.0 108.799 -159.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.2 t -112.02 122.36 47.56 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 175.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -104.58 169.84 8.23 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 106.19 -1.781 . . . . 0.0 106.19 167.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 90.2 m -149.11 85.18 1.46 Allowed 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.867 1.667 . . . . 0.0 110.167 -167.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.2 m -76.43 148.61 6.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 O-C-N 120.876 -1.14 . . . . 0.0 110.601 -178.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt . . . . . 0 N--CA 1.435 -1.194 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -179.555 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 . . . . . 0 N--CA 1.452 -0.369 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 49.5 tp -39.54 -46.26 1.71 Allowed 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 125.691 1.596 . . . . 0.0 113.453 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.72 -52.5 59.91 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.492 0.717 . . . . 0.0 111.815 178.161 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -63.31 -47.36 82.58 Favored 'General case' 0 N--CA 1.457 -0.079 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 178.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 34.8 t -49.78 -56.51 10.05 Favored 'General case' 0 C--O 1.224 -0.287 0 O-C-N 123.856 0.722 . . . . 0.0 109.713 -178.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -57.01 -45.09 83.31 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 124.346 1.059 . . . . 0.0 112.468 -179.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.3 tt -60.65 -44.75 96.04 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.582 0.706 . . . . 0.0 109.972 179.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.7 m -64.52 -45.6 86.5 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 97.7 m -63.15 -41.41 99.26 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 -176.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.18 -36.62 82.46 Favored 'General case' 0 C--O 1.228 -0.064 0 N-CA-C 106.938 -1.504 . . . . 0.0 106.938 -178.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.2 m -70.59 -14.87 62.66 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 177.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.6 mt -98.07 5.13 49.01 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.444 0.698 . . . . 0.0 110.644 168.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.05 21.01 79.28 Favored Glycine 0 CA--C 1.526 0.78 0 O-C-N 120.782 -1.199 . . . . 0.0 112.168 -177.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.1 mt -112.33 -177.7 3.23 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.122 1.769 . . . . 0.0 108.365 177.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -140.95 105.78 4.94 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -163.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.17 134.6 25.15 Favored Glycine 0 CA--C 1.528 0.844 0 C-N-CA 121.335 -0.46 . . . . 0.0 113.866 -166.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 11.9 mptt -117.21 165.63 13.2 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 127.374 2.27 . . . . 0.0 105.587 161.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 50.8 t -150.37 104.94 3.28 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.244 -0.91 . . . . 0.0 110.515 -169.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.4 mt -87.08 161.36 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 N-CA-C 105.449 -2.056 . . . . 0.0 105.449 162.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -45.32 -49.94 10.3 Favored Glycine 0 CA--C 1.527 0.785 0 CA-C-O 122.236 0.909 . . . . 0.0 114.119 -170.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.05 -33.33 22.5 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 124.182 0.993 . . . . 0.0 109.587 -177.204 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 37.3 mttp -119.3 116.21 25.76 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 125.033 1.333 . . . . 0.0 111.258 -157.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 20.3 t -66.51 127.03 30.76 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 155.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -105.54 169.09 8.67 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 105.379 -2.082 . . . . 0.0 105.379 165.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 87.9 m -148.7 84.09 1.47 Allowed 'General case' 0 C--O 1.233 0.212 0 C-N-CA 124.904 1.282 . . . . 0.0 109.335 -177.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -71.41 146.78 11.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 O-C-N 121.175 -0.953 . . . . 0.0 108.905 -177.453 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? . . . . . 0 N--CA 1.441 -0.876 0 O-C-N 120.854 -1.154 . . . . 0.0 112.606 -160.048 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 51.3 t-20 . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.739 0.304 . . . . 0.0 110.594 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.5 tp -51.71 -38.27 54.46 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 124.466 1.106 . . . . 0.0 111.494 -178.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 40.8 mtp85 -58.24 -52.3 66.14 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 64.6 ttp -64.3 -49.7 70.76 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 -179.17 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.3 t -49.9 -52.77 30.45 Favored 'General case' 0 C--N 1.334 -0.067 0 C-N-CA 123.008 0.523 . . . . 0.0 110.261 -176.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -69.21 -15.52 63.4 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.8 tp -80.54 -52.47 7.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 119.817 1.19 . . . . 0.0 109.36 168.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.1 p -63.91 -41.45 97.67 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.604 -0.685 . . . . 0.0 109.432 -172.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 83.5 m -64.07 -40.23 95.81 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 176.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.7 ttm105 -65.28 -35.64 81.64 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -175.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.2 m -55.82 -33.05 64.09 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.536 0.607 . . . . 0.0 111.562 172.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 42.5 mt -90.69 6.76 42.69 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.795 0.838 . . . . 0.0 111.302 177.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.16 19.7 78.69 Favored Glycine 0 CA--C 1.526 0.754 0 O-C-N 121.32 -0.863 . . . . 0.0 113.299 -178.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 37.3 mt -111.75 170.1 8.37 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.743 1.217 . . . . 0.0 109.976 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -115.61 104.16 11.43 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 126.252 1.821 . . . . 0.0 107.89 -170.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.59 128.92 38.94 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-N 116.477 -0.329 . . . . 0.0 113.061 -173.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.2 mtpm? -121.11 116.44 24.99 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.549 -1.648 . . . . 0.0 106.549 166.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -94.44 100.67 12.63 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 117.896 0.316 . . . . 0.0 110.148 -169.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.2 mt -90.25 162.29 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -171.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -39.93 -49.59 3.41 Favored Glycine 0 CA--C 1.525 0.704 0 C-N-CA 125.162 1.363 . . . . 0.0 113.854 -171.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.21 -42.24 14.88 Favored 'General case' 0 N--CA 1.439 -1.003 0 C-N-CA 125.782 1.633 . . . . 0.0 107.518 -171.318 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -156.23 159.86 39.3 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.985 0.914 . . . . 0.0 111.531 -153.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.7 t -79.32 125.19 29.18 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.07 169.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -105.41 170.78 7.68 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 167.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.3 m -148.57 84.89 1.49 Allowed 'General case' 0 C--O 1.232 0.155 0 C-N-CA 125.115 1.366 . . . . 0.0 110.59 -167.398 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.4 m -76.08 144.72 11.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 O-C-N 120.945 -1.097 . . . . 0.0 111.281 -175.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt . . . . . 0 N--CA 1.433 -1.28 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 173.186 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 55.3 t-20 . . . . . 0 N--CA 1.454 -0.249 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 49.3 tp -51.51 -36.8 46.23 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.935 0.894 . . . . 0.0 111.034 178.604 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.74 -52.38 65.75 Favored 'General case' 0 N--CA 1.458 -0.073 0 CA-C-N 118.776 0.717 . . . . 0.0 110.222 179.36 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 15.5 tmm? -64.32 -46.16 84.72 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -178.405 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 11.4 t -49.79 -57.64 6.95 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 177.565 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -58.79 -40.99 85.64 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 118.522 -0.751 . . . . 0.0 112.078 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.9 tt -60.64 -43.66 97.31 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.605 1.093 . . . . 0.0 110.015 178.149 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.1 t -64.07 -46.48 84.15 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 -178.242 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.8 m -63.23 -45.86 89.66 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -176.755 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -38.97 67.51 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 125.339 1.456 . . . . 0.0 108.817 177.702 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.1 m -67.51 -19.02 65.26 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 178.951 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.8 mt -101.13 9.21 42.25 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.837 0.855 . . . . 0.0 111.039 169.538 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.28 23.11 77.59 Favored Glycine 0 CA--C 1.526 0.756 0 O-C-N 120.878 -1.139 . . . . 0.0 112.779 -179.476 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.7 mt -109.11 175.46 5.45 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 125.562 1.545 . . . . 0.0 108.868 178.302 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.7 tt -126.82 102.86 7.22 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.983 1.713 . . . . 0.0 107.057 -167.917 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.84 120.19 20.42 Favored Glycine 0 CA--C 1.529 0.951 0 O-C-N 122.104 -0.373 . . . . 0.0 112.499 -174.811 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.4 tptt -122.17 106.29 11.02 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 104.521 -2.4 . . . . 0.0 104.521 174.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 5.1 t -110.76 124.87 52.82 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.704 0.684 . . . . 0.0 111.534 -170.213 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 22.2 mt -91.34 162.67 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 105.874 -1.899 . . . . 0.0 105.874 168.162 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -5.8 -81.04 0.01 OUTLIER Glycine 0 CA--C 1.532 1.135 0 C-N-CA 127.209 2.337 . . . . 0.0 115.441 -175.043 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.54 -38.78 16.87 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 128.496 2.718 . . . . 0.0 113.919 167.153 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -85.38 100.53 11.9 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.879 1.271 . . . . 0.0 110.433 -156.941 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.4 t -66.64 119.05 11.09 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.048 0.939 . . . . 0.0 110.513 166.018 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.62 171.52 7.32 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 104.802 -2.296 . . . . 0.0 104.802 161.503 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 94.0 m -145.95 83.2 1.63 Allowed 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.234 -2.135 . . . . 0.0 105.234 -177.694 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.3 m -73.53 144.24 12.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 C-N-CA 119.33 -0.948 . . . . 0.0 108.949 -177.455 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.6 ttpp . . . . . 0 N--CA 1.435 -1.218 0 CA-C-O 118.202 -0.904 . . . . 0.0 111.568 -159.755 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 28.1 tp -53.61 -33.81 56.26 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.396 1.078 . . . . 0.0 111.817 179.434 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.73 -46.68 68.27 Favored 'General case' 0 N--CA 1.453 -0.277 0 O-C-N 121.393 -0.817 . . . . 0.0 110.27 -176.76 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 13.3 tmm? -69.1 -44.61 72.12 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 176.694 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 23.3 t -50.7 -55.43 16.59 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 123.889 0.876 . . . . 0.0 110.08 -177.839 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -55.51 -39.42 70.48 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 178.97 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 39.8 tp -67.06 -44.83 79.1 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.972 -0.455 . . . . 0.0 110.618 -179.575 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.1 t -63.65 -44.97 92.27 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 -179.206 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 88.6 m -62.82 -43.65 98.25 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 -177.47 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.8 tpt85 -57.99 -44.49 87.19 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 177.722 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -55.86 -44.51 78.12 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 118.01 0.368 . . . . 0.0 110.039 177.732 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.8 mt -74.95 -3.33 31.57 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.284 0.634 . . . . 0.0 111.6 178.563 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.11 40.19 43.1 Favored Glycine 0 C--N 1.333 0.415 0 CA-C-O 122.313 0.952 . . . . 0.0 110.775 179.292 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 16.8 mt -131.37 -174.26 3.35 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 127.987 2.515 . . . . 0.0 107.303 177.363 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 47.9 tp -145.82 117.18 7.95 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 125.945 1.698 . . . . 0.0 107.517 -168.103 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.68 162.97 49.47 Favored Glycine 0 CA--C 1.533 1.186 0 N-CA-C 115.535 0.974 . . . . 0.0 115.535 -161.829 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -145.04 166.64 24.76 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 127.91 2.484 . . . . 0.0 106.902 157.802 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -121.54 120.35 34.6 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 121.465 -0.772 . . . . 0.0 109.524 177.681 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 56.7 mt -84.49 163.33 2.82 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 156.961 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -39.87 -59.01 2.14 Favored Glycine 0 CA--C 1.529 0.919 0 C-N-CA 124.468 1.033 . . . . 0.0 114.013 -171.556 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.83 -33.59 45.89 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.449 1.5 . . . . 0.0 108.596 -177.261 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.4 ttpm? -140.77 124.15 16.75 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.724 0.297 . . . . 0.0 111.011 -130.717 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.5 t -65.03 134.01 52.91 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.173 0.989 . . . . 0.0 110.5 173.248 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.3 tm-20 -106.31 166.5 10.48 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 105.544 -2.021 . . . . 0.0 105.544 164.314 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 84.2 m -149.74 84.97 1.41 Allowed 'General case' 0 C--O 1.235 0.315 0 C-N-CA 125.474 1.51 . . . . 0.0 110.598 -178.691 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.0 m -71.13 157.46 6.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 178.541 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.441 -0.884 0 O-C-N 120.592 -1.318 . . . . 0.0 109.837 174.53 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 . . . . . 0 N--CA 1.456 -0.165 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.8 tp -50.46 -36.71 34.72 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 124.659 1.184 . . . . 0.0 112.352 177.718 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.17 -48.85 69.38 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 121.209 -0.932 . . . . 0.0 109.238 -177.906 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 12.2 tmm? -55.11 -48.25 73.87 Favored 'General case' 0 C--N 1.335 -0.049 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 174.281 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.8 t -56.73 -58.34 8.5 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.271 0.557 . . . . 0.0 110.518 -175.793 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -49.77 -45.76 49.96 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 125.08 1.352 . . . . 0.0 110.822 175.728 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.4 tp -63.46 -42.4 98.62 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 121.627 -0.671 . . . . 0.0 110.989 -177.576 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -64.62 -51.99 59.79 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 178.43 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.8 m -64.13 -34.36 77.89 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 123.944 0.898 . . . . 0.0 110.147 -170.713 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -47.04 -37.96 10.2 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 123.592 0.757 . . . . 0.0 111.216 170.402 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.3 t -56.2 -34.6 66.42 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.671 0.669 . . . . 0.0 110.742 -176.467 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 68.7 mt -104.34 15.18 28.79 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.675 0.79 . . . . 0.0 110.647 177.58 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 59.77 19.98 51.16 Favored Glycine 0 CA--C 1.523 0.555 0 C-N-CA 124.135 0.874 . . . . 0.0 113.342 -177.757 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 45.9 mt -89.41 171.2 9.91 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 178.375 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -113.41 106.76 14.96 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 105.84 -1.911 . . . . 0.0 105.84 -169.61 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.15 108.53 2.21 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-O 119.399 -0.667 . . . . 0.0 111.755 -174.008 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.22 121.42 41.02 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 172.187 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.1 m -75.26 125.07 28.21 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 168.726 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.7 mt -82.44 160.75 3.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 104.333 -2.469 . . . . 0.0 104.333 146.009 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.49 -46.86 45.52 Favored Glycine 0 CA--C 1.528 0.864 0 O-C-N 121.568 -0.708 . . . . 0.0 113.299 -161.909 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.56 -36.49 18.87 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.89 2.476 . . . . 0.0 111.369 178.812 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -135.21 138.3 43.48 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-O 121.549 0.69 . . . . 0.0 112.107 -153.744 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.8 t -68.7 129.64 40.52 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 118.495 -0.764 . . . . 0.0 111.108 171.642 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -115.95 173.63 6.46 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 105.636 -1.987 . . . . 0.0 105.636 156.073 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -137.0 84.98 2.1 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 125.769 1.628 . . . . 0.0 107.833 -171.327 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.0 m -68.82 151.01 10.44 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.493 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -178.832 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.5 tttp . . . . . 0 N--CA 1.43 -1.453 0 O-C-N 121.37 -0.831 . . . . 0.0 110.628 -165.76 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 59.3 t-20 . . . . . 0 N--CA 1.453 -0.295 0 CA-C-O 120.641 0.258 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 40.2 tp -53.64 -33.81 56.45 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.172 0.989 . . . . 0.0 111.921 -179.608 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.28 -57.77 8.46 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.425 -0.797 . . . . 0.0 110.554 178.693 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -61.88 -42.9 99.62 Favored 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 -178.337 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 38.8 t -48.63 -60.83 2.39 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.045 0.938 . . . . 0.0 108.854 178.832 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -60.72 -34.99 75.22 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -177.425 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.6 tt -63.52 -43.0 98.44 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.42 1.009 . . . . 0.0 110.677 175.237 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.5 t -64.37 -45.68 86.67 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.497 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 63.2 m -63.61 -41.51 98.29 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 -176.642 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.79 -50.18 69.12 Favored 'General case' 0 C--N 1.339 0.11 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 173.486 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.9 m -58.7 -33.35 70.08 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 179.354 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.8 mt -87.22 -4.56 59.1 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.315 0.646 . . . . 0.0 112.177 178.11 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.87 52.52 32.79 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 110.16 -1.176 . . . . 0.0 110.16 -176.921 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 28.2 mt -142.39 174.46 10.61 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 129.895 3.278 . . . . 0.0 107.82 177.552 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.5 tt -130.0 113.92 15.17 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 127.893 2.477 . . . . 0.0 106.715 -172.111 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -77.71 138.09 21.07 Favored Glycine 0 CA--C 1.53 0.984 0 N-CA-C 114.597 0.599 . . . . 0.0 114.597 -168.608 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -117.47 167.49 11.24 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 127.231 2.212 . . . . 0.0 107.868 167.765 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.2 t -112.58 130.8 55.9 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.656 0.782 . . . . 0.0 110.597 173.797 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.5 mt -111.13 163.62 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 C-N-CA 126.914 2.086 . . . . 0.0 106.996 168.111 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -27.07 -63.27 0.08 OUTLIER Glycine 0 CA--C 1.535 1.321 0 C-N-CA 126.228 1.871 . . . . 0.0 116.481 -175.513 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.19 -34.18 22.11 Favored 'General case' 0 N--CA 1.443 -0.776 0 O-C-N 121.063 -1.257 . . . . 0.0 109.345 -178.064 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -147.98 152.59 37.74 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.124 0.57 . . . . 0.0 112.512 -129.357 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.0 t -65.06 144.48 57.23 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.661 1.584 . . . . 0.0 111.504 173.009 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.425 ' CD ' HG13 ' A' ' 29' ' ' VAL . 9.3 tm-20 -114.93 168.71 9.66 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 157.048 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 98.6 m -147.01 84.35 1.59 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 126.081 1.752 . . . . 0.0 110.648 178.497 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.425 HG13 ' CD ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -82.79 158.32 3.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 -174.718 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.1 tptt . . . . . 0 N--CA 1.44 -0.935 0 O-C-N 120.815 -1.178 . . . . 0.0 109.876 165.065 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.0 t30 . . . . . 0 N--CA 1.463 0.203 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 30.6 tp -48.47 -44.73 35.95 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 123.166 0.586 . . . . 0.0 112.291 179.547 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -64.25 -37.34 87.14 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 120.139 -0.624 . . . . 0.0 111.033 -172.452 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.3 tmm? -60.86 -51.06 70.91 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 174.775 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.0 t -57.47 -56.93 15.53 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.88 -175.51 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -45.79 -50.62 13.83 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 126.031 1.732 . . . . 0.0 110.354 171.741 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 31.5 tp -62.49 -30.67 71.44 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 121.768 -0.583 . . . . 0.0 111.518 -177.289 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.3 t -71.73 -56.46 5.75 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 119.004 0.82 . . . . 0.0 109.053 172.014 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.2 m -63.81 -28.36 69.81 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.597 1.559 . . . . 0.0 110.639 -167.442 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.2 ttp85 -41.22 -46.02 3.03 Favored 'General case' 0 C--O 1.226 -0.136 0 C-N-CA 125.927 1.691 . . . . 0.0 110.422 168.333 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.6 m -55.18 -31.12 61.13 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.626 0.648 . . . . 0.0 112.286 -175.431 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.7 mt -106.53 9.48 31.52 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 123.711 0.804 . . . . 0.0 111.074 -178.059 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 56.6 54.57 35.3 Favored Glycine 0 C--N 1.339 0.74 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 -177.575 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 39.0 mt -127.15 140.55 52.18 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 125.393 1.477 . . . . 0.0 108.092 175.576 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.5 tp -72.11 121.42 19.22 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 125.843 1.657 . . . . 0.0 107.043 168.703 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.35 128.76 16.35 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 111.521 -0.631 . . . . 0.0 111.521 -178.645 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -107.91 94.6 5.16 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 126.904 2.082 . . . . 0.0 107.241 177.231 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.1 103.08 4.43 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 172.074 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 22.8 mt -82.74 161.15 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 N-CA-C 104.1 -2.556 . . . . 0.0 104.1 167.402 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -45.46 -47.75 11.88 Favored Glycine 0 CA--C 1.527 0.784 0 O-C-N 122.022 -0.424 . . . . 0.0 112.536 -166.878 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.94 -41.96 20.11 Favored 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 128.202 2.601 . . . . 0.0 109.227 -172.426 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.1 ptpp? -155.87 161.39 40.6 Favored 'General case' 0 C--O 1.227 -0.118 0 CA-C-O 121.246 0.546 . . . . 0.0 112.314 -153.737 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.9 t -88.28 129.89 35.25 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.014 0.926 . . . . 0.0 110.744 179.078 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -117.26 172.43 7.31 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 168.032 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 82.3 m -147.8 100.84 3.26 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.401 1.08 . . . . 0.0 108.78 -169.895 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.8 m -97.22 154.24 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 O-C-N 121.012 -1.055 . . . . 0.0 109.133 176.515 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.5 ttmm . . . . . 0 N--CA 1.443 -0.815 0 O-C-N 121.673 -0.642 . . . . 0.0 109.901 170.648 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.171 0 N-CA-C 106.188 -1.782 . . . . 0.0 106.188 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -69.0 84.77 0.33 Allowed 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 120.64 1.564 . . . . 0.0 107.083 163.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 21.3 t -67.8 107.37 2.58 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 105.201 -2.148 . . . . 0.0 105.201 167.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 -74.22 95.2 2.58 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.966 0.412 . . . . 0.0 110.387 -163.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.6 tp -53.93 -37.03 63.43 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.94 0.896 . . . . 0.0 112.103 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 72.6 ttt-85 -64.61 -48.84 73.42 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 119.62 1.1 . . . . 0.0 109.596 -178.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -61.95 -46.2 90.35 Favored 'General case' 0 N--CA 1.457 -0.117 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.4 t -56.42 -52.52 64.34 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 110.428 -0.212 . . . . 0.0 110.428 -178.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -51.49 -49.95 60.83 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 118.314 -0.851 . . . . 0.0 110.422 173.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.7 tp -58.28 -52.41 65.69 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 119.236 0.925 . . . . 0.0 110.909 -177.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.8 m -64.69 -42.84 95.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.535 0.683 . . . . 0.0 109.458 -172.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.5 m -64.29 -43.1 95.81 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 175.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -66.23 -32.01 73.18 Favored 'General case' 0 C--O 1.226 -0.146 0 N-CA-C 107.165 -1.421 . . . . 0.0 107.165 -170.842 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.0 m -56.37 -33.41 65.69 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.142 0.428 . . . . 0.0 111.162 173.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 40.3 mt -91.86 12.29 22.05 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.9 0.88 . . . . 0.0 110.764 174.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.39 -20.61 36.6 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 125.139 1.352 . . . . 0.0 112.533 -177.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.0 mt -83.47 178.01 8.2 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.389 -1.065 . . . . 0.0 110.294 -152.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 13.3 tp -109.24 94.83 5.25 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 127.983 2.513 . . . . 0.0 107.347 -177.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -64.51 130.5 37.44 Favored Glycine 0 CA--C 1.523 0.534 0 CA-C-O 119.431 -0.65 . . . . 0.0 111.794 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.91 138.68 42.64 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 168.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -111.81 108.02 17.28 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 119.263 -0.399 . . . . 0.0 110.588 -155.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.5 mt -86.17 161.63 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 -172.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -40.07 -49.97 3.52 Favored Glycine 0 CA--C 1.525 0.682 0 C-N-CA 125.283 1.421 . . . . 0.0 113.908 -172.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.74 -46.21 14.57 Favored 'General case' 0 N--CA 1.44 -0.941 0 C-N-CA 126.137 1.775 . . . . 0.0 108.875 -176.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -156.68 159.73 38.67 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -156.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 18.0 t -71.59 141.51 50.03 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.92 0.888 . . . . 0.0 111.173 175.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -127.67 172.6 10.63 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 167.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 57.5 m -145.01 97.36 3.0 Favored 'General case' 0 C--N 1.334 -0.068 0 C-N-CA 126.443 1.897 . . . . 0.0 107.241 -167.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -74.94 164.62 3.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 169.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 29.2 tttt -84.74 -76.68 0.3 Allowed 'General case' 0 N--CA 1.436 -1.147 0 O-C-N 121.342 -0.849 . . . . 0.0 110.196 178.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 21.9 m170 -80.25 162.13 24.78 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.355 0.843 0 O-C-N 123.891 0.744 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.128 0 N-CA-C 105.747 -1.946 . . . . 0.0 105.747 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 51.8 t80 67.86 -56.89 0.47 Allowed 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 119.537 1.062 . . . . 0.0 109.365 -157.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.5 t -61.69 128.78 37.9 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 162.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -129.2 117.81 21.35 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 127.13 2.172 . . . . 0.0 107.335 -158.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 45.7 tp -46.08 -47.25 17.2 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 124.567 1.147 . . . . 0.0 112.084 174.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.1 ttm180 -60.19 -46.78 88.55 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.771 0.319 . . . . 0.0 110.22 -169.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 16.8 tmm? -67.9 -45.73 73.61 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 123.288 0.635 . . . . 0.0 109.342 175.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.1 t -53.97 -42.69 69.24 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.658 0.742 . . . . 0.0 111.231 -175.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -51.1 -33.73 27.4 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.918 1.287 . . . . 0.0 112.636 173.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.1 tt -71.57 -46.35 59.66 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 123.886 0.874 . . . . 0.0 109.295 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.2 m -64.56 -53.28 50.32 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -176.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 97.2 m -64.8 -28.4 69.54 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.9 1.28 . . . . 0.0 110.943 -174.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.1 ttm105 -59.03 -20.16 50.56 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 117.938 -1.03 . . . . 0.0 111.123 177.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.6 p -50.53 -47.88 57.36 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 120.112 1.324 . . . . 0.0 110.899 175.158 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 81.9 mt -100.03 22.34 11.42 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.58 0.752 . . . . 0.0 109.424 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.12 20.25 60.22 Favored Glycine 0 C--N 1.334 0.463 0 C-N-CA 123.873 0.749 . . . . 0.0 113.042 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 33.5 mt -84.72 145.46 27.92 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.6 tt -76.68 97.85 4.57 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 105.237 -2.135 . . . . 0.0 105.237 175.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.5 148.12 48.03 Favored Glycine 0 N--CA 1.451 -0.359 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.715 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.443 ' NZ ' ' OE2' ' A' ' 27' ' ' GLU . 14.8 tptp -165.38 94.39 0.62 Allowed 'General case' 0 N--CA 1.425 -1.696 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 -140.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 28.7 t -74.53 116.62 15.42 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 120.243 -1.536 . . . . 0.0 110.973 -176.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 11.6 mm -84.68 161.24 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 162.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -25.31 -69.27 0.04 OUTLIER Glycine 0 CA--C 1.529 0.91 0 C-N-CA 125.886 1.708 . . . . 0.0 114.291 -169.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.73 -44.0 12.9 Favored 'General case' 0 N--CA 1.443 -0.78 0 C-N-CA 127.995 2.518 . . . . 0.0 108.928 179.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.1 mttm -108.78 129.38 55.38 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.006 0.522 . . . . 0.0 109.64 -151.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.3 t -65.04 118.91 9.83 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 164.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.443 ' OE2' ' NZ ' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -120.74 172.2 8.05 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 179.445 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 24.6 m -146.38 114.28 6.51 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 -165.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.5 m -103.03 145.46 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 171.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.7 tttm -82.46 80.4 8.63 Favored 'General case' 0 N--CA 1.437 -1.111 0 O-C-N 121.134 -0.979 . . . . 0.0 109.722 -178.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 72.43 -65.67 0.34 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.769 1.628 . . . . 0.0 109.668 175.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.067 0 O-C-N 124.281 0.988 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.045 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -75.14 63.21 1.28 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 120.137 1.335 . . . . 0.0 111.066 -178.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 47.4 t -71.89 89.3 1.07 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 176.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 64.3 t-20 -74.28 85.39 1.92 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.119 0.485 . . . . 0.0 110.363 -170.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.5 tp -49.63 -38.36 31.73 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.895 1.278 . . . . 0.0 112.148 176.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -64.54 -49.8 69.84 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.388 -0.82 . . . . 0.0 109.91 -177.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.3 tmt? -65.42 -46.29 80.56 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.4 t -46.53 -50.81 16.64 Favored 'General case' 0 C--O 1.226 -0.139 0 C-N-CA 123.53 0.732 . . . . 0.0 109.846 178.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -58.27 -37.08 74.27 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 123.773 0.829 . . . . 0.0 112.94 177.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.8 tp -66.39 -45.73 79.02 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 119.799 1.181 . . . . 0.0 110.708 176.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.43 -45.49 87.3 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.3 m -63.45 -42.06 98.65 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.29 -31.91 70.7 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.5 m -71.52 -18.77 62.25 Favored 'General case' 0 N--CA 1.454 -0.273 0 O-C-N 121.111 -0.993 . . . . 0.0 113.298 176.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 46.0 mt -93.85 6.21 49.14 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.892 0.877 . . . . 0.0 110.686 165.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.15 9.08 87.23 Favored Glycine 0 CA--C 1.527 0.822 0 O-C-N 120.743 -1.223 . . . . 0.0 113.126 -177.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 33.7 mt -105.15 148.92 26.36 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.267 1.427 . . . . 0.0 111.431 -171.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -79.6 124.09 28.21 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 127.145 2.178 . . . . 0.0 107.264 171.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -87.94 131.07 10.42 Favored Glycine 0 CA--C 1.525 0.711 0 CA-C-N 118.052 0.387 . . . . 0.0 112.945 -177.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -113.43 166.03 11.89 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 128.147 2.579 . . . . 0.0 109.09 175.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 33.4 t -119.4 130.18 55.18 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 169.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 4.5 mt -105.18 161.61 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 N-CA-C 105.804 -1.924 . . . . 0.0 105.804 161.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -46.33 -43.53 14.41 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 123.754 0.692 . . . . 0.0 113.531 -173.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -75.05 -47.0 31.12 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 126.383 1.873 . . . . 0.0 108.873 -175.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -156.51 164.01 38.72 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -153.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 14.7 t -64.73 138.0 58.13 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.617 1.167 . . . . 0.0 109.406 164.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.16 170.1 8.53 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 164.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 77.2 m -145.5 124.77 12.97 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 178.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.3 m -128.73 150.11 34.09 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.566 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 172.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -72.44 125.0 26.33 Favored 'General case' 0 N--CA 1.436 -1.142 0 O-C-N 120.732 -1.23 . . . . 0.0 111.598 -168.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 48.5 m80 -37.54 145.17 0.07 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.463 1.505 . . . . 0.0 111.403 169.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 0.995 0 O-C-N 123.917 0.761 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.977 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -67.42 -46.62 72.61 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 160.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -63.65 132.61 51.64 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 168.394 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -98.56 119.24 36.94 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 126.23 1.812 . . . . 0.0 108.494 171.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.6 tp -59.2 -35.33 73.41 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.82 0.848 . . . . 0.0 112.204 -179.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -56.08 24.08 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 121.15 -0.969 . . . . 0.0 110.551 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 15.6 tmm? -54.58 -45.7 73.6 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 177.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.8 t -57.65 -57.52 12.38 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.85 -174.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 89.8 mt-30 -58.9 -40.06 83.33 Favored 'General case' 0 N--CA 1.447 -0.579 0 O-C-N 122.09 -0.381 . . . . 0.0 110.737 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -57.13 -40.13 76.54 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 121.626 -0.671 . . . . 0.0 110.972 176.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.4 t -68.15 -51.67 43.36 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 176.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 81.6 m -64.15 -29.4 70.52 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.485 1.114 . . . . 0.0 110.82 -171.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.16 -46.37 12.01 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.512 1.125 . . . . 0.0 109.505 169.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -56.91 -28.29 61.78 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.105 0.411 . . . . 0.0 112.102 -175.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 mt -105.33 5.86 32.24 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 124.088 0.955 . . . . 0.0 111.15 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 56.2 52.59 48.54 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 -176.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 38.3 mt -126.75 142.27 51.59 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 125.415 1.486 . . . . 0.0 108.056 175.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.0 tt -76.39 109.64 10.26 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 105.704 -1.961 . . . . 0.0 105.704 170.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -68.27 134.07 28.75 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 177.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.47 165.39 21.71 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 167.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.7 t -132.07 102.98 6.03 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 122.075 -0.391 . . . . 0.0 110.013 -157.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 46.6 mt -82.99 161.31 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 N-CA-C 104.657 -2.349 . . . . 0.0 104.657 175.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -40.31 -55.6 3.01 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 123.966 0.793 . . . . 0.0 112.577 -166.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.03 -44.51 15.13 Favored 'General case' 0 N--CA 1.439 -0.988 0 C-N-CA 128.411 2.684 . . . . 0.0 107.697 -176.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -122.79 127.96 49.8 Favored 'General case' 0 C--N 1.334 -0.08 0 C-N-CA 124.037 0.935 . . . . 0.0 110.181 -145.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.6 t -64.62 140.89 58.91 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 161.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -140.29 172.09 13.23 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 106.857 -1.535 . . . . 0.0 106.857 167.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 65.7 m -145.83 108.69 4.54 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 -162.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.2 m -110.16 146.67 15.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 123.706 0.802 . . . . 0.0 109.727 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.6 tttp -85.65 50.06 1.89 Allowed 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 120.955 -1.091 . . . . 0.0 109.667 176.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -72.38 75.54 1.02 Allowed 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.402 1.081 . . . . 0.0 108.407 -178.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 1.009 0 O-C-N 124.334 1.021 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.746 0 N-CA-C 104.954 -2.239 . . . . 0.0 104.954 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.28 -52.43 52.85 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 157.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 44.8 t -66.04 124.38 22.4 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 174.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -108.65 114.69 28.7 Favored 'General case' 0 C--N 1.333 -0.119 0 C-N-CA 125.84 1.656 . . . . 0.0 107.583 169.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 38.4 tp -58.31 -38.48 77.18 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.414 0.686 . . . . 0.0 111.9 -178.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -51.33 69.52 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.555 0.616 . . . . 0.0 110.008 -178.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.0 -49.76 75.74 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.4 t -50.75 -52.71 37.94 Favored 'General case' 0 N--CA 1.46 0.055 0 CA-C-O 121.791 0.805 . . . . 0.0 110.337 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -60.19 -39.3 86.04 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 123.176 0.59 . . . . 0.0 111.284 177.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 40.5 tp -60.32 -43.24 96.54 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 121.676 -0.64 . . . . 0.0 111.204 176.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.78 -44.74 84.88 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.26 -0.9 . . . . 0.0 109.779 175.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 70.9 m -64.07 -36.04 82.7 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.538 0.335 . . . . 0.0 110.316 -173.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.4 ttt85 -45.13 -37.07 4.07 Favored 'General case' 0 C--N 1.341 0.211 0 C-N-CA 124.237 1.015 . . . . 0.0 111.163 170.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.3 t -55.81 -33.07 64.11 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.699 0.681 . . . . 0.0 111.027 -175.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.0 mt -107.64 15.38 24.75 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.778 0.831 . . . . 0.0 110.615 178.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.26 24.97 66.03 Favored Glycine 0 CA--C 1.524 0.624 0 O-C-N 121.387 -0.821 . . . . 0.0 113.152 -178.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 57.6 mt -98.81 162.37 13.14 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 123.78 0.832 . . . . 0.0 109.505 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 tt -105.51 104.43 14.16 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.99 1.716 . . . . 0.0 107.687 -174.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.96 123.79 31.02 Favored Glycine 0 CA--C 1.524 0.641 0 CA-C-O 119.306 -0.719 . . . . 0.0 112.148 -178.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.458 ' NZ ' ' OE1' ' A' ' 27' ' ' GLU . 2.2 pptp? -135.77 130.82 34.66 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 170.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 21.6 t -102.48 119.91 39.63 Favored 'General case' 0 N--CA 1.461 0.079 0 N-CA-C 112.486 0.551 . . . . 0.0 112.486 -166.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 13.5 mt -84.11 66.99 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.58 0 C-N-CA 125.591 1.556 . . . . 0.0 106.838 176.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.14 -84.1 0.51 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 125.524 1.535 . . . . 0.0 110.339 174.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.06 -45.44 18.31 Favored 'General case' 0 N--CA 1.44 -0.938 0 C-N-CA 125.61 1.564 . . . . 0.0 107.186 175.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.4 mttp -95.23 115.88 28.01 Favored 'General case' 0 C--O 1.227 -0.094 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 -155.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 20.1 t -64.53 119.05 9.72 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 165.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.458 ' OE1' ' NZ ' ' A' ' 20' ' ' LYS . 1.3 tm-20 -109.18 173.8 6.16 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 165.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 99.0 m -145.75 83.37 1.65 Allowed 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.616 1.567 . . . . 0.0 107.524 -167.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 12.4 m -76.46 144.25 12.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 C-N-CA 119.489 -0.884 . . . . 0.0 109.058 -173.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -81.18 94.41 6.65 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 175.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 10.8 t-160 -72.72 -118.52 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 160.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 0.979 0 O-C-N 123.25 0.344 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.559 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -72.31 104.84 3.85 Favored 'General case' 0 C--N 1.334 -0.078 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 172.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.2 t -83.58 83.96 7.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.989 0.423 . . . . 0.0 111.111 -173.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -73.3 90.67 1.65 Allowed 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 169.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 35.7 tp -50.04 -35.77 26.27 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.77 1.228 . . . . 0.0 112.112 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.7 mmm-85 -67.45 -46.1 74.05 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.253 -178.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -62.91 -46.61 87.02 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 35.9 t -47.84 -52.66 18.21 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 121.714 0.769 . . . . 0.0 109.783 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -61.04 -32.8 72.41 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 123.65 0.78 . . . . 0.0 112.242 177.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 37.2 tp -66.4 -44.06 84.09 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.805 1.184 . . . . 0.0 111.126 175.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.31 -43.29 95.17 Favored 'General case' 0 C--N 1.332 -0.189 0 O-C-N 120.997 -1.064 . . . . 0.0 108.875 176.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 65.2 m -64.38 -40.63 96.21 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.952 -0.547 . . . . 0.0 109.576 -177.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.6 ttt85 -47.56 -49.49 26.37 Favored 'General case' 0 C--N 1.343 0.29 0 CA-C-N 119.261 0.937 . . . . 0.0 109.961 168.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.9 m -59.77 -31.25 69.5 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.837 -0.125 . . . . 0.0 110.917 -175.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 53.6 mt -89.61 -1.88 58.15 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.697 0.799 . . . . 0.0 112.304 175.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.13 28.89 70.98 Favored Glycine 0 CA--C 1.526 0.765 0 O-C-N 120.657 -1.277 . . . . 0.0 112.511 -177.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 52.2 mt -117.64 177.43 4.76 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 126.797 2.039 . . . . 0.0 108.474 -179.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -122.02 111.43 17.03 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 126.961 2.105 . . . . 0.0 107.445 -171.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -73.28 119.65 6.77 Favored Glycine 0 CA--C 1.523 0.534 0 CA-C-O 119.321 -0.711 . . . . 0.0 111.589 -174.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -137.19 149.39 47.2 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 170.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -123.88 121.02 34.26 Favored 'General case' 0 N--CA 1.462 0.126 0 O-C-N 121.327 -0.858 . . . . 0.0 112.978 -159.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.1 mm -84.5 67.03 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 175.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.08 -88.06 0.19 Allowed Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 126.539 2.019 . . . . 0.0 110.674 173.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.56 -29.83 56.81 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 107.664 -1.235 . . . . 0.0 107.664 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.7 mttp -108.7 108.05 18.74 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.238 1.015 . . . . 0.0 109.789 -159.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.3 t -64.09 131.59 47.99 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 165.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -132.54 172.97 11.82 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 106.033 -1.839 . . . . 0.0 106.033 166.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 79.6 m -131.42 88.38 2.58 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 126.789 2.036 . . . . 0.0 106.157 -170.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.5 m -71.54 164.82 3.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 107.267 -1.383 . . . . 0.0 107.267 173.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.4 tptp -65.56 -52.28 53.55 Favored 'General case' 0 N--CA 1.433 -1.322 0 O-C-N 120.778 -1.201 . . . . 0.0 110.476 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 30.6 m80 -140.99 164.15 31.05 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 106.857 -1.535 . . . . 0.0 106.857 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.355 0.827 0 O-C-N 124.187 0.929 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.942 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -145.05 -39.24 0.26 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 124.625 1.17 . . . . 0.0 112.604 -161.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 t -64.29 127.22 30.54 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.677 0.791 . . . . 0.0 110.557 -170.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -100.56 108.74 20.74 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 108.512 -0.922 . . . . 0.0 108.512 175.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 44.1 tp -34.96 -53.42 0.57 Allowed 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 125.235 1.414 . . . . 0.0 114.672 -171.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 76.1 mtm180 -45.99 -47.42 16.72 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-N 118.358 0.526 . . . . 0.0 111.813 -176.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 49.8 ttm -63.75 -53.41 51.47 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 -176.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.8 t -49.83 -54.69 17.77 Favored 'General case' 0 C--O 1.231 0.087 0 CA-C-O 121.593 0.711 . . . . 0.0 110.705 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -49.48 -51.54 35.39 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 125.401 1.481 . . . . 0.0 110.324 176.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 47.2 tp -61.5 -47.78 84.05 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.092 0.557 . . . . 0.0 111.051 -177.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 p -64.52 -47.53 78.49 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -175.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.418 ' SG ' ' HA2' ' A' ' 19' ' ' GLY . 72.1 m -64.41 -39.84 94.62 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -178.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.48 -38.76 75.06 Favored 'General case' 0 C--O 1.228 -0.074 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.8 m -63.61 -28.51 69.97 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.063 -0.398 . . . . 0.0 111.591 178.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 43.0 mt -88.24 3.52 49.16 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.889 0.876 . . . . 0.0 111.302 171.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 69.92 29.59 70.76 Favored Glycine 0 C--N 1.336 0.533 0 O-C-N 120.988 -1.07 . . . . 0.0 112.227 -177.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 70.6 mt -118.37 152.69 35.35 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 125.917 1.687 . . . . 0.0 109.064 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.0 tp -85.93 96.73 9.9 Favored 'General case' 0 N--CA 1.442 -0.835 0 C-N-CA 127.067 2.147 . . . . 0.0 106.86 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.418 ' HA2' ' SG ' ' A' ' 12' ' ' CYS . . . -65.91 114.4 6.56 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.483 -0.865 . . . . 0.0 111.264 -178.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.64 112.77 25.28 Favored 'General case' 0 N--CA 1.438 -1.072 0 N-CA-C 104.881 -2.266 . . . . 0.0 104.881 173.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.6 t -77.15 113.15 14.58 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 124.378 1.071 . . . . 0.0 109.29 177.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 30.1 mm -84.49 159.79 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 160.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -49.18 -48.2 32.73 Favored Glycine 0 C--O 1.224 -0.488 0 CA-C-O 121.982 0.768 . . . . 0.0 112.96 -159.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.2 -36.42 18.0 Favored 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 130.225 3.41 . . . . 0.0 115.964 177.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.0 tptt -133.93 129.5 36.4 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 -161.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.3 t -68.48 126.64 30.29 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 118.171 -0.919 . . . . 0.0 109.767 170.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -108.94 172.12 7.03 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 105.679 -1.971 . . . . 0.0 105.679 163.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.0 m -145.04 84.67 1.72 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 -168.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -70.07 172.1 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.2 mttt -84.75 155.83 21.69 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.308 -1.495 . . . . 0.0 111.557 -172.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -32.62 90.53 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.188 1.395 . . . . 0.0 109.713 154.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 0.953 0 O-C-N 124.189 0.931 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.633 0 N-CA-C 104.673 -2.343 . . . . 0.0 104.673 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -63.27 -58.81 5.93 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 154.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.1 t -63.84 136.29 57.28 Favored 'General case' 0 C--O 1.239 0.544 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 176.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -98.7 110.47 23.06 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 126.374 1.87 . . . . 0.0 108.201 175.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 45.0 tp -51.07 -43.84 61.07 Favored 'General case' 0 C--O 1.223 -0.297 0 C-N-CA 123.829 0.852 . . . . 0.0 112.16 177.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 63.8 ttp85 -62.83 -42.86 99.9 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.95 0.796 . . . . 0.0 110.717 -172.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 13.5 tmm? -61.7 -49.6 75.82 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 174.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.3 t -55.0 -52.02 64.42 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.911 -175.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -50.61 -55.06 18.04 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.06 1.344 . . . . 0.0 110.772 172.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 tp -56.72 -38.35 72.22 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.2 m -71.55 -53.4 13.92 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.11 0.481 . . . . 0.0 109.738 -178.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.3 m -64.35 -27.58 69.11 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 124.413 1.085 . . . . 0.0 110.663 -174.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 44.9 ttt180 -52.75 -25.47 11.28 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.217 -0.896 . . . . 0.0 111.273 173.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.6 p -50.38 -43.16 54.32 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 120.221 1.373 . . . . 0.0 111.29 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.7 mt -102.87 18.79 20.68 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.107 0.963 . . . . 0.0 110.132 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.21 31.25 72.79 Favored Glycine 0 CA--C 1.522 0.503 0 O-C-N 121.632 -0.668 . . . . 0.0 112.866 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 65.7 mt -98.43 139.16 34.59 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.784 0.833 . . . . 0.0 108.823 178.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 39.2 tp -63.59 108.31 1.36 Allowed 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 165.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.22 129.09 22.96 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 108.925 -1.67 . . . . 0.0 108.925 167.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.57 153.54 48.69 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 174.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.2 t -128.96 100.83 5.81 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -146.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 53.7 mt -83.72 161.02 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 N-CA-C 105.383 -2.08 . . . . 0.0 105.383 173.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -40.87 -55.31 3.39 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 124.289 0.947 . . . . 0.0 112.854 -163.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.83 -43.91 12.9 Favored 'General case' 0 N--CA 1.438 -1.034 0 C-N-CA 127.234 2.214 . . . . 0.0 109.63 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -115.31 125.97 53.9 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.182 0.593 . . . . 0.0 109.791 -151.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.1 t -73.12 129.31 37.78 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 163.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -118.94 172.5 7.5 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 171.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.0 m -143.54 126.14 15.94 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 106.332 -1.729 . . . . 0.0 106.332 -173.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.4 m -135.53 152.99 32.44 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-N 118.423 0.556 . . . . 0.0 109.514 175.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 38.2 tttm -76.3 141.64 41.56 Favored 'General case' 0 N--CA 1.436 -1.157 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 174.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.4 m80 70.81 -63.94 0.39 Allowed 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 125.046 1.338 . . . . 0.0 109.925 -176.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.079 0 O-C-N 124.401 1.063 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.529 0 CA-C-O 116.77 -1.586 . . . . 0.0 108.021 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -176.31 -49.99 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 119.821 1.191 . . . . 0.0 110.423 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.4 t -64.42 114.04 4.05 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.014 0.926 . . . . 0.0 112.337 -164.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -75.81 112.26 12.01 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 159.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 48.9 tp -48.6 -42.45 34.0 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.535 1.134 . . . . 0.0 113.342 178.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.18 -54.11 48.43 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 118.81 0.732 . . . . 0.0 109.848 -178.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -60.47 -44.53 95.79 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.5 t -51.38 -57.55 8.65 Favored 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 121.543 0.687 . . . . 0.0 109.866 177.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -61.66 -34.82 76.4 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-O 117.984 -1.008 . . . . 0.0 111.458 -178.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 44.1 tp -63.0 -45.14 93.83 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.89 1.223 . . . . 0.0 110.637 175.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.0 m -64.89 -47.35 78.13 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -178.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.8 m -64.03 -43.82 94.41 Favored 'General case' 0 CA--C 1.535 0.365 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 -178.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -44.91 -53.61 7.41 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 125.688 1.595 . . . . 0.0 109.538 168.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 12.8 m -54.98 -44.21 74.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 118.235 0.47 . . . . 0.0 111.111 178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.4 mt -75.28 -7.41 53.85 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.399 0.68 . . . . 0.0 112.454 177.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.97 43.84 25.81 Favored Glycine 0 C--N 1.334 0.457 0 CA-C-O 122.174 0.874 . . . . 0.0 111.298 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 54.1 mt -136.55 157.39 46.88 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 126.418 1.887 . . . . 0.0 108.403 -177.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 46.1 tp -90.78 108.01 19.56 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.67 1.988 . . . . 0.0 107.224 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.33 136.05 27.96 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.657 -0.782 . . . . 0.0 111.716 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 pptp? -134.57 153.47 51.94 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 166.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.6 t -134.08 96.87 3.72 Favored 'General case' 0 CA--C 1.518 -0.271 0 O-C-N 121.972 -0.455 . . . . 0.0 111.297 -154.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 6.2 mt -86.56 65.46 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 -177.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.72 -73.33 0.25 Allowed Glycine 0 CA--C 1.528 0.877 0 C-N-CA 124.374 0.988 . . . . 0.0 112.633 172.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.89 -49.96 7.47 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 126.217 1.807 . . . . 0.0 110.808 165.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -88.88 99.55 12.48 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -160.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 33.8 t -63.48 132.03 50.05 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 106.949 -1.501 . . . . 0.0 106.949 161.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -128.39 171.73 11.77 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 104.646 -2.353 . . . . 0.0 104.646 174.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -146.3 86.44 1.69 Allowed 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 -169.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -71.94 163.62 3.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 178.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.0 ttmm -95.67 -22.43 17.57 Favored 'General case' 0 N--CA 1.437 -1.122 0 O-C-N 121.476 -0.765 . . . . 0.0 111.318 174.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 13.5 m170 -127.1 147.54 50.17 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 -173.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.356 0.85 0 O-C-N 124.12 0.888 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.513 0 N-CA-C 105.358 -2.09 . . . . 0.0 105.358 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -150.77 -59.99 0.18 Allowed 'General case' 0 CA--C 1.533 0.321 0 O-C-N 124.088 0.867 . . . . 0.0 111.456 -156.475 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.9 t -64.57 110.87 2.47 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -163.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -75.18 84.07 2.37 Favored 'General case' 0 CA--C 1.527 0.08 0 O-C-N 121.466 -0.771 . . . . 0.0 109.688 173.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.1 tp -35.99 -48.2 0.57 Allowed 'General case' 0 C--O 1.224 -0.275 0 C-N-CA 125.782 1.633 . . . . 0.0 113.768 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 70.4 mtm180 -55.34 -48.68 73.83 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 122.163 -0.336 . . . . 0.0 111.045 -176.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -65.41 -50.19 66.41 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 45.7 t -47.27 -52.67 15.47 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 121.646 0.736 . . . . 0.0 110.464 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -51.82 -47.09 64.49 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 124.121 0.968 . . . . 0.0 111.609 177.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 37.1 tp -67.27 -48.6 67.22 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 122.611 0.364 . . . . 0.0 110.186 -176.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.7 m -64.16 -41.03 97.31 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -174.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.0 m -64.92 -46.57 81.09 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 176.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.3 ttp-105 -58.12 -34.45 70.24 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 121.933 -0.48 . . . . 0.0 109.91 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.9 m -57.49 -29.46 64.29 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.679 0.672 . . . . 0.0 111.546 177.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 57.7 mt -99.9 14.48 30.3 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.185 0.994 . . . . 0.0 110.825 176.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.04 7.99 68.13 Favored Glycine 0 CA--C 1.527 0.811 0 O-C-N 120.996 -1.065 . . . . 0.0 113.235 -178.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 32.1 mt -92.05 145.22 24.69 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 122.179 0.99 . . . . 0.0 109.798 -175.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.5 tp -76.41 107.6 8.79 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 125.37 1.468 . . . . 0.0 107.193 170.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -90.2 138.26 14.4 Favored Glycine 0 C--N 1.331 0.29 0 CA-C-O 118.902 -0.944 . . . . 0.0 111.838 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.94 159.38 38.04 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 173.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 95.9 m -83.44 126.59 32.92 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 121.199 -0.938 . . . . 0.0 110.921 -176.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 14.8 mm -85.03 162.01 3.0 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 152.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -39.24 -56.72 2.26 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 124.921 1.248 . . . . 0.0 113.738 -171.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.37 -43.07 15.08 Favored 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 124.79 1.236 . . . . 0.0 108.606 -179.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.6 mttm -118.5 151.67 37.41 Favored 'General case' 0 C--O 1.223 -0.299 0 C-N-CA 123.106 0.562 . . . . 0.0 110.902 -151.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.9 t -66.54 131.24 45.59 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 154.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -104.18 167.35 9.81 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 105.534 -2.025 . . . . 0.0 105.534 164.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 66.7 m -141.12 114.18 8.54 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 103.696 -2.705 . . . . 0.0 103.696 168.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.0 m -108.67 152.23 10.71 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.681 0 N-CA-C 106.519 -1.659 . . . . 0.0 106.519 168.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.07 122.7 22.21 Favored 'General case' 0 N--CA 1.432 -1.375 0 O-C-N 120.959 -1.088 . . . . 0.0 110.305 -173.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 24.8 t-80 -52.5 160.38 0.86 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.012 1.325 . . . . 0.0 111.593 174.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 0.988 0 O-C-N 123.675 0.609 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.338 0 N-CA-C 106.039 -1.837 . . . . 0.0 106.039 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 44.4 t80 70.67 -53.26 0.66 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 120.651 1.569 . . . . 0.0 110.477 -170.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.7 t -61.91 123.24 17.51 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 106.361 -1.718 . . . . 0.0 106.361 168.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -93.83 130.44 39.86 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 123.732 0.813 . . . . 0.0 108.94 -176.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 31.7 tp -58.95 -45.39 90.57 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.541 0.337 . . . . 0.0 111.39 -173.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -61.99 -42.71 99.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 -176.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -58.37 -52.24 66.42 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 52.9 t -53.32 -55.92 20.89 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.652 -176.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -55.81 -46.59 78.0 Favored 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 124.318 1.047 . . . . 0.0 111.767 177.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.0 tt -56.78 -42.07 78.78 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 121.754 -0.591 . . . . 0.0 110.4 178.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 m -66.8 -50.39 62.8 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.4 m -63.52 -33.41 75.53 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.914 1.285 . . . . 0.0 109.616 -173.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.46 -26.75 21.57 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.517 1.527 . . . . 0.0 110.502 177.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.0 m -53.63 -36.92 62.56 Favored 'General case' 0 C--O 1.225 -0.198 0 O-C-N 121.025 -1.047 . . . . 0.0 112.961 175.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 mt -111.99 22.61 14.67 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.125 0.57 . . . . 0.0 109.929 179.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 58.47 26.33 59.33 Favored Glycine 0 CA--C 1.526 0.773 0 CA-C-O 122.04 0.8 . . . . 0.0 113.084 -179.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.4 mt -92.95 156.65 16.78 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 122.064 0.935 . . . . 0.0 108.766 178.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 tt -98.7 95.89 7.55 Favored 'General case' 0 N--CA 1.441 -0.921 0 C-N-CA 129.346 3.058 . . . . 0.0 106.514 -170.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.42 131.19 29.53 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.522 -0.847 . . . . 0.0 111.909 -177.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.44 ' NZ ' ' OE1' ' A' ' 27' ' ' GLU . 13.0 pttp -135.51 134.95 40.03 Favored 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 159.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 57.2 m -74.93 114.64 13.63 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 174.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 24.4 mt -83.44 162.57 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 N-CA-C 105.26 -2.126 . . . . 0.0 105.26 166.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -34.85 -57.3 0.79 Allowed Glycine 0 CA--C 1.525 0.674 0 C-N-CA 125.27 1.414 . . . . 0.0 112.987 -166.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.46 -43.21 19.19 Favored 'General case' 0 N--CA 1.442 -0.827 0 C-N-CA 127.837 2.455 . . . . 0.0 109.82 -172.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.22 164.35 38.92 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -160.233 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.6 t -64.96 133.14 51.11 Favored 'General case' 0 C--N 1.333 -0.114 0 C-N-CA 124.008 0.923 . . . . 0.0 110.225 174.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.44 ' OE1' ' NZ ' ' A' ' 20' ' ' LYS . 5.1 tm-20 -118.38 170.94 8.5 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 106.472 -1.677 . . . . 0.0 106.472 161.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 94.9 m -146.12 82.81 1.61 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 -168.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -72.69 150.47 8.3 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 -176.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 28.6 ttpt -81.3 150.35 28.54 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 118.895 -1.122 . . . . 0.0 111.854 -164.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 50.9 m-70 68.48 66.82 0.32 Allowed 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 125.271 1.428 . . . . 0.0 109.34 -177.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.363 1.175 0 O-C-N 124.464 1.103 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.537 0 N-CA-C 104.79 -2.3 . . . . 0.0 104.79 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -143.93 -48.52 0.28 Allowed 'General case' 0 C--N 1.333 -0.142 0 O-C-N 124.551 1.157 . . . . 0.0 109.828 -155.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.0 t -63.15 122.52 16.31 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 120.343 -0.543 . . . . 0.0 109.68 177.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 64.9 t-20 -74.87 76.08 2.14 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.154 0.582 . . . . 0.0 109.652 -176.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 32.7 tp -44.48 -45.19 9.05 Favored 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 124.485 1.114 . . . . 0.0 111.648 -179.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 69.2 ttp85 -56.79 -49.68 74.6 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 122.352 0.261 . . . . 0.0 111.338 -177.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -69.21 -49.31 57.6 Favored 'General case' 0 C--O 1.225 -0.21 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.7 t -46.23 -51.04 15.09 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 124.244 1.017 . . . . 0.0 110.595 -175.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -55.05 -45.02 75.22 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.77 -179.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 32.0 tp -70.11 -47.3 62.4 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.141 0.576 . . . . 0.0 109.79 -174.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.3 p -64.18 -45.82 86.71 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 -176.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.0 m -64.34 -40.31 95.63 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.2 ttp-105 -62.54 -41.75 99.08 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 -178.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.5 m -57.32 -35.04 69.36 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.188 0.449 . . . . 0.0 111.422 175.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.6 mt -85.08 5.18 30.75 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.598 0.759 . . . . 0.0 111.669 176.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 61.54 47.17 92.17 Favored Glycine 0 C--N 1.334 0.461 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 23.5 mt -131.46 148.88 52.68 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 126.507 1.923 . . . . 0.0 108.582 175.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.8 tp -82.16 107.13 14.62 Favored 'General case' 0 N--CA 1.44 -0.938 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 171.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.03 129.71 29.63 Favored Glycine 0 N--CA 1.451 -0.307 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 178.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.17 131.32 40.28 Favored 'General case' 0 N--CA 1.44 -0.969 0 N-CA-C 105.427 -2.064 . . . . 0.0 105.427 176.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 m -80.27 133.28 35.97 Favored 'General case' 0 CA--C 1.515 -0.373 0 O-C-N 121.084 -1.01 . . . . 0.0 109.734 177.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.9 mm -84.34 160.44 3.36 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.683 0 N-CA-C 104.324 -2.473 . . . . 0.0 104.324 149.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.21 -47.78 41.43 Favored Glycine 0 CA--C 1.528 0.862 0 O-C-N 121.449 -0.782 . . . . 0.0 112.355 -171.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.93 -44.65 47.44 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 127.034 2.134 . . . . 0.0 107.765 -172.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -155.01 152.99 30.31 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-O 121.529 0.68 . . . . 0.0 110.883 -151.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.9 t -70.93 140.78 51.07 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 124.348 1.059 . . . . 0.0 111.182 -178.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -128.23 171.97 11.47 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 106.53 -1.655 . . . . 0.0 106.53 163.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 86.4 m -146.08 102.38 3.62 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 -170.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 16.2 m -89.03 166.81 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 172.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm -77.88 162.33 26.92 Favored 'General case' 0 N--CA 1.44 -0.963 0 O-C-N 120.752 -1.218 . . . . 0.0 108.941 172.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 22.4 m170 -61.42 89.09 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.247 0.619 . . . . 0.0 109.343 -176.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 1.004 0 O-C-N 124.413 1.071 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.851 0 CA-C-O 116.472 -1.728 . . . . 0.0 108.388 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -137.34 136.15 37.68 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 120.331 1.423 . . . . 0.0 107.695 -175.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.4 t -127.86 127.77 44.03 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 118.489 0.586 . . . . 0.0 110.663 -157.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 62.7 t-20 -74.72 85.5 2.15 Favored 'General case' 0 N--CA 1.463 0.203 0 O-C-N 121.631 -0.668 . . . . 0.0 109.416 179.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.9 tp -48.11 -43.77 31.25 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.702 0.801 . . . . 0.0 111.969 176.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -66.12 -45.78 79.88 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.859 -0.526 . . . . 0.0 110.297 -172.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -60.13 -49.16 78.74 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 175.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.1 t -51.0 -54.43 24.61 Favored 'General case' 0 CA--C 1.523 -0.077 0 CA-C-O 121.309 0.576 . . . . 0.0 110.787 -176.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -53.83 -47.29 71.08 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 124.45 1.1 . . . . 0.0 110.801 176.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 41.9 tp -60.74 -42.75 97.99 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 119.178 -0.439 . . . . 0.0 111.61 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.91 -51.0 52.87 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 119.1 0.864 . . . . 0.0 109.611 179.079 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.1 m -63.58 -31.8 73.08 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 124.101 0.96 . . . . 0.0 109.018 -171.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 45.9 ttt180 -49.25 -29.89 6.41 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 118.356 -0.831 . . . . 0.0 111.942 172.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 80.1 p -52.68 -40.71 63.16 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 120.175 1.352 . . . . 0.0 111.483 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.4 mt -104.5 21.35 16.9 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.826 0.85 . . . . 0.0 109.953 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.2 33.71 86.82 Favored Glycine 0 C--N 1.335 0.509 0 CA-C-O 122.209 0.894 . . . . 0.0 111.882 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.9 mt -102.39 132.34 48.46 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-O 121.866 0.841 . . . . 0.0 109.373 -178.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 31.3 tp -68.01 94.61 0.5 Allowed 'General case' 0 N--CA 1.442 -0.867 0 C-N-CA 125.668 1.587 . . . . 0.0 106.955 170.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.47 123.7 29.84 Favored Glycine 0 N--CA 1.448 -0.535 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 170.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.2 143.62 46.5 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 106.789 -1.56 . . . . 0.0 106.789 173.35 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.8 t -129.29 96.36 4.28 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 -145.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.4 mt -83.06 159.87 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 N-CA-C 104.109 -2.552 . . . . 0.0 104.109 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -46.31 -49.9 14.1 Favored Glycine 0 CA--C 1.53 0.972 0 CA-C-O 122.504 1.058 . . . . 0.0 113.45 -162.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.47 -24.24 24.19 Favored 'General case' 0 N--CA 1.438 -1.051 0 C-N-CA 130.814 3.646 . . . . 0.0 115.241 -177.115 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.5 mmtm -138.91 118.16 12.71 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.049 0.94 . . . . 0.0 112.402 -170.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.2 t -64.29 124.46 21.79 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 155.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -117.67 172.05 7.62 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 105.832 -1.914 . . . . 0.0 105.832 171.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.0 m -142.56 98.75 3.36 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.751 1.62 . . . . 0.0 107.655 -172.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -83.04 173.26 0.96 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 172.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 2.7 ttmp? -79.75 140.2 37.01 Favored 'General case' 0 N--CA 1.444 -0.762 0 O-C-N 119.975 -1.703 . . . . 0.0 109.913 170.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -48.43 -39.56 23.15 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.542 0.61 . . . . 0.0 111.018 169.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 1.002 0 O-C-N 122.736 0.023 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.25 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 4.4 m-85 62.52 31.03 17.18 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 119.364 0.984 . . . . 0.0 113.35 173.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.1 t -64.97 133.77 52.45 Favored 'General case' 0 C--O 1.234 0.24 0 O-C-N 121.936 -0.478 . . . . 0.0 109.747 176.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 63.8 t-20 -74.64 83.69 2.07 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 122.112 0.958 . . . . 0.0 108.891 178.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 24.2 tp -56.44 -34.89 67.27 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.201 -0.909 . . . . 0.0 111.642 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.71 -48.79 79.14 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.875 0.761 . . . . 0.0 110.739 177.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -58.38 -49.28 77.82 Favored 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 109.047 -0.724 . . . . 0.0 109.047 177.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.6 t -51.52 -52.75 44.31 Favored 'General case' 0 C--O 1.227 -0.116 0 CA-C-O 121.022 0.439 . . . . 0.0 110.542 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -52.37 -48.46 65.58 Favored 'General case' 0 N--CA 1.444 -0.759 0 C-N-CA 123.129 0.572 . . . . 0.0 111.481 175.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.0 tp -63.1 -49.6 73.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.436 0.562 . . . . 0.0 111.197 -176.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.1 m -64.71 -42.37 95.31 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 121.376 -0.828 . . . . 0.0 109.695 -177.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 87.2 m -63.9 -42.85 97.34 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.3 ttt85 -54.86 -46.91 74.76 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.0 m -58.24 -35.18 71.32 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 117.949 0.34 . . . . 0.0 111.05 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.5 mt -84.92 1.73 45.98 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.543 0.737 . . . . 0.0 111.851 176.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.97 47.7 64.31 Favored Glycine 0 C--N 1.334 0.422 0 O-C-N 120.71 -1.244 . . . . 0.0 110.148 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.9 mt -136.49 177.69 7.65 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 128.13 2.572 . . . . 0.0 107.48 176.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -125.13 110.76 14.5 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 126.29 1.836 . . . . 0.0 106.914 -175.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -73.46 123.59 8.38 Favored Glycine 0 N--CA 1.449 -0.491 0 CA-C-O 119.451 -0.639 . . . . 0.0 112.445 -173.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.4 ' NZ ' ' OE1' ' A' ' 27' ' ' GLU . 1.9 pptp? -134.99 133.48 39.5 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 106.006 -1.85 . . . . 0.0 106.006 167.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 30.2 t -103.78 136.84 42.71 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -165.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 23.2 mt -97.85 163.33 2.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 C-N-CA 125.68 1.592 . . . . 0.0 107.274 176.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -12.55 -70.55 0.01 OUTLIER Glycine 0 CA--C 1.532 1.141 0 C-N-CA 127.839 2.638 . . . . 0.0 116.352 -176.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.92 -47.9 9.22 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 126.639 1.976 . . . . 0.0 108.927 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -136.93 149.39 47.55 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.969 0.89 . . . . 0.0 113.159 -146.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.5 t -64.87 139.59 58.78 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.161 1.784 . . . . 0.0 111.307 -178.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.4 ' OE1' ' NZ ' ' A' ' 20' ' ' LYS . 4.0 tm-20 -122.95 172.76 8.25 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 105.241 -2.133 . . . . 0.0 105.241 160.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 94.4 m -145.87 83.69 1.65 Allowed 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 -164.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 31.4 m -72.28 157.17 6.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -177.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 43.9 tptt -85.09 67.11 10.07 Favored 'General case' 0 N--CA 1.437 -1.082 0 O-C-N 121.35 -0.844 . . . . 0.0 112.368 -167.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 26.13 49.44 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.873 2.469 . . . . 0.0 114.696 157.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 0.941 0 O-C-N 123.874 0.734 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.565 0 N-CA-C 103.629 -2.73 . . . . 0.0 103.629 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 37.7 p90 44.87 -178.43 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.703 0 O-C-N 125.888 1.992 . . . . 0.0 111.2 -131.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.6 t -66.17 114.82 5.57 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 123.478 0.711 . . . . 0.0 111.106 -178.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -74.58 98.98 3.5 Favored 'General case' 0 C--N 1.333 -0.111 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 170.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.8 tp -50.48 -37.05 36.59 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.965 0.906 . . . . 0.0 112.333 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -67.38 -52.08 44.31 Favored 'General case' 0 N--CA 1.454 -0.226 0 O-C-N 121.358 -0.839 . . . . 0.0 110.506 -176.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -61.61 -42.98 99.64 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 28.2 t -50.76 -57.44 8.34 Favored 'General case' 0 CA--C 1.523 -0.083 0 CA-C-O 121.487 0.66 . . . . 0.0 109.226 177.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -60.99 -37.33 82.1 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 122.827 0.451 . . . . 0.0 111.93 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 31.2 tp -60.93 -43.03 99.19 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.095 0.861 . . . . 0.0 110.468 176.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.5 m -67.1 -44.78 79.09 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.8 m -63.77 -41.24 98.0 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -177.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -47.81 -30.93 4.4 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 125.315 1.446 . . . . 0.0 111.164 172.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.0 t -51.69 -44.3 63.07 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.696 1.135 . . . . 0.0 109.825 -177.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 57.5 mt -108.69 25.22 11.99 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.97 0.908 . . . . 0.0 110.266 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 61.01 27.16 66.7 Favored Glycine 0 CA--C 1.526 0.753 0 CA-C-O 121.858 0.699 . . . . 0.0 113.386 177.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.8 mt -91.64 172.24 8.63 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 123.897 0.879 . . . . 0.0 109.391 177.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.1 tt -126.2 97.64 5.16 Favored 'General case' 0 N--CA 1.445 -0.699 0 C-N-CA 127.292 2.237 . . . . 0.0 106.269 -161.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.32 125.06 11.56 Favored Glycine 0 CA--C 1.526 0.763 0 CA-C-N 115.053 -0.976 . . . . 0.0 112.581 -168.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.5 mtpm? -124.73 120.0 30.53 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 126.134 1.774 . . . . 0.0 107.925 177.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.0 m -74.78 130.53 39.64 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 6.2 mt -111.73 66.42 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.727 0 C-N-CA 125.391 1.476 . . . . 0.0 107.54 169.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.99 -88.8 0.48 Allowed Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 126.429 1.966 . . . . 0.0 110.319 173.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.74 -45.25 21.58 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 176.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.9 mttp -88.99 157.09 18.5 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.25 0.62 . . . . 0.0 109.714 -162.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.7 t -101.81 123.82 46.41 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 164.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -104.88 170.2 8.01 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 106.489 -1.671 . . . . 0.0 106.489 167.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 92.2 m -149.57 85.12 1.43 Allowed 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.943 1.697 . . . . 0.0 110.253 -169.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.6 m -76.23 166.09 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 O-C-N 120.69 -1.256 . . . . 0.0 110.294 177.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.4 mtmt -79.49 160.65 26.47 Favored 'General case' 0 N--CA 1.439 -0.979 0 O-C-N 121.145 -0.972 . . . . 0.0 111.797 -174.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 64.9 t-80 58.41 61.8 2.16 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.884 1.274 . . . . 0.0 109.405 -178.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.083 0 O-C-N 124.167 0.917 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.177 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -75.23 71.81 2.27 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 119.605 1.093 . . . . 0.0 110.084 -178.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 40.9 t -64.89 127.75 32.9 Favored 'General case' 0 C--N 1.333 -0.126 0 O-C-N 121.928 -0.482 . . . . 0.0 110.372 178.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 61.3 t-20 -74.66 86.18 2.14 Favored 'General case' 0 CA--C 1.529 0.15 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 176.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 36.2 tp -53.87 -37.4 63.67 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.676 0.79 . . . . 0.0 111.601 176.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.62 -49.19 78.73 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-N 118.722 0.692 . . . . 0.0 109.917 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -59.21 -52.35 66.08 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 178.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.7 t -51.95 -50.06 61.94 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 122.023 0.916 . . . . 0.0 110.852 -176.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -54.42 -46.87 73.28 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.395 176.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.92 -49.76 71.38 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.084 0.554 . . . . 0.0 111.493 -177.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.6 p -64.55 -42.27 95.79 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.44 -0.787 . . . . 0.0 109.222 -176.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 72.1 m -63.78 -42.97 97.65 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 177.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.01 -42.43 94.27 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 -178.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.9 m -55.88 -43.51 77.25 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 120.82 -1.175 . . . . 0.0 111.232 175.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.9 mt -72.91 -4.71 33.69 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 122.751 0.42 . . . . 0.0 111.648 175.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.02 14.84 82.21 Favored Glycine 0 CA--C 1.524 0.625 0 O-C-N 121.184 -0.947 . . . . 0.0 111.866 -178.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 24.0 mt -100.76 -179.73 4.16 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 125.884 1.674 . . . . 0.0 107.884 177.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -121.62 104.39 9.59 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 -171.007 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -77.15 130.77 10.65 Favored Glycine 0 C--N 1.332 0.351 0 CA-C-O 119.428 -0.651 . . . . 0.0 113.239 -170.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.88 130.76 27.8 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 106.474 -1.676 . . . . 0.0 106.474 168.228 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.6 t -99.71 124.96 45.47 Favored 'General case' 0 CA--C 1.518 -0.271 0 O-C-N 121.933 -0.479 . . . . 0.0 111.125 -174.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.6 mt -84.85 161.98 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 172.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -45.57 -36.23 6.03 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.444 1.021 . . . . 0.0 114.195 -177.024 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.71 -57.83 3.67 Favored 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 127.933 2.493 . . . . 0.0 107.872 -179.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.65 155.9 30.85 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -152.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 43.5 t -66.59 133.03 49.47 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 124.15 0.98 . . . . 0.0 110.877 171.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.9 172.08 9.67 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 164.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 76.8 m -145.81 89.98 1.95 Allowed 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 126.507 1.923 . . . . 0.0 106.31 -167.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.6 m -70.19 146.81 11.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 174.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.9 ttpp -90.12 68.14 7.07 Favored 'General case' 0 N--CA 1.435 -1.215 0 O-C-N 121.37 -0.832 . . . . 0.0 111.137 -164.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -103.31 48.83 0.84 Allowed 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 161.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 0.98 0 O-C-N 124.326 1.016 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.763 0 N-CA-C 105.956 -1.868 . . . . 0.0 105.956 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -65.02 156.95 29.71 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 120.217 1.372 . . . . 0.0 107.667 162.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.0 t -64.69 109.46 2.03 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.108 0.48 . . . . 0.0 110.033 176.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -74.64 99.89 3.79 Favored 'General case' 0 C--N 1.334 -0.088 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 170.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 56.0 tp -39.51 -46.91 1.8 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.784 1.634 . . . . 0.0 113.291 174.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.8 ttt85 -64.02 -44.45 92.54 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 119.006 0.821 . . . . 0.0 109.797 -174.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -61.75 -48.25 81.52 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 174.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 54.1 t -53.16 -55.06 27.13 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.834 0.826 . . . . 0.0 109.582 -176.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 60.3 mm-40 -57.24 -46.15 83.27 Favored 'General case' 0 N--CA 1.44 -0.958 0 O-C-N 121.888 -0.508 . . . . 0.0 110.888 178.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 46.6 tp -62.74 -46.45 88.02 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.686 0.675 . . . . 0.0 111.482 -176.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.4 p -64.98 -45.13 86.93 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -178.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 88.4 m -62.95 -42.8 99.93 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -41.53 77.3 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 177.128 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.9 m -68.54 -27.21 65.89 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 177.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 69.1 mt -80.18 -3.85 50.66 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.545 0.612 . . . . 0.0 111.534 167.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 75.32 29.13 60.61 Favored Glycine 0 C--N 1.337 0.591 0 CA-C-N 119.299 0.954 . . . . 0.0 111.444 -177.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 30.8 mt -123.55 -176.44 3.45 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.847 2.059 . . . . 0.0 108.17 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.9 tp -135.45 113.95 11.65 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 126.193 1.797 . . . . 0.0 107.992 -166.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -67.14 144.76 45.22 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 121.441 -0.409 . . . . 0.0 112.997 -165.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -127.99 87.11 2.56 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 128.16 2.584 . . . . 0.0 105.375 171.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -78.28 98.11 5.8 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 123.602 0.761 . . . . 0.0 110.728 -176.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 64.4 mt -87.96 161.34 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 N-CA-C 106.703 -1.592 . . . . 0.0 106.703 164.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.36 -53.53 23.8 Favored Glycine 0 CA--C 1.523 0.544 0 O-C-N 121.989 -0.444 . . . . 0.0 113.293 -166.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.4 -26.13 26.61 Favored 'General case' 0 N--CA 1.441 -0.877 0 C-N-CA 124.859 1.263 . . . . 0.0 110.435 179.702 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.4 mttp -129.02 110.47 12.08 Favored 'General case' 0 C--O 1.226 -0.14 0 C-N-CA 123.368 0.667 . . . . 0.0 110.162 -156.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 31.6 t -76.42 117.67 18.32 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 164.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -103.49 170.95 7.64 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 171.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.8 m -148.48 84.67 1.49 Allowed 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.669 1.588 . . . . 0.0 109.165 -171.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.7 m -70.7 154.84 7.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 C-N-CA 118.941 -1.104 . . . . 0.0 109.306 178.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -82.84 75.22 9.75 Favored 'General case' 0 N--CA 1.436 -1.134 0 O-C-N 121.368 -0.832 . . . . 0.0 109.671 -178.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 23.8 t-80 48.76 -106.93 0.2 Allowed 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.729 1.612 . . . . 0.0 110.093 -177.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 0.965 0 O-C-N 123.605 0.566 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.875 0 CA-C-O 116.033 -1.937 . . . . 0.0 105.997 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 50.6 t80 61.78 -71.78 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 120.091 1.314 . . . . 0.0 107.615 -153.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.3 t -62.62 107.45 0.95 Allowed 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 164.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 32.9 t-20 -96.15 129.22 43.51 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 103.415 -2.809 . . . . 0.0 103.415 145.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 39.0 tp -51.68 -39.46 58.29 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 118.535 0.607 . . . . 0.0 110.305 177.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -61.25 -38.54 87.04 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-O 118.584 -0.722 . . . . 0.0 112.143 176.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 58.5 ttp -63.94 -49.96 70.56 Favored 'General case' 0 CA--C 1.528 0.101 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 179.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 43.1 t -52.95 -54.75 30.38 Favored 'General case' 0 C--O 1.226 -0.182 0 CA-C-O 121.289 0.566 . . . . 0.0 110.07 179.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -61.84 -35.9 79.63 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-O 118.554 -0.736 . . . . 0.0 112.519 -179.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.6 tt -63.82 -43.84 95.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 119.605 1.093 . . . . 0.0 109.535 176.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.3 t -64.37 -48.76 74.26 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 -178.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.8 m -63.42 -42.52 98.71 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 -177.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -39.1 68.02 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 124.253 1.021 . . . . 0.0 108.644 176.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.4 m -68.93 -25.12 64.42 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.637 -0.665 . . . . 0.0 112.66 177.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.7 mt -89.02 -0.02 57.07 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.682 0.793 . . . . 0.0 111.743 168.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.84 35.06 65.78 Favored Glycine 0 CA--C 1.525 0.682 0 O-C-N 121.24 -0.912 . . . . 0.0 112.646 -177.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 35.3 mt -129.1 172.82 11.03 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 126.496 1.918 . . . . 0.0 109.72 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.0 tp -116.44 110.93 19.29 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 126.574 1.95 . . . . 0.0 109.228 -171.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -74.48 132.06 13.98 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 114.336 0.494 . . . . 0.0 114.336 -169.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? -124.38 108.99 12.76 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 126.448 1.899 . . . . 0.0 107.429 171.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.5 t -76.01 112.5 12.5 Favored 'General case' 0 C--N 1.332 -0.152 0 O-C-N 122.038 -0.414 . . . . 0.0 111.242 -178.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.2 mm -88.46 65.92 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 C-N-CA 125.565 1.546 . . . . 0.0 107.676 177.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.62 -88.12 0.17 Allowed Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 125.829 1.68 . . . . 0.0 110.791 175.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.29 -42.98 34.82 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 106.352 -1.722 . . . . 0.0 106.352 178.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -102.38 162.93 12.53 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.507 1.123 . . . . 0.0 108.799 -159.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.2 t -112.02 122.36 47.56 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 175.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -104.58 169.84 8.23 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 106.19 -1.781 . . . . 0.0 106.19 167.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 90.2 m -149.11 85.18 1.46 Allowed 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.867 1.667 . . . . 0.0 110.167 -167.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.2 m -76.43 148.61 6.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 O-C-N 120.876 -1.14 . . . . 0.0 110.601 -178.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -92.04 61.88 4.11 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -61.57 -28.72 69.54 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 119.378 -0.344 . . . . 0.0 110.773 -175.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 0.967 0 O-C-N 123.612 0.57 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 116.506 -1.711 . . . . 0.0 106.655 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 54.92 47.76 21.5 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 119.294 0.952 . . . . 0.0 111.099 171.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.3 t -66.52 117.03 8.14 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.278 -0.419 . . . . 0.0 109.901 -179.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -99.3 104.08 15.96 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 169.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 49.5 tp -39.54 -46.26 1.71 Allowed 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 125.691 1.596 . . . . 0.0 113.453 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.72 -52.5 59.91 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.492 0.717 . . . . 0.0 111.815 178.161 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -63.31 -47.36 82.58 Favored 'General case' 0 N--CA 1.457 -0.079 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 178.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 34.8 t -49.78 -56.51 10.05 Favored 'General case' 0 C--O 1.224 -0.287 0 O-C-N 123.856 0.722 . . . . 0.0 109.713 -178.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -57.01 -45.09 83.31 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 124.346 1.059 . . . . 0.0 112.468 -179.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.3 tt -60.65 -44.75 96.04 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.582 0.706 . . . . 0.0 109.972 179.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.7 m -64.52 -45.6 86.5 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 97.7 m -63.15 -41.41 99.26 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 -176.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.18 -36.62 82.46 Favored 'General case' 0 C--O 1.228 -0.064 0 N-CA-C 106.938 -1.504 . . . . 0.0 106.938 -178.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 13.2 m -70.59 -14.87 62.66 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 177.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.6 mt -98.07 5.13 49.01 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.444 0.698 . . . . 0.0 110.644 168.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.05 21.01 79.28 Favored Glycine 0 CA--C 1.526 0.78 0 O-C-N 120.782 -1.199 . . . . 0.0 112.168 -177.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.1 mt -112.33 -177.7 3.23 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.122 1.769 . . . . 0.0 108.365 177.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -140.95 105.78 4.94 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 -163.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.17 134.6 25.15 Favored Glycine 0 CA--C 1.528 0.844 0 C-N-CA 121.335 -0.46 . . . . 0.0 113.866 -166.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 11.9 mptt -117.21 165.63 13.2 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 127.374 2.27 . . . . 0.0 105.587 161.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 50.8 t -150.37 104.94 3.28 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.244 -0.91 . . . . 0.0 110.515 -169.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.4 mt -87.08 161.36 2.87 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 N-CA-C 105.449 -2.056 . . . . 0.0 105.449 162.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -45.32 -49.94 10.3 Favored Glycine 0 CA--C 1.527 0.785 0 CA-C-O 122.236 0.909 . . . . 0.0 114.119 -170.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.05 -33.33 22.5 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 124.182 0.993 . . . . 0.0 109.587 -177.204 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 37.3 mttp -119.3 116.21 25.76 Favored 'General case' 0 N--CA 1.462 0.15 0 C-N-CA 125.033 1.333 . . . . 0.0 111.258 -157.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 20.3 t -66.51 127.03 30.76 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 155.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -105.54 169.09 8.67 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 105.379 -2.082 . . . . 0.0 105.379 165.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 87.9 m -148.7 84.09 1.47 Allowed 'General case' 0 C--O 1.233 0.212 0 C-N-CA 124.904 1.282 . . . . 0.0 109.335 -177.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -71.41 146.78 11.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 O-C-N 121.175 -0.953 . . . . 0.0 108.905 -177.453 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? -84.71 71.35 10.83 Favored 'General case' 0 N--CA 1.441 -0.876 0 O-C-N 120.854 -1.154 . . . . 0.0 112.606 -160.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 46.9 t-80 -152.1 47.07 0.77 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.584 0.754 . . . . 0.0 110.102 178.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.359 0.981 0 O-C-N 123.493 0.496 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.153 0 CA-C-O 116.37 -1.776 . . . . 0.0 106.247 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -68.61 85.77 0.3 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 120.687 1.585 . . . . 0.0 107.24 164.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 18.4 t -67.28 110.97 3.74 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 105.735 -1.95 . . . . 0.0 105.735 168.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 51.3 t-20 -74.51 85.5 2.04 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.739 0.304 . . . . 0.0 110.594 -166.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 43.5 tp -51.71 -38.27 54.46 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 124.466 1.106 . . . . 0.0 111.494 -178.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 40.8 mtp85 -58.24 -52.3 66.14 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 64.6 ttp -64.3 -49.7 70.76 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 -179.17 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.3 t -49.9 -52.77 30.45 Favored 'General case' 0 C--N 1.334 -0.067 0 C-N-CA 123.008 0.523 . . . . 0.0 110.261 -176.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -69.21 -15.52 63.4 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 42.8 tp -80.54 -52.47 7.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 119.817 1.19 . . . . 0.0 109.36 168.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.1 p -63.91 -41.45 97.67 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.604 -0.685 . . . . 0.0 109.432 -172.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 83.5 m -64.07 -40.23 95.81 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 176.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.7 ttm105 -65.28 -35.64 81.64 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -175.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.2 m -55.82 -33.05 64.09 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.536 0.607 . . . . 0.0 111.562 172.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 42.5 mt -90.69 6.76 42.69 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.795 0.838 . . . . 0.0 111.302 177.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.16 19.7 78.69 Favored Glycine 0 CA--C 1.526 0.754 0 O-C-N 121.32 -0.863 . . . . 0.0 113.299 -178.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 37.3 mt -111.75 170.1 8.37 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.743 1.217 . . . . 0.0 109.976 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -115.61 104.16 11.43 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 126.252 1.821 . . . . 0.0 107.89 -170.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.59 128.92 38.94 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-N 116.477 -0.329 . . . . 0.0 113.061 -173.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.2 mtpm? -121.11 116.44 24.99 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 106.549 -1.648 . . . . 0.0 106.549 166.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -94.44 100.67 12.63 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 117.896 0.316 . . . . 0.0 110.148 -169.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 20.2 mt -90.25 162.29 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 -171.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -39.93 -49.59 3.41 Favored Glycine 0 CA--C 1.525 0.704 0 C-N-CA 125.162 1.363 . . . . 0.0 113.854 -171.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.21 -42.24 14.88 Favored 'General case' 0 N--CA 1.439 -1.003 0 C-N-CA 125.782 1.633 . . . . 0.0 107.518 -171.318 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.0 mtmm -156.23 159.86 39.3 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.985 0.914 . . . . 0.0 111.531 -153.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.7 t -79.32 125.19 29.18 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.07 169.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -105.41 170.78 7.68 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 167.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 81.3 m -148.57 84.89 1.49 Allowed 'General case' 0 C--O 1.232 0.155 0 C-N-CA 125.115 1.366 . . . . 0.0 110.59 -167.398 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 28.4 m -76.08 144.72 11.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 O-C-N 120.945 -1.097 . . . . 0.0 111.281 -175.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt -89.21 69.66 8.26 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 173.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -50.65 -36.65 36.59 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.781 0.832 . . . . 0.0 112.475 -166.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 0.953 0 O-C-N 123.823 0.702 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.421 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -125.9 84.48 2.28 Favored 'General case' 0 N--CA 1.457 -0.083 0 C-N-CA 124.065 0.946 . . . . 0.0 108.57 -176.167 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 41.9 t -64.65 126.52 28.17 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 123.426 0.691 . . . . 0.0 112.377 -172.896 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 55.3 t-20 -74.34 83.12 1.91 Allowed 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 167.106 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 49.3 tp -51.51 -36.8 46.23 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.935 0.894 . . . . 0.0 111.034 178.604 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.74 -52.38 65.75 Favored 'General case' 0 N--CA 1.458 -0.073 0 CA-C-N 118.776 0.717 . . . . 0.0 110.222 179.36 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 15.5 tmm? -64.32 -46.16 84.72 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -178.405 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 11.4 t -49.79 -57.64 6.95 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 177.565 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -58.79 -40.99 85.64 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-O 118.522 -0.751 . . . . 0.0 112.078 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.9 tt -60.64 -43.66 97.31 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.605 1.093 . . . . 0.0 110.015 178.149 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.1 t -64.07 -46.48 84.15 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 -178.242 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 74.8 m -63.23 -45.86 89.66 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -176.755 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -38.97 67.51 Favored 'General case' 0 C--N 1.332 -0.164 0 C-N-CA 125.339 1.456 . . . . 0.0 108.817 177.702 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.1 m -67.51 -19.02 65.26 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 178.951 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 60.8 mt -101.13 9.21 42.25 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.837 0.855 . . . . 0.0 111.039 169.538 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 70.28 23.11 77.59 Favored Glycine 0 CA--C 1.526 0.756 0 O-C-N 120.878 -1.139 . . . . 0.0 112.779 -179.476 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 18.7 mt -109.11 175.46 5.45 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 125.562 1.545 . . . . 0.0 108.868 178.302 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.7 tt -126.82 102.86 7.22 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.983 1.713 . . . . 0.0 107.057 -167.917 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -62.84 120.19 20.42 Favored Glycine 0 CA--C 1.529 0.951 0 O-C-N 122.104 -0.373 . . . . 0.0 112.499 -174.811 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.4 tptt -122.17 106.29 11.02 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 104.521 -2.4 . . . . 0.0 104.521 174.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 5.1 t -110.76 124.87 52.82 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.704 0.684 . . . . 0.0 111.534 -170.213 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 22.2 mt -91.34 162.67 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 105.874 -1.899 . . . . 0.0 105.874 168.162 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -5.8 -81.04 0.01 OUTLIER Glycine 0 CA--C 1.532 1.135 0 C-N-CA 127.209 2.337 . . . . 0.0 115.441 -175.043 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.54 -38.78 16.87 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 128.496 2.718 . . . . 0.0 113.919 167.153 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.5 tmtt? -85.38 100.53 11.9 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.879 1.271 . . . . 0.0 110.433 -156.941 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 40.4 t -66.64 119.05 11.09 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.048 0.939 . . . . 0.0 110.513 166.018 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.62 171.52 7.32 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 104.802 -2.296 . . . . 0.0 104.802 161.503 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 94.0 m -145.95 83.2 1.63 Allowed 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.234 -2.135 . . . . 0.0 105.234 -177.694 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 25.3 m -73.53 144.24 12.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 C-N-CA 119.33 -0.948 . . . . 0.0 108.949 -177.455 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.6 ttpp -95.94 123.45 39.54 Favored 'General case' 0 N--CA 1.435 -1.218 0 CA-C-O 118.202 -0.904 . . . . 0.0 111.568 -159.755 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -79.56 -122.13 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.707 0.685 . . . . 0.0 109.454 165.775 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.358 0.962 0 O-C-N 123.463 0.477 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.816 0 N-CA-C 104.604 -2.369 . . . . 0.0 104.604 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 27.7 t80 59.68 -80.17 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -148.698 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.3 t -63.5 128.11 34.35 Favored 'General case' 0 C--O 1.24 0.593 0 O-C-N 121.655 -0.653 . . . . 0.0 109.443 177.589 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -93.74 89.98 6.39 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.186 1.394 . . . . 0.0 108.227 -174.472 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 28.1 tp -53.61 -33.81 56.26 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.396 1.078 . . . . 0.0 111.817 179.434 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -68.73 -46.68 68.27 Favored 'General case' 0 N--CA 1.453 -0.277 0 O-C-N 121.393 -0.817 . . . . 0.0 110.27 -176.76 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 13.3 tmm? -69.1 -44.61 72.12 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 176.694 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 23.3 t -50.7 -55.43 16.59 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 123.889 0.876 . . . . 0.0 110.08 -177.839 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -55.51 -39.42 70.48 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 178.97 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 39.8 tp -67.06 -44.83 79.1 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.972 -0.455 . . . . 0.0 110.618 -179.575 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 10.1 t -63.65 -44.97 92.27 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 -179.206 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 88.6 m -62.82 -43.65 98.25 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 -177.47 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.8 tpt85 -57.99 -44.49 87.19 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 177.722 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -55.86 -44.51 78.12 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 118.01 0.368 . . . . 0.0 110.039 177.732 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.8 mt -74.95 -3.33 31.57 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.284 0.634 . . . . 0.0 111.6 178.563 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 74.11 40.19 43.1 Favored Glycine 0 C--N 1.333 0.415 0 CA-C-O 122.313 0.952 . . . . 0.0 110.775 179.292 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 16.8 mt -131.37 -174.26 3.35 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 127.987 2.515 . . . . 0.0 107.303 177.363 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 47.9 tp -145.82 117.18 7.95 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 125.945 1.698 . . . . 0.0 107.517 -168.103 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.68 162.97 49.47 Favored Glycine 0 CA--C 1.533 1.186 0 N-CA-C 115.535 0.974 . . . . 0.0 115.535 -161.829 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -145.04 166.64 24.76 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 127.91 2.484 . . . . 0.0 106.902 157.802 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -121.54 120.35 34.6 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 121.465 -0.772 . . . . 0.0 109.524 177.681 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 56.7 mt -84.49 163.33 2.82 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 156.961 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -39.87 -59.01 2.14 Favored Glycine 0 CA--C 1.529 0.919 0 C-N-CA 124.468 1.033 . . . . 0.0 114.013 -171.556 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.83 -33.59 45.89 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.449 1.5 . . . . 0.0 108.596 -177.261 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.4 ttpm? -140.77 124.15 16.75 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.724 0.297 . . . . 0.0 111.011 -130.717 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.5 t -65.03 134.01 52.91 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.173 0.989 . . . . 0.0 110.5 173.248 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.3 tm-20 -106.31 166.5 10.48 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 105.544 -2.021 . . . . 0.0 105.544 164.314 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 84.2 m -149.74 84.97 1.41 Allowed 'General case' 0 C--O 1.235 0.315 0 C-N-CA 125.474 1.51 . . . . 0.0 110.598 -178.691 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.0 m -71.13 157.46 6.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 178.541 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.76 -44.62 85.32 Favored 'General case' 0 N--CA 1.441 -0.884 0 O-C-N 120.592 -1.318 . . . . 0.0 109.837 174.53 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -155.67 -22.81 0.11 Allowed 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 160.079 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.078 0 CA-C-N 116.043 -0.526 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.552 0 CA-C-O 116.001 -1.952 . . . . 0.0 107.648 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -168.73 32.87 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.871 1.214 . . . . 0.0 112.048 176.528 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 26.1 t -68.83 115.46 8.18 Favored 'General case' 0 C--N 1.331 -0.199 0 O-C-N 120.956 -1.09 . . . . 0.0 110.063 177.311 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -74.12 95.74 2.61 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 174.851 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 34.8 tp -50.46 -36.71 34.72 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 124.659 1.184 . . . . 0.0 112.352 177.718 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.17 -48.85 69.38 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 121.209 -0.932 . . . . 0.0 109.238 -177.906 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 12.2 tmm? -55.11 -48.25 73.87 Favored 'General case' 0 C--N 1.335 -0.049 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 174.281 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.8 t -56.73 -58.34 8.5 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.271 0.557 . . . . 0.0 110.518 -175.793 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -49.77 -45.76 49.96 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 125.08 1.352 . . . . 0.0 110.822 175.728 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.4 tp -63.46 -42.4 98.62 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 121.627 -0.671 . . . . 0.0 110.989 -177.576 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.7 t -64.62 -51.99 59.79 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 107.697 -1.223 . . . . 0.0 107.697 178.43 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 71.8 m -64.13 -34.36 77.89 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 123.944 0.898 . . . . 0.0 110.147 -170.713 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -47.04 -37.96 10.2 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 123.592 0.757 . . . . 0.0 111.216 170.402 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.3 t -56.2 -34.6 66.42 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.671 0.669 . . . . 0.0 110.742 -176.467 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 68.7 mt -104.34 15.18 28.79 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.675 0.79 . . . . 0.0 110.647 177.58 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 59.77 19.98 51.16 Favored Glycine 0 CA--C 1.523 0.555 0 C-N-CA 124.135 0.874 . . . . 0.0 113.342 -177.757 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 45.9 mt -89.41 171.2 9.91 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 178.375 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -113.41 106.76 14.96 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 105.84 -1.911 . . . . 0.0 105.84 -169.61 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.15 108.53 2.21 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-O 119.399 -0.667 . . . . 0.0 111.755 -174.008 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.22 121.42 41.02 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 172.187 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.1 m -75.26 125.07 28.21 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 168.726 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 47.7 mt -82.44 160.75 3.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 104.333 -2.469 . . . . 0.0 104.333 146.009 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -50.49 -46.86 45.52 Favored Glycine 0 CA--C 1.528 0.864 0 O-C-N 121.568 -0.708 . . . . 0.0 113.299 -161.909 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -86.56 -36.49 18.87 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.89 2.476 . . . . 0.0 111.369 178.812 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -135.21 138.3 43.48 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-O 121.549 0.69 . . . . 0.0 112.107 -153.744 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.8 t -68.7 129.64 40.52 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 118.495 -0.764 . . . . 0.0 111.108 171.642 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -115.95 173.63 6.46 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 105.636 -1.987 . . . . 0.0 105.636 156.073 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 72.3 m -137.0 84.98 2.1 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 125.769 1.628 . . . . 0.0 107.833 -171.327 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.0 m -68.82 151.01 10.44 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.493 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -178.832 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.5 tttp -87.43 84.1 7.22 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 121.37 -0.831 . . . . 0.0 110.628 -165.76 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 75.21 -65.62 0.33 Allowed 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.724 1.61 . . . . 0.0 109.675 170.483 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.361 1.102 0 O-C-N 124.431 1.082 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.941 0 CA-C-O 116.575 -1.679 . . . . 0.0 106.978 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -75.09 68.33 1.87 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 120.401 1.455 . . . . 0.0 109.135 174.598 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.0 t -79.61 73.49 6.3 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 121.572 0.701 . . . . 0.0 109.207 179.333 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 59.3 t-20 -74.51 85.68 2.05 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 121.837 -0.54 . . . . 0.0 110.392 -168.742 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 40.2 tp -53.64 -33.81 56.45 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.172 0.989 . . . . 0.0 111.921 -179.608 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.28 -57.77 8.46 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.425 -0.797 . . . . 0.0 110.554 178.693 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.0 tmm? -61.88 -42.9 99.62 Favored 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 -178.337 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 38.8 t -48.63 -60.83 2.39 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.045 0.938 . . . . 0.0 108.854 178.832 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -60.72 -34.99 75.22 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -177.425 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 8.6 tt -63.52 -43.0 98.44 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.42 1.009 . . . . 0.0 110.677 175.237 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.5 t -64.37 -45.68 86.67 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 179.497 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 63.2 m -63.61 -41.51 98.29 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 -176.642 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.79 -50.18 69.12 Favored 'General case' 0 C--N 1.339 0.11 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 173.486 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.9 m -58.7 -33.35 70.08 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 179.354 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.8 mt -87.22 -4.56 59.1 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.315 0.646 . . . . 0.0 112.177 178.11 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.87 52.52 32.79 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 110.16 -1.176 . . . . 0.0 110.16 -176.921 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 28.2 mt -142.39 174.46 10.61 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 129.895 3.278 . . . . 0.0 107.82 177.552 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 2.5 tt -130.0 113.92 15.17 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 127.893 2.477 . . . . 0.0 106.715 -172.111 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -77.71 138.09 21.07 Favored Glycine 0 CA--C 1.53 0.984 0 N-CA-C 114.597 0.599 . . . . 0.0 114.597 -168.608 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -117.47 167.49 11.24 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 127.231 2.212 . . . . 0.0 107.868 167.765 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.2 t -112.58 130.8 55.9 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.656 0.782 . . . . 0.0 110.597 173.797 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 39.5 mt -111.13 163.62 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 C-N-CA 126.914 2.086 . . . . 0.0 106.996 168.111 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -27.07 -63.27 0.08 OUTLIER Glycine 0 CA--C 1.535 1.321 0 C-N-CA 126.228 1.871 . . . . 0.0 116.481 -175.513 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.19 -34.18 22.11 Favored 'General case' 0 N--CA 1.443 -0.776 0 O-C-N 121.063 -1.257 . . . . 0.0 109.345 -178.064 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -147.98 152.59 37.74 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.124 0.57 . . . . 0.0 112.512 -129.357 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 44.0 t -65.06 144.48 57.23 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.661 1.584 . . . . 0.0 111.504 173.009 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.425 ' CD ' HG13 ' A' ' 29' ' ' VAL . 9.3 tm-20 -114.93 168.71 9.66 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 157.048 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 98.6 m -147.01 84.35 1.59 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 126.081 1.752 . . . . 0.0 110.648 178.497 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.425 HG13 ' CD ' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -82.79 158.32 3.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 -174.718 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.1 tptt -61.97 -45.31 94.21 Favored 'General case' 0 N--CA 1.44 -0.935 0 O-C-N 120.815 -1.178 . . . . 0.0 109.876 165.065 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -137.04 -54.83 0.71 Allowed 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 177.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.36 1.056 0 CA-C-N 114.553 -1.203 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.85 0 N-CA-C 104.493 -2.41 . . . . 0.0 104.493 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -58.74 -55.14 38.9 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 150.449 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.1 t -64.01 127.99 33.85 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.236 -177.4 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -91.46 112.34 24.22 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 126.256 1.822 . . . . 0.0 108.277 176.029 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 30.6 tp -48.47 -44.73 35.95 Favored 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 123.166 0.586 . . . . 0.0 112.291 179.547 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -64.25 -37.34 87.14 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 120.139 -0.624 . . . . 0.0 111.033 -172.452 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 14.3 tmm? -60.86 -51.06 70.91 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 174.775 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.0 t -57.47 -56.93 15.53 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.88 -175.51 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -45.79 -50.62 13.83 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 126.031 1.732 . . . . 0.0 110.354 171.741 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 31.5 tp -62.49 -30.67 71.44 Favored 'General case' 0 N--CA 1.454 -0.254 0 O-C-N 121.768 -0.583 . . . . 0.0 111.518 -177.289 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.3 t -71.73 -56.46 5.75 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 119.004 0.82 . . . . 0.0 109.053 172.014 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.2 m -63.81 -28.36 69.81 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.597 1.559 . . . . 0.0 110.639 -167.442 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.2 ttp85 -41.22 -46.02 3.03 Favored 'General case' 0 C--O 1.226 -0.136 0 C-N-CA 125.927 1.691 . . . . 0.0 110.422 168.333 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.6 m -55.18 -31.12 61.13 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.626 0.648 . . . . 0.0 112.286 -175.431 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.7 mt -106.53 9.48 31.52 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 123.711 0.804 . . . . 0.0 111.074 -178.059 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 56.6 54.57 35.3 Favored Glycine 0 C--N 1.339 0.74 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 -177.575 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 39.0 mt -127.15 140.55 52.18 Favored 'General case' 0 C--N 1.319 -0.741 0 C-N-CA 125.393 1.477 . . . . 0.0 108.092 175.576 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.5 tp -72.11 121.42 19.22 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 125.843 1.657 . . . . 0.0 107.043 168.703 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.35 128.76 16.35 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 111.521 -0.631 . . . . 0.0 111.521 -178.645 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -107.91 94.6 5.16 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 126.904 2.082 . . . . 0.0 107.241 177.231 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.1 103.08 4.43 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 172.074 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 22.8 mt -82.74 161.15 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 N-CA-C 104.1 -2.556 . . . . 0.0 104.1 167.402 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -45.46 -47.75 11.88 Favored Glycine 0 CA--C 1.527 0.784 0 O-C-N 122.022 -0.424 . . . . 0.0 112.536 -166.878 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -81.94 -41.96 20.11 Favored 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 128.202 2.601 . . . . 0.0 109.227 -172.426 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 5.1 ptpp? -155.87 161.39 40.6 Favored 'General case' 0 C--O 1.227 -0.118 0 CA-C-O 121.246 0.546 . . . . 0.0 112.314 -153.737 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 38.9 t -88.28 129.89 35.25 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 124.014 0.926 . . . . 0.0 110.744 179.078 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -117.26 172.43 7.31 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 168.032 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 82.3 m -147.8 100.84 3.26 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.401 1.08 . . . . 0.0 108.78 -169.895 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.8 m -97.22 154.24 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 O-C-N 121.012 -1.055 . . . . 0.0 109.133 176.515 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.5 ttmm -85.79 -43.29 13.45 Favored 'General case' 0 N--CA 1.443 -0.815 0 O-C-N 121.673 -0.642 . . . . 0.0 109.901 170.648 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 58.8 t60 50.48 -135.93 1.31 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.511 0.724 . . . . 0.0 109.559 -178.383 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.357 0.903 0 O-C-N 123.59 0.556 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_