data_5t4r_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 5t4r _Structure_validation_residue.Date_analyzed 2017-09-01 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 ' 2' ' ' CYS . . . . . . . . . . . . . 26.7 p . . . . . 0 N--CA 1.433 -1.307 0 CA-C-O 121.946 0.879 . . . . 0.0 112.659 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.6 mpp_? -103.17 134.67 46.2 Favored 'General case' 0 C--N 1.285 -2.196 0 CA-C-N 114.107 -1.406 . . . . 0.0 109.83 177.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.431 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 89.7 m-85 -91.38 -162.03 0.88 Allowed 'General case' 0 N--CA 1.404 -2.742 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.459 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 6.8 ttt -65.8 136.72 56.57 Favored 'General case' 0 C--N 1.32 -0.688 0 O-C-N 122.295 -0.253 . . . . 0.0 110.91 -171.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 79.52 2.68 2.22 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.061 1.344 . . . . 0.0 111.997 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -87.44 144.88 19.32 Favored Glycine 0 N--CA 1.438 -1.203 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 174.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.497 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 19.3 t70 -61.93 148.07 44.81 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.244 0.618 . . . . 0.0 112.598 -176.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.5 p -152.4 146.63 25.47 Favored 'General case' 0 N--CA 1.423 -1.81 0 C-N-CA 120.097 -0.641 . . . . 0.0 111.786 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -101.95 -44.27 5.54 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 106.726 -1.583 . . . . 0.0 106.726 172.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.56 ' HG2' ' OD1' ' A' ' 14' ' ' ASP . 4.4 ptpp? -134.52 177.47 7.75 Favored 'General case' 0 N--CA 1.409 -2.523 0 CA-C-N 113.752 -1.567 . . . . 0.0 107.549 -176.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -74.53 -19.76 60.23 Favored 'General case' 0 C--N 1.29 -2.014 0 CA-C-O 121.154 0.502 . . . . 0.0 110.959 -175.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -69.24 -23.52 63.88 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.849 -177.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.56 ' OD1' ' HG2' ' A' ' 11' ' ' LYS . 40.0 m-20 -74.78 -29.89 61.27 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-O 121.758 0.789 . . . . 0.0 109.157 -178.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.1 m -87.33 163.32 16.88 Favored 'General case' 0 N--CA 1.426 -1.658 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.226 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 m -69.97 169.25 13.65 Favored 'General case' 0 N--CA 1.419 -2.003 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 173.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -87.81 -0.19 56.62 Favored 'General case' 0 C--N 1.287 -2.152 0 CA-C-O 122.728 1.252 . . . . 0.0 111.384 -170.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 89.3 m-70 -95.08 2.05 55.11 Favored 'General case' 0 C--N 1.273 -2.748 0 CA-C-N 113.08 -1.873 . . . . 0.0 108.656 172.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.0 mp -136.41 -177.05 4.55 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.464 -175.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.64 160.55 28.52 Favored Glycine 0 N--CA 1.425 -2.067 0 N-CA-C 108.818 -1.713 . . . . 0.0 108.818 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.6 t -92.48 127.89 38.14 Favored 'General case' 0 C--N 1.285 -2.221 0 CA-C-N 117.84 0.82 . . . . 0.0 111.429 -176.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm -96.68 112.58 24.27 Favored 'General case' 0 CA--C 1.468 -2.183 0 O-C-N 121.36 -0.838 . . . . 0.0 108.894 169.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -72.73 -8.72 56.79 Favored 'General case' 0 C--N 1.294 -1.832 0 CA-C-N 114.289 -1.323 . . . . 0.0 111.51 -176.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -88.91 -27.82 20.72 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-O 122.201 1.0 . . . . 0.0 108.378 -177.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.54 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 0.9 OUTLIER -110.03 -8.44 14.82 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 114.513 -1.222 . . . . 0.0 111.03 -176.022 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.503 ' N ' ' HD2' ' A' ' 26' ' ' LYS . 3.7 mptp? 59.85 26.36 15.55 Favored 'General case' 0 CA--C 1.486 -1.499 0 C-N-CA 124.61 1.164 . . . . 0.0 110.847 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.54 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 2.5 p90 -141.27 156.62 45.86 Favored 'General case' 0 C--N 1.286 -2.164 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.521 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 59.3 m -72.29 133.53 45.07 Favored 'General case' 0 N--CA 1.411 -2.418 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.508 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.459 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -120.11 173.81 6.87 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 176.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -71.98 -0.06 10.59 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 119.59 1.086 . . . . 0.0 113.331 -175.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.1 p30 . . . . . 0 N--CA 1.407 -2.592 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 -178.604 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 24.8 p . . . . . 0 N--CA 1.407 -2.592 0 CA-C-O 121.704 0.764 . . . . 0.0 110.58 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.7 mpp_? -94.04 133.88 37.04 Favored 'General case' 0 C--N 1.268 -2.977 0 CA-C-N 114.263 -1.335 . . . . 0.0 109.632 176.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.479 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 43.6 m-85 -85.07 -165.83 1.32 Allowed 'General case' 0 N--CA 1.409 -2.483 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 176.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 12.4 ttt -63.96 134.21 54.66 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 77.88 1.19 2.84 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.509 1.524 . . . . 0.0 111.66 -178.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -76.31 154.49 44.4 Favored Glycine 0 N--CA 1.44 -1.062 0 N-CA-C 109.172 -1.571 . . . . 0.0 109.172 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -74.81 143.53 43.93 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 117.099 0.449 . . . . 0.0 111.929 -174.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.448 ' O ' ' HE2' ' A' ' 26' ' ' LYS . 28.9 p -151.45 154.86 37.42 Favored 'General case' 0 N--CA 1.412 -2.331 0 C-N-CA 119.988 -0.685 . . . . 0.0 111.232 -177.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -112.83 -36.57 5.11 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 107.324 -1.361 . . . . 0.0 107.324 171.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -141.98 178.15 7.72 Favored 'General case' 0 N--CA 1.425 -1.709 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.835 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -71.4 -17.81 62.38 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 120.606 0.241 . . . . 0.0 111.311 -174.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -64.36 -26.47 68.49 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-O 121.492 0.663 . . . . 0.0 110.319 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -72.88 -29.49 63.22 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.124 -178.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.2 m -91.4 162.64 14.5 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.516 -176.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.8 m -71.35 177.83 3.72 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.575 175.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -57.65 -56.44 21.94 Favored 'General case' 0 CA--C 1.502 -0.885 0 C-N-CA 124.114 0.966 . . . . 0.0 112.293 -174.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 -77.13 19.88 0.3 Allowed 'General case' 0 C--N 1.293 -1.862 0 CA-C-N 114.801 -1.09 . . . . 0.0 112.882 -176.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.417 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 60.7 mt -132.51 167.45 19.96 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.248 0.547 . . . . 0.0 110.764 -176.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.37 148.92 20.92 Favored Glycine 0 N--CA 1.434 -1.476 0 N-CA-C 108.994 -1.642 . . . . 0.0 108.994 177.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.9 t -84.61 128.27 34.51 Favored 'General case' 0 C--N 1.285 -2.215 0 CA-C-N 117.236 0.518 . . . . 0.0 111.208 -175.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 35.0 mmtm -88.29 112.9 23.34 Favored 'General case' 0 CA--C 1.465 -2.318 0 O-C-N 121.934 -0.479 . . . . 0.0 109.796 172.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.2 mpt_? -73.95 -9.78 58.98 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.601 -1.181 . . . . 0.0 111.505 -178.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -89.34 -29.14 19.35 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 -178.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.432 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 95.0 mmm -112.44 -20.36 11.81 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 114.68 -1.145 . . . . 0.0 112.3 -171.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.448 ' HE2' ' O ' ' A' ' 9' ' ' CYS . 14.4 mmmm 69.69 36.39 2.14 Favored 'General case' 0 CA--C 1.503 -0.843 0 C-N-CA 125.458 1.503 . . . . 0.0 111.304 -178.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.432 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 3.4 p90 -144.25 160.17 41.43 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-N 114.365 -1.289 . . . . 0.0 111.696 178.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 70.2 m -79.92 130.04 34.97 Favored 'General case' 0 C--N 1.289 -2.045 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.832 -178.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.84 -174.48 2.83 Favored 'General case' 0 C--N 1.289 -2.034 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 177.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -75.45 -6.16 48.69 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -176.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 N--CA 1.407 -2.611 0 N-CA-C 105.194 -2.15 . . . . 0.0 105.194 -179.987 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.7 p . . . . . 0 N--CA 1.418 -2.029 0 CA-C-O 121.78 0.8 . . . . 0.0 109.5 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -115.07 135.73 53.88 Favored 'General case' 0 N--CA 1.402 -2.842 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.618 171.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.449 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 64.4 m-85 -96.16 -159.04 0.7 Allowed 'General case' 0 N--CA 1.387 -3.619 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 175.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 11.1 ttt -67.47 135.57 53.29 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.386 -0.926 . . . . 0.0 109.661 -175.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 76.26 5.98 3.63 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.529 1.132 . . . . 0.0 111.059 -178.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . 0.402 ' O ' ' HA ' ' A' ' 27' ' ' TYR . . . -87.25 149.7 22.2 Favored Glycine 0 N--CA 1.434 -1.493 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 175.364 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.408 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 7.2 t70 -71.22 141.84 50.62 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 123.682 0.793 . . . . 0.0 112.924 -173.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.5 p -149.95 150.34 31.7 Favored 'General case' 0 C--N 1.284 -2.279 0 C-N-CA 119.626 -0.829 . . . . 0.0 111.432 -177.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -113.76 -35.13 5.26 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 172.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.574 ' HG2' ' OD2' ' A' ' 14' ' ' ASP . 3.9 ptpp? -138.06 175.14 9.84 Favored 'General case' 0 N--CA 1.413 -2.281 0 CA-C-N 114.417 -1.265 . . . . 0.0 107.82 -176.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -75.34 -16.57 60.39 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-O 121.16 0.505 . . . . 0.0 111.443 -175.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.435 ' HB2' ' HG3' ' A' ' 11' ' ' LYS . 46.1 mt-10 -68.87 -25.99 64.9 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.818 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.574 ' OD2' ' HG2' ' A' ' 11' ' ' LYS . 45.0 m-20 -72.92 -26.79 61.53 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.109 -177.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 13.0 m -96.68 156.92 16.14 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 120.978 0.418 . . . . 0.0 110.088 -178.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.16 179.71 3.72 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 173.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -49.99 -61.46 2.13 Favored 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 127.15 2.18 . . . . 0.0 113.867 -172.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -76.25 15.57 0.56 Allowed 'General case' 0 C--N 1.29 -1.986 0 CA-C-N 114.854 -1.066 . . . . 0.0 112.746 -174.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.2 mp -135.54 176.76 8.38 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-O 120.925 0.393 . . . . 0.0 110.942 -177.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -150.38 161.06 28.83 Favored Glycine 0 N--CA 1.425 -2.088 0 N-CA-C 108.902 -1.679 . . . . 0.0 108.902 176.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.2 t -87.16 130.59 34.48 Favored 'General case' 0 C--N 1.297 -1.699 0 CA-C-N 117.554 0.677 . . . . 0.0 112.333 -176.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.566 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 74.4 mmtt -100.63 105.1 16.46 Favored 'General case' 0 CA--C 1.465 -2.312 0 CA-C-O 121.358 0.599 . . . . 0.0 109.43 170.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -72.92 -3.7 27.44 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 114.385 -1.28 . . . . 0.0 111.115 -176.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -89.77 -31.68 17.3 Favored 'General case' 0 CA--C 1.5 -0.972 0 CA-C-O 121.998 0.904 . . . . 0.0 108.694 -177.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.491 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 96.2 mmm -112.29 -7.97 13.97 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 114.537 -1.211 . . . . 0.0 111.867 -176.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.408 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 70.7 mmtt 65.35 30.01 11.23 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.723 1.209 . . . . 0.0 111.717 -179.053 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.491 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 7.0 p90 -144.42 159.79 42.14 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.27 178.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 55.9 m -81.15 131.02 35.28 Favored 'General case' 0 C--N 1.287 -2.139 0 CA-C-N 114.614 -1.176 . . . . 0.0 110.658 -178.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -116.33 -176.59 2.99 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 105.831 -1.915 . . . . 0.0 105.831 175.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -75.54 2.43 11.72 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 119.053 0.842 . . . . 0.0 113.041 -175.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.566 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 2.9 p30 . . . . . 0 N--CA 1.401 -2.919 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.1 p . . . . . 0 N--CA 1.418 -2.074 0 CA-C-O 121.114 0.483 . . . . 0.0 109.798 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . 0.428 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 3.4 tpp180 -86.76 131.22 34.19 Favored 'General case' 0 C--N 1.276 -2.602 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 -178.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -90.25 -166.55 1.61 Allowed 'General case' 0 N--CA 1.415 -2.182 0 CA-C-O 120.818 0.342 . . . . 0.0 111.843 -178.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 16.0 ttt -64.9 140.31 58.85 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.755 -174.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 72.22 8.91 5.91 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.514 1.126 . . . . 0.0 111.577 -179.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.61 137.92 14.16 Favored Glycine 0 N--CA 1.419 -2.486 0 N-CA-C 109.681 -1.368 . . . . 0.0 109.681 175.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.543 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 18.5 t70 -56.76 143.99 34.6 Favored 'General case' 0 CA--C 1.486 -1.489 0 C-N-CA 124.449 1.1 . . . . 0.0 111.553 -178.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 26.5 p -149.43 151.91 34.8 Favored 'General case' 0 N--CA 1.42 -1.941 0 C-N-CA 119.518 -0.873 . . . . 0.0 111.957 -175.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -115.97 -33.91 4.92 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.292 -0.867 . . . . 0.0 108.71 176.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -138.73 164.04 30.59 Favored 'General case' 0 N--CA 1.42 -1.959 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 176.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -71.55 -16.5 62.32 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-O 121.317 0.58 . . . . 0.0 110.162 -177.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -67.52 -28.22 67.63 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 114.432 -1.258 . . . . 0.0 109.552 -177.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -69.08 -32.8 72.49 Favored 'General case' 0 N--CA 1.436 -1.133 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.911 -177.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 3' ' ' ARG . 69.3 m -100.4 165.74 11.3 Favored 'General case' 0 N--CA 1.429 -1.512 0 CA-C-O 121.378 0.609 . . . . 0.0 112.582 -177.408 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.3 m -64.69 172.34 2.8 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.834 -178.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -79.01 -27.43 43.26 Favored 'General case' 0 CA--C 1.488 -1.432 0 CA-C-O 121.939 0.876 . . . . 0.0 111.647 -172.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 33.9 m170 -77.92 4.14 12.78 Favored 'General case' 0 C--N 1.28 -2.439 0 CA-C-N 114.299 -1.319 . . . . 0.0 110.62 177.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.5 mp -133.14 177.1 7.93 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-O 121.285 0.564 . . . . 0.0 111.304 -177.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -150.6 152.12 24.03 Favored Glycine 0 N--CA 1.421 -2.365 0 N-CA-C 109.774 -1.33 . . . . 0.0 109.774 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 32.5 t -88.96 118.68 28.86 Favored 'General case' 0 C--N 1.292 -1.915 0 C-N-CA 123.153 0.581 . . . . 0.0 111.042 -175.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.42 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 75.3 mmtt -87.97 115.61 25.56 Favored 'General case' 0 CA--C 1.466 -2.269 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 177.199 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.1 mmt180 -73.47 -15.3 61.33 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.326 -175.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -90.68 -25.93 19.83 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.965 -176.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.521 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 89.4 mmm -107.01 -17.19 14.24 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 114.975 -1.012 . . . . 0.0 110.755 -173.39 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.543 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 32.2 mmmt 68.36 33.1 4.3 Favored 'General case' 0 CA--C 1.489 -1.398 0 C-N-CA 124.42 1.088 . . . . 0.0 111.118 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.521 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 7.8 p90 -153.61 166.36 33.03 Favored 'General case' 0 C--N 1.287 -2.127 0 CA-C-N 114.185 -1.371 . . . . 0.0 110.464 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.6 m -95.85 140.37 30.72 Favored 'General case' 0 C--N 1.276 -2.59 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.31 -172.41 2.35 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 177.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -76.71 9.24 2.93 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 119.883 1.219 . . . . 0.0 113.151 -176.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.42 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 4.7 p-10 . . . . . 0 N--CA 1.405 -2.677 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.7 p . . . . . 0 N--CA 1.426 -1.635 0 CA-C-O 121.263 0.554 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . 0.503 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 39.6 mmt180 -80.12 131.48 35.75 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-N 114.565 -1.198 . . . . 0.0 109.524 178.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.426 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 55.8 m-85 -90.91 -158.88 0.58 Allowed 'General case' 0 N--CA 1.397 -3.109 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 173.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.1 ttt -71.66 137.28 47.75 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 120.31 -0.556 . . . . 0.0 109.901 -173.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 77.61 2.36 3.01 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.137 1.375 . . . . 0.0 111.266 -178.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.38 142.9 26.56 Favored Glycine 0 N--CA 1.43 -1.713 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 174.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.503 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 12.7 t70 -69.32 144.54 53.5 Favored 'General case' 0 CA--C 1.492 -1.259 0 C-N-CA 123.339 0.656 . . . . 0.0 111.116 -176.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.401 ' O ' ' HE2' ' A' ' 26' ' ' LYS . 32.0 p -152.47 155.97 38.53 Favored 'General case' 0 C--N 1.29 -1.991 0 C-N-CA 119.65 -0.82 . . . . 0.0 111.883 -176.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -113.73 -36.93 4.71 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 171.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.4 pttm -135.68 167.52 20.98 Favored 'General case' 0 N--CA 1.426 -1.666 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.153 -178.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -67.46 -19.13 65.31 Favored 'General case' 0 CA--C 1.488 -1.411 0 CA-C-O 120.994 0.426 . . . . 0.0 111.49 -178.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -70.94 -23.7 62.29 Favored 'General case' 0 CA--C 1.497 -1.095 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.34 -177.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -77.16 -27.98 53.94 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.1 -178.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 20.8 m -89.68 158.95 17.35 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 59.1 m -65.23 169.9 5.18 Favored 'General case' 0 N--CA 1.421 -1.923 0 CA-C-O 121.448 0.642 . . . . 0.0 110.632 174.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -66.71 -47.91 70.88 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.647 -169.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 47.5 m80 -64.82 -3.9 3.84 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 114.872 -1.058 . . . . 0.0 113.196 179.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.7 mp -120.96 -178.77 3.83 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.289 0.566 . . . . 0.0 111.583 -177.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -148.18 153.16 25.1 Favored Glycine 0 N--CA 1.419 -2.471 0 N-CA-C 110.27 -1.132 . . . . 0.0 110.27 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.3 t -86.31 127.78 34.83 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-O 120.6 0.238 . . . . 0.0 110.481 -177.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.501 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 73.1 mmtt -92.51 113.57 25.88 Favored 'General case' 0 CA--C 1.46 -2.497 0 CA-C-O 121.24 0.543 . . . . 0.0 110.439 176.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -71.45 -12.78 61.57 Favored 'General case' 0 C--N 1.29 -1.979 0 CA-C-N 113.474 -1.694 . . . . 0.0 112.091 -175.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.429 ' HB3' ' HZ2' ' A' ' 24' ' ' LYS . 3.3 mmmp? -90.38 -30.66 17.27 Favored 'General case' 0 C--N 1.297 -1.702 0 C-N-CA 119.457 -0.897 . . . . 0.0 109.633 -177.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.429 ' HB3' ' CD2' ' A' ' 27' ' ' TYR . 16.5 mmt -113.15 -13.84 12.97 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -174.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.404 ' HA ' ' HD2' ' A' ' 26' ' ' LYS . 14.5 mmmm 66.81 36.67 4.42 Favored 'General case' 0 CA--C 1.498 -1.055 0 C-N-CA 124.444 1.098 . . . . 0.0 110.767 -179.027 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.429 ' CD2' ' HB3' ' A' ' 25' ' ' MET . 10.0 p90 -142.99 159.84 41.49 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.657 177.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.426 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 42.2 m -84.72 129.47 34.83 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.938 -176.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.16 -173.8 2.64 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -79.62 8.46 6.48 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 119.775 1.17 . . . . 0.0 113.1 -176.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.501 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 3.3 p-10 . . . . . 0 N--CA 1.409 -2.479 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 13.1 p . . . . . 0 N--CA 1.439 -0.992 0 CA-C-O 121.854 0.835 . . . . 0.0 112.397 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -94.48 132.04 39.56 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.08 176.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.455 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 70.3 m-85 -92.09 -162.96 0.98 Allowed 'General case' 0 N--CA 1.398 -3.029 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 175.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.7 ttt -61.88 137.56 58.26 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 120.51 0.195 . . . . 0.0 110.57 -175.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 76.84 -5.09 2.24 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.926 1.291 . . . . 0.0 111.888 -179.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.92 146.39 36.58 Favored Glycine 0 N--CA 1.435 -1.394 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 176.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.46 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 16.2 t70 -73.23 145.37 46.26 Favored 'General case' 0 CA--C 1.485 -1.548 0 CA-C-O 120.947 0.404 . . . . 0.0 111.081 -176.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.7 p -153.73 152.75 31.12 Favored 'General case' 0 N--CA 1.41 -2.472 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.459 -178.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -113.34 -32.88 6.12 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 173.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -131.71 165.44 23.72 Favored 'General case' 0 N--CA 1.417 -2.097 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 176.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -70.03 -16.18 63.12 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 121.552 0.691 . . . . 0.0 110.469 -175.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -72.92 -23.75 60.74 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.974 -177.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -76.72 -16.24 59.56 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.154 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 33.9 m -99.14 156.56 16.89 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.805 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 36.4 m -64.45 173.82 1.95 Allowed 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.797 176.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -60.8 -51.91 67.31 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.63 1.172 . . . . 0.0 113.024 -171.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 41.3 m80 -70.82 2.37 4.33 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 114.202 -1.363 . . . . 0.0 113.237 -178.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.6 mp -122.52 173.17 7.85 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.564 0.697 . . . . 0.0 112.561 -177.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -138.97 156.92 24.61 Favored Glycine 0 N--CA 1.43 -1.766 0 N-CA-C 108.304 -1.919 . . . . 0.0 108.304 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.3 t -100.74 121.57 41.88 Favored 'General case' 0 C--N 1.286 -2.159 0 CA-C-N 117.774 0.787 . . . . 0.0 110.783 -175.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -75.31 110.66 9.85 Favored 'General case' 0 CA--C 1.461 -2.445 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 171.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -77.36 -11.55 59.85 Favored 'General case' 0 C--N 1.291 -1.967 0 O-C-N 124.531 1.145 . . . . 0.0 109.578 -176.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -89.59 -27.69 20.05 Favored 'General case' 0 N--CA 1.433 -1.3 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.441 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 93.4 mmm -112.84 -6.82 13.8 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -172.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.46 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 4.9 mptp? 59.65 33.13 21.88 Favored 'General case' 0 CA--C 1.495 -1.17 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.441 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 17.3 p90 -144.66 153.3 41.6 Favored 'General case' 0 CA--C 1.486 -1.49 0 C-N-CA 118.881 -1.128 . . . . 0.0 112.946 177.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 39.7 m -80.04 131.42 35.78 Favored 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 113.966 -1.47 . . . . 0.0 110.046 -179.264 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -124.13 175.5 6.97 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 178.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -70.63 -4.66 24.45 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -175.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 . . . . . 0 N--CA 1.418 -2.03 0 N-CA-C 103.59 -2.745 . . . . 0.0 103.59 175.517 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.9 p . . . . . 0 N--CA 1.429 -1.479 0 CA-C-O 121.281 0.562 . . . . 0.0 111.25 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 33.9 mmt180 -82.09 125.93 31.42 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 115.004 -0.998 . . . . 0.0 108.425 176.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.481 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 76.9 m-85 -88.39 -164.91 1.2 Allowed 'General case' 0 N--CA 1.387 -3.625 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.532 178.28 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.496 ' HA ' ' O ' ' A' ' 28' ' ' CYS . 16.3 ttt -63.97 134.03 54.3 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 120.817 0.342 . . . . 0.0 110.354 -173.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 78.79 -1.77 2.35 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 125.631 1.572 . . . . 0.0 111.717 -179.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.3 145.06 32.71 Favored Glycine 0 N--CA 1.439 -1.105 0 N-CA-C 110.201 -1.16 . . . . 0.0 110.201 176.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.416 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 13.5 t70 -67.7 144.9 55.24 Favored 'General case' 0 CA--C 1.495 -1.151 0 C-N-CA 123.117 0.567 . . . . 0.0 111.742 -177.268 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.1 p -149.36 161.3 42.33 Favored 'General case' 0 N--CA 1.419 -1.982 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.201 -177.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -118.25 -32.34 4.71 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 172.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.8 pttt -147.42 177.28 9.37 Favored 'General case' 0 N--CA 1.426 -1.663 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 178.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -71.84 -16.32 62.16 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -175.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.24 -30.64 71.68 Favored 'General case' 0 CA--C 1.488 -1.428 0 CA-C-O 121.317 0.58 . . . . 0.0 110.498 177.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -68.83 -32.27 71.84 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.893 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 17.7 m -94.99 155.26 16.8 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.109 -177.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 25.1 m -60.77 173.47 0.74 Allowed 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 123.885 0.874 . . . . 0.0 111.351 175.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -68.54 -39.4 81.13 Favored 'General case' 0 CA--C 1.5 -0.956 0 CA-C-O 121.884 0.85 . . . . 0.0 111.919 -171.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 20.2 m170 -86.87 9.25 19.81 Favored 'General case' 0 C--N 1.278 -2.527 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.206 -176.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.465 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 68.8 mt -126.71 162.83 24.88 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 -178.012 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -139.39 150.96 21.64 Favored Glycine 0 C--N 1.299 -1.51 0 N-CA-C 110.754 -0.939 . . . . 0.0 110.754 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -87.08 106.21 17.7 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -176.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -64.3 114.9 4.56 Favored 'General case' 0 CA--C 1.468 -2.193 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 175.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -65.62 -24.1 66.97 Favored 'General case' 0 C--N 1.308 -1.227 0 O-C-N 125.237 1.585 . . . . 0.0 110.475 -175.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.413 ' HZ1' ' HB3' ' A' ' 24' ' ' LYS . 2.8 mmmp? -90.05 -21.47 22.31 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 119.597 -0.841 . . . . 0.0 110.695 -168.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -112.3 -29.98 7.35 Favored 'General case' 0 N--CA 1.419 -2.018 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.334 -176.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp 72.06 49.59 0.24 Allowed 'General case' 0 CA--C 1.494 -1.188 0 C-N-CA 125.227 1.411 . . . . 0.0 110.925 -171.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -145.04 160.05 41.99 Favored 'General case' 0 CA--C 1.486 -1.483 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.233 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.496 ' O ' ' HA ' ' A' ' 5' ' ' MET . 56.3 m -85.57 122.81 30.22 Favored 'General case' 0 C--N 1.282 -2.344 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.252 -177.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.49 -165.18 1.17 Allowed 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 106.317 -1.735 . . . . 0.0 106.317 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -75.84 -5.84 47.87 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -176.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 . . . . . 0 N--CA 1.41 -2.432 0 N-CA-C 105.92 -1.881 . . . . 0.0 105.92 173.94 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.5 p . . . . . 0 N--CA 1.424 -1.767 0 CA-C-O 121.649 0.738 . . . . 0.0 111.758 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.72 135.42 41.16 Favored 'General case' 0 C--N 1.283 -2.284 0 CA-C-N 114.388 -1.278 . . . . 0.0 109.476 176.328 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.473 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 87.7 m-85 -91.46 -162.75 0.95 Allowed 'General case' 0 N--CA 1.399 -2.992 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 176.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.416 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 10.5 ttt -64.44 135.35 56.01 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 -175.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 75.77 9.67 3.45 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.828 1.251 . . . . 0.0 111.938 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.34 144.22 17.36 Favored Glycine 0 N--CA 1.434 -1.44 0 N-CA-C 109.161 -1.575 . . . . 0.0 109.161 173.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -62.47 145.6 53.75 Favored 'General case' 0 CA--C 1.493 -1.217 0 C-N-CA 123.079 0.551 . . . . 0.0 112.138 -176.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 21.6 p -153.47 155.13 35.71 Favored 'General case' 0 N--CA 1.422 -1.85 0 C-N-CA 120.011 -0.676 . . . . 0.0 110.757 -179.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -121.44 -34.33 3.47 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 172.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.6 pttt -131.36 174.09 10.42 Favored 'General case' 0 N--CA 1.42 -1.974 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 176.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -74.03 -16.06 61.06 Favored 'General case' 0 C--N 1.297 -1.717 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 -174.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -71.19 -24.7 62.27 Favored 'General case' 0 CA--C 1.483 -1.632 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.732 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -69.54 -25.54 64.06 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.609 -178.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 25.7 m -96.58 155.61 16.69 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.709 -178.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.7 m -66.13 178.01 1.26 Allowed 'General case' 0 C--N 1.291 -1.977 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.421 176.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 36.3 mmtp -57.61 -55.64 32.26 Favored 'General case' 0 CA--C 1.505 -0.763 0 C-N-CA 124.304 1.041 . . . . 0.0 113.066 -171.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 39.5 m80 -72.8 1.47 8.51 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 115.204 -0.907 . . . . 0.0 113.342 -176.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.3 mp -124.7 166.95 15.25 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-O 121.682 0.753 . . . . 0.0 111.961 -175.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -135.46 161.88 24.77 Favored Glycine 0 N--CA 1.419 -2.467 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 178.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.4 t -88.23 122.1 31.38 Favored 'General case' 0 C--N 1.285 -2.22 0 CA-C-N 116.92 0.36 . . . . 0.0 110.851 -176.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -83.9 114.37 21.62 Favored 'General case' 0 CA--C 1.465 -2.316 0 C-N-CA 119.426 -0.91 . . . . 0.0 110.06 175.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -67.11 -24.17 65.91 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 113.804 -1.544 . . . . 0.0 110.222 -178.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -87.39 -26.38 23.35 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 115.263 -0.88 . . . . 0.0 109.569 -174.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.501 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 76.3 mmm -110.4 -15.66 13.88 Favored 'General case' 0 C--N 1.291 -1.96 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.007 -170.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm 62.56 33.35 15.96 Favored 'General case' 0 CA--C 1.496 -1.124 0 C-N-CA 124.856 1.263 . . . . 0.0 110.348 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.501 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 3.3 p90 -151.18 161.23 43.1 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.419 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 57.6 m -79.28 135.36 36.73 Favored 'General case' 0 C--N 1.278 -2.536 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.719 -177.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.416 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -130.46 -178.89 4.96 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 176.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -71.91 0.38 9.36 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -175.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.3 t70 . . . . . 0 N--CA 1.416 -2.152 0 N-CA-C 105.034 -2.21 . . . . 0.0 105.034 179.422 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.2 p . . . . . 0 N--CA 1.411 -2.421 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -95.29 132.7 40.0 Favored 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.205 177.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.411 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 78.7 m-85 -92.11 -165.43 1.35 Allowed 'General case' 0 N--CA 1.409 -2.505 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.867 -177.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.2 ttt -61.61 136.06 57.87 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -176.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 78.58 -4.99 2.1 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.571 1.149 . . . . 0.0 111.743 -178.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.13 147.72 36.65 Favored Glycine 0 N--CA 1.44 -1.089 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 174.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -63.66 143.71 57.61 Favored 'General case' 0 CA--C 1.484 -1.563 0 C-N-CA 123.25 0.62 . . . . 0.0 112.243 -174.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.7 p -152.9 147.68 26.27 Favored 'General case' 0 C--N 1.279 -2.496 0 C-N-CA 118.544 -1.262 . . . . 0.0 111.192 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -125.79 -23.29 4.02 Favored 'General case' 0 N--CA 1.424 -1.733 0 CA-C-N 114.642 -1.163 . . . . 0.0 108.646 172.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -139.64 165.08 28.21 Favored 'General case' 0 N--CA 1.424 -1.752 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 176.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -71.69 -15.69 62.22 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.232 0.539 . . . . 0.0 110.634 -176.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -65.3 -28.15 69.12 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 114.838 -1.073 . . . . 0.0 110.931 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -73.06 -30.12 63.47 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.206 -176.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 12.2 m -95.77 155.58 16.69 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.773 -176.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 18.3 m -61.67 171.15 1.65 Allowed 'General case' 0 C--N 1.304 -1.372 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.673 174.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -72.05 -42.89 65.75 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-O 121.281 0.562 . . . . 0.0 110.933 -173.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 36.0 m80 -64.03 0.35 0.93 Allowed 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 114.855 -1.066 . . . . 0.0 112.788 175.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.6 mp -128.73 -175.98 3.7 Favored 'General case' 0 N--CA 1.421 -1.916 0 CA-C-O 121.078 0.466 . . . . 0.0 110.616 -178.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -152.28 161.29 29.34 Favored Glycine 0 N--CA 1.418 -2.556 0 N-CA-C 108.918 -1.673 . . . . 0.0 108.918 175.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.3 t -87.6 131.62 34.35 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-N 117.446 0.623 . . . . 0.0 111.136 -178.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -103.1 107.52 18.36 Favored 'General case' 0 CA--C 1.469 -2.148 0 CA-C-O 121.477 0.656 . . . . 0.0 110.259 172.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -74.75 -5.32 42.71 Favored 'General case' 0 C--N 1.293 -1.853 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.627 -177.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -89.03 -29.98 19.06 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 95.8 mmm -112.65 -9.98 13.69 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 114.791 -1.095 . . . . 0.0 112.589 -177.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp 65.15 28.71 12.15 Favored 'General case' 0 CA--C 1.504 -0.799 0 C-N-CA 124.901 1.28 . . . . 0.0 111.306 -178.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.3 p90 -145.56 162.44 37.45 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-N 114.849 -1.069 . . . . 0.0 111.747 179.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 52.3 m -77.24 135.21 38.45 Favored 'General case' 0 C--N 1.287 -2.14 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.589 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -124.67 -178.81 4.26 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 176.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -71.04 -3.92 22.24 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.471 1.285 . . . . 0.0 114.471 -175.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 . . . . . 0 N--CA 1.41 -2.446 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 178.028 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.4 p . . . . . 0 N--CA 1.413 -2.278 0 CA-C-O 121.385 0.612 . . . . 0.0 110.529 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . 0.44 ' HB3' ' HA3' ' A' ' 7' ' ' GLY . 8.6 mpt_? -99.06 137.07 38.12 Favored 'General case' 0 C--N 1.285 -2.223 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.828 176.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.506 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 74.0 m-85 -86.98 -166.99 1.73 Allowed 'General case' 0 N--CA 1.399 -2.991 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.572 174.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 13.0 ttt -60.56 133.62 56.27 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 -175.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 74.99 5.59 4.31 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.618 1.167 . . . . 0.0 112.023 -178.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . 0.44 ' HA3' ' HB3' ' A' ' 3' ' ' ARG . . . -80.03 160.84 44.98 Favored Glycine 0 N--CA 1.442 -0.932 0 N-CA-C 109.22 -1.552 . . . . 0.0 109.22 173.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.43 141.52 45.03 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -174.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.2 p -151.19 155.13 38.21 Favored 'General case' 0 N--CA 1.423 -1.775 0 C-N-CA 119.828 -0.749 . . . . 0.0 111.915 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -119.42 -39.23 2.91 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 124.725 1.21 . . . . 0.0 108.169 172.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.8 pttm -132.36 175.42 9.3 Favored 'General case' 0 N--CA 1.423 -1.785 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -74.84 -17.43 60.6 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 121.1 0.476 . . . . 0.0 110.294 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -69.68 -23.43 63.44 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.333 -177.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -76.81 -25.14 52.94 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 -177.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 39.5 m -91.73 159.66 15.73 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.758 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 69.9 m -67.09 178.66 1.36 Allowed 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.255 176.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -55.23 -61.29 2.43 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-O 121.855 0.836 . . . . 0.0 112.587 -172.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 63.8 m80 -78.93 22.06 0.4 Allowed 'General case' 0 C--N 1.281 -2.372 0 CA-C-N 113.93 -1.486 . . . . 0.0 112.362 -174.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.506 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 61.6 mt -131.49 157.77 42.64 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 120.893 0.378 . . . . 0.0 110.141 -178.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -135.12 152.28 20.75 Favored Glycine 0 N--CA 1.43 -1.761 0 N-CA-C 108.95 -1.66 . . . . 0.0 108.95 177.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.6 t -87.72 123.85 32.96 Favored 'General case' 0 C--N 1.287 -2.129 0 CA-C-N 117.293 0.546 . . . . 0.0 111.174 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.5 mmtm -87.16 108.9 19.12 Favored 'General case' 0 CA--C 1.468 -2.188 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.114 172.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? -69.45 -5.0 20.95 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 114.336 -1.302 . . . . 0.0 112.06 -177.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -87.82 -39.49 14.81 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 -176.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 93.1 mmm -113.17 -3.35 13.93 Favored 'General case' 0 N--CA 1.427 -1.582 0 CA-C-N 114.519 -1.219 . . . . 0.0 112.136 -175.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.422 ' HD3' ' HA ' ' A' ' 26' ' ' LYS . 32.6 mmtp 55.11 45.67 25.62 Favored 'General case' 0 C--O 1.248 1.007 0 C-N-CA 124.555 1.142 . . . . 0.0 113.454 -178.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -142.14 162.81 34.54 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.945 176.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 61.4 m -81.76 127.36 32.87 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 115.316 -0.857 . . . . 0.0 111.288 -177.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -118.91 -176.12 3.04 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 106.516 -1.661 . . . . 0.0 106.516 177.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -73.34 -9.95 59.24 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -176.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 . . . . . 0 N--CA 1.425 -1.715 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 176.756 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.9 p . . . . . 0 N--CA 1.418 -2.06 0 CA-C-O 121.937 0.875 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 28.5 mmt180 -95.07 143.4 26.56 Favored 'General case' 0 C--N 1.27 -2.86 0 CA-C-N 113.939 -1.482 . . . . 0.0 108.369 -177.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.43 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 65.6 m-85 -92.65 -165.71 1.4 Allowed 'General case' 0 N--CA 1.394 -3.23 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.9 ttt -64.32 138.14 58.28 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -175.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 74.1 6.53 4.76 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.576 1.15 . . . . 0.0 111.815 -179.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -85.96 146.95 21.54 Favored Glycine 0 N--CA 1.436 -1.333 0 N-CA-C 109.819 -1.313 . . . . 0.0 109.819 174.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.409 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 16.2 t70 -67.11 139.92 57.55 Favored 'General case' 0 CA--C 1.495 -1.172 0 C-N-CA 123.694 0.798 . . . . 0.0 112.498 -176.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.549 ' O ' ' HE2' ' A' ' 26' ' ' LYS . 31.3 p -157.63 157.53 33.8 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.409 -177.185 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -113.29 -37.42 4.71 Favored 'General case' 0 CA--C 1.507 -0.678 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 169.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 23.9 pttm -126.42 170.2 12.21 Favored 'General case' 0 N--CA 1.418 -2.034 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.01 -176.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -73.01 -19.26 61.24 Favored 'General case' 0 CA--C 1.486 -1.514 0 CA-C-O 121.122 0.487 . . . . 0.0 110.053 -176.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -72.44 -24.84 61.27 Favored 'General case' 0 CA--C 1.482 -1.66 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.996 -177.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -71.0 -29.2 65.09 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 -178.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 33.5 m -88.76 162.29 16.31 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.266 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 82.0 m -71.7 178.03 3.82 Favored 'General case' 0 N--CA 1.427 -1.62 0 CA-C-O 121.048 0.451 . . . . 0.0 111.48 176.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -54.84 -59.44 4.72 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.453 1.101 . . . . 0.0 113.926 -169.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 27.1 m170 -81.86 21.85 0.81 Allowed 'General case' 0 C--N 1.285 -2.229 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.076 -173.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 51.6 mt -125.02 167.92 14.06 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -140.87 146.2 17.35 Favored Glycine 0 N--CA 1.423 -2.207 0 N-CA-C 108.671 -1.772 . . . . 0.0 108.671 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 47.5 t -88.25 127.32 35.46 Favored 'General case' 0 C--N 1.283 -2.325 0 CA-C-O 121.333 0.587 . . . . 0.0 110.423 -176.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 56.4 mmtt -93.59 107.95 19.74 Favored 'General case' 0 N--CA 1.413 -2.302 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.0 175.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -72.48 -5.2 35.11 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.023 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -86.23 -37.52 18.54 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.476 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 95.6 mmm -112.86 -9.57 13.64 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.368 -174.314 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.549 ' HE2' ' O ' ' A' ' 9' ' ' CYS . 13.9 mmmm 66.4 35.04 5.91 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 124.738 1.215 . . . . 0.0 112.275 -179.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.476 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 14.2 p90 -147.18 160.46 42.43 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.879 178.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.43 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 57.1 m -79.78 130.71 35.55 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.308 -178.037 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.32 -175.53 3.02 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -79.4 1.97 23.41 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.321 0.964 . . . . 0.0 112.789 -178.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.0 t70 . . . . . 0 N--CA 1.425 -1.69 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 -177.73 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.4 p . . . . . 0 N--CA 1.419 -2.001 0 CA-C-O 121.633 0.73 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . 0.556 ' HB2' ' SG ' ' A' ' 28' ' ' CYS . 20.6 mmt180 -90.85 132.16 36.06 Favored 'General case' 0 C--N 1.28 -2.456 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 178.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.442 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 48.0 m-85 -84.93 -165.66 1.26 Allowed 'General case' 0 N--CA 1.397 -3.1 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 172.144 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.7 ttt -66.39 137.53 56.94 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -175.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 77.47 1.09 2.98 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.74 1.216 . . . . 0.0 111.436 -178.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.18 136.27 16.5 Favored Glycine 0 N--CA 1.429 -1.768 0 N-CA-C 108.877 -1.689 . . . . 0.0 108.877 174.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -60.0 140.49 56.74 Favored 'General case' 0 CA--C 1.492 -1.26 0 C-N-CA 123.266 0.627 . . . . 0.0 112.588 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 19.2 p -141.51 154.95 45.81 Favored 'General case' 0 N--CA 1.416 -2.174 0 C-N-CA 119.585 -0.846 . . . . 0.0 111.249 -176.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -118.14 -39.64 3.04 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 175.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.9 pttm -135.23 172.9 12.35 Favored 'General case' 0 N--CA 1.422 -1.872 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.099 -178.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -75.6 -16.13 60.26 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-O 121.022 0.439 . . . . 0.0 111.025 -176.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -70.37 -24.07 62.89 Favored 'General case' 0 CA--C 1.489 -1.4 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.486 -178.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -72.23 -31.55 65.93 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -178.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 17.3 m -89.28 155.08 19.61 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.504 -176.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.9 m -67.01 178.03 1.53 Allowed 'General case' 0 C--N 1.302 -1.466 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.562 177.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -63.07 -55.12 28.17 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -171.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -74.09 11.48 0.91 Allowed 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.945 -178.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.442 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 62.2 mt -128.21 -179.42 5.0 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 -177.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -161.5 165.36 35.52 Favored Glycine 0 N--CA 1.418 -2.554 0 N-CA-C 108.936 -1.666 . . . . 0.0 108.936 177.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.3 t -92.51 124.83 36.84 Favored 'General case' 0 C--N 1.289 -2.052 0 CA-C-O 121.343 0.592 . . . . 0.0 110.31 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.407 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 30.1 mmtp -99.86 112.29 24.56 Favored 'General case' 0 C--N 1.287 -2.124 0 CA-C-O 121.103 0.477 . . . . 0.0 110.374 173.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.9 mpt_? -73.11 -10.84 60.21 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 114.357 -1.292 . . . . 0.0 111.109 -177.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -85.26 -30.21 23.99 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -177.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 80.8 mmm -111.22 -10.69 14.27 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 114.407 -1.27 . . . . 0.0 110.856 -173.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.587 ' N ' ' HD2' ' A' ' 26' ' ' LYS . 9.6 mptt 62.1 26.1 15.68 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 125.816 1.646 . . . . 0.0 110.864 179.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -142.59 165.97 25.95 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.605 179.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.556 ' SG ' ' HB2' ' A' ' 3' ' ' ARG . 63.1 m -81.38 131.28 35.28 Favored 'General case' 0 N--CA 1.414 -2.253 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.37 -179.163 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.406 ' C ' ' H ' ' A' ' 31' ' ' ASP . . . -118.55 -175.82 2.96 Favored 'General case' 0 C--N 1.283 -2.308 0 N-CA-C 105.583 -2.006 . . . . 0.0 105.583 176.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.417 ' HA ' HD23 ' A' ' 19' ' ' LEU . 98.5 m95 -80.87 19.52 0.85 Allowed 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 119.303 0.956 . . . . 0.0 110.349 178.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.406 ' H ' ' C ' ' A' ' 29' ' ' ALA . 36.1 t70 . . . . . 0 N--CA 1.401 -2.878 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.387 -170.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.3 p . . . . . 0 N--CA 1.43 -1.46 0 CA-C-O 121.818 0.818 . . . . 0.0 111.796 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 39.5 mmt180 -86.92 133.95 33.56 Favored 'General case' 0 C--N 1.282 -2.332 0 CA-C-N 114.3 -1.318 . . . . 0.0 110.079 178.445 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.404 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 25.0 m-85 -84.71 -166.6 1.52 Allowed 'General case' 0 N--CA 1.399 -3.008 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.156 174.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.484 ' HA ' ' O ' ' A' ' 28' ' ' CYS . 11.3 ttt -65.74 138.8 58.19 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 -176.221 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 77.03 2.6 3.27 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.205 1.402 . . . . 0.0 111.832 -179.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -82.62 146.69 24.75 Favored Glycine 0 N--CA 1.435 -1.427 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 175.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.41 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 14.5 t70 -64.3 145.14 56.5 Favored 'General case' 0 CA--C 1.492 -1.251 0 C-N-CA 123.106 0.562 . . . . 0.0 112.207 -178.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 31.0 p -152.59 149.24 28.26 Favored 'General case' 0 N--CA 1.417 -2.094 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.145 -178.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -113.21 -23.73 9.79 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 173.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.8 pttm -145.67 172.25 13.55 Favored 'General case' 0 N--CA 1.423 -1.816 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 179.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -74.2 -16.71 60.96 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 121.337 0.589 . . . . 0.0 110.143 -177.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -73.15 -22.36 60.53 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.393 -178.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -77.02 -24.98 52.08 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 -179.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.8 m -89.94 161.62 15.82 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 115.157 -0.928 . . . . 0.0 109.034 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 56.4 m -70.38 178.42 2.91 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.517 174.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -61.55 -51.01 70.36 Favored 'General case' 0 CA--C 1.498 -1.019 0 CA-C-O 121.542 0.687 . . . . 0.0 112.799 -171.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 38.4 m-70 -76.55 14.06 0.86 Allowed 'General case' 0 C--N 1.283 -2.298 0 CA-C-N 114.658 -1.155 . . . . 0.0 112.417 -176.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 46.7 mt -128.93 153.2 47.74 Favored 'General case' 0 N--CA 1.433 -1.318 0 CA-C-O 121.151 0.5 . . . . 0.0 110.207 -175.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -131.16 145.77 17.25 Favored Glycine 0 N--CA 1.426 -1.992 0 N-CA-C 108.814 -1.714 . . . . 0.0 108.814 177.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 39.0 t -84.81 111.88 20.02 Favored 'General case' 0 C--N 1.284 -2.248 0 CA-C-N 116.96 0.38 . . . . 0.0 111.231 -175.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.439 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 71.3 mmtt -72.53 113.34 9.45 Favored 'General case' 0 CA--C 1.482 -1.66 0 O-C-N 121.301 -0.874 . . . . 0.0 108.667 177.119 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.6 mmt180 -69.38 -12.74 61.91 Favored 'General case' 0 C--N 1.315 -0.897 0 O-C-N 124.49 1.119 . . . . 0.0 109.896 -178.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -89.59 -29.93 18.52 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-O 122.093 0.949 . . . . 0.0 109.378 -175.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.53 ' HB3' ' CD1' ' A' ' 27' ' ' TYR . 23.3 mmt -111.81 -16.28 13.2 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.268 -173.08 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 66.44 33.7 6.69 Favored 'General case' 0 CA--C 1.499 -1.015 0 C-N-CA 124.372 1.069 . . . . 0.0 110.119 -178.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.53 ' CD1' ' HB3' ' A' ' 25' ' ' MET . 4.0 p90 -143.45 158.29 43.76 Favored 'General case' 0 CA--C 1.489 -1.369 0 CA-C-N 114.511 -1.222 . . . . 0.0 112.55 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.484 ' O ' ' HA ' ' A' ' 5' ' ' MET . 77.0 m -78.86 123.84 27.63 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.963 -178.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.445 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -119.61 -172.39 2.32 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 177.601 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -78.55 1.15 23.44 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 119.155 0.889 . . . . 0.0 112.915 -176.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.439 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 19.5 t70 . . . . . 0 N--CA 1.434 -1.269 0 C-N-CA 125.158 1.383 . . . . 0.0 107.914 177.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 6.2 p . . . . . 0 N--CA 1.424 -1.769 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -92.26 124.98 36.73 Favored 'General case' 0 C--N 1.272 -2.761 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 -179.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -88.39 -167.36 1.86 Allowed 'General case' 0 N--CA 1.412 -2.363 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.707 -177.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 13.3 ttt -64.23 139.16 58.74 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.704 -173.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 74.28 8.6 4.56 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.934 1.294 . . . . 0.0 111.674 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -95.06 145.07 17.56 Favored Glycine 0 N--CA 1.419 -2.498 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 175.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.472 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 20.9 t70 -64.78 143.66 57.78 Favored 'General case' 0 CA--C 1.493 -1.248 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -176.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 23.9 p -150.51 149.69 30.29 Favored 'General case' 0 N--CA 1.417 -2.11 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.872 -177.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -112.14 -35.52 5.62 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 175.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.9 pttp -134.34 162.33 32.5 Favored 'General case' 0 N--CA 1.42 -1.95 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.16 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -64.14 -18.68 64.68 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-O 121.04 0.447 . . . . 0.0 111.946 -178.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -71.48 -21.96 61.87 Favored 'General case' 0 CA--C 1.493 -1.245 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.953 -177.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -75.24 -30.8 60.64 Favored 'General case' 0 N--CA 1.42 -1.928 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.971 -178.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 20.7 m -90.22 155.46 18.99 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.042 -178.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 32.5 m -61.41 176.97 0.42 Allowed 'General case' 0 C--N 1.298 -1.651 0 C-N-CA 124.515 1.126 . . . . 0.0 112.942 176.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.1 mttp -66.36 -48.48 70.06 Favored 'General case' 0 CA--C 1.496 -1.098 0 CA-C-O 122.377 1.084 . . . . 0.0 109.902 -175.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -68.14 -1.39 5.91 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 113.597 -1.638 . . . . 0.0 112.708 -178.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.8 mp -130.51 176.5 8.11 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-O 121.251 0.548 . . . . 0.0 111.473 -175.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.73 160.77 28.01 Favored Glycine 0 N--CA 1.419 -2.468 0 N-CA-C 108.506 -1.837 . . . . 0.0 108.506 177.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.4 t -93.7 120.58 34.15 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 117.351 0.576 . . . . 0.0 110.412 -177.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.411 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 73.8 mmtt -85.15 108.72 17.83 Favored 'General case' 0 CA--C 1.455 -2.687 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 173.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.409 ' H ' ' HD2' ' A' ' 23' ' ' ARG . 1.3 mpt_? -79.68 -8.08 58.99 Favored 'General case' 0 C--N 1.282 -2.328 0 CA-C-N 114.991 -1.004 . . . . 0.0 108.64 -174.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -90.01 -27.77 19.53 Favored 'General case' 0 CA--C 1.501 -0.918 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.128 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.55 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 90.5 mmm -109.64 -19.06 13.32 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.655 -172.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.472 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 71.8 mmtt 72.84 29.64 1.85 Allowed 'General case' 0 CA--C 1.497 -1.088 0 C-N-CA 125.555 1.542 . . . . 0.0 111.568 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.55 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 27.4 p90 -147.89 158.68 44.16 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.875 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.2 m -77.44 130.8 37.51 Favored 'General case' 0 C--N 1.291 -1.97 0 CA-C-N 114.676 -1.147 . . . . 0.0 110.51 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -122.73 -178.18 3.86 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 177.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -76.05 8.2 3.42 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.307 0.958 . . . . 0.0 113.072 -176.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.411 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 3.8 p30 . . . . . 0 N--CA 1.409 -2.501 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.5 p . . . . . 0 N--CA 1.423 -1.782 0 CA-C-O 121.003 0.43 . . . . 0.0 110.361 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . 0.437 ' HB3' ' HA3' ' A' ' 7' ' ' GLY . 9.0 mpt_? -83.83 131.47 34.88 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.882 178.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.484 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 79.1 m-85 -89.79 -163.06 0.95 Allowed 'General case' 0 N--CA 1.391 -3.377 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.2 ttt -66.56 134.0 51.48 Favored 'General case' 0 C--N 1.299 -1.587 0 C-N-CA 120.279 -0.568 . . . . 0.0 109.934 -173.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 76.57 6.48 3.43 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 124.955 1.302 . . . . 0.0 111.966 -178.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . 0.437 ' HA3' ' HB3' ' A' ' 3' ' ' ARG . . . -79.02 156.37 41.84 Favored Glycine 0 N--CA 1.443 -0.839 0 N-CA-C 108.047 -2.021 . . . . 0.0 108.047 172.038 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -88.36 140.2 29.71 Favored 'General case' 0 CA--C 1.476 -1.875 0 CA-C-N 118.256 1.028 . . . . 0.0 110.733 -172.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.9 p -144.04 147.22 33.54 Favored 'General case' 0 C--N 1.272 -2.797 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.984 -175.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -110.34 -30.0 7.88 Favored 'General case' 0 C--N 1.293 -1.89 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 177.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.503 ' HD2' ' OE1' ' A' ' 13' ' ' GLU . 17.2 pttp -139.43 167.18 22.66 Favored 'General case' 0 N--CA 1.426 -1.649 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.268 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -70.73 -18.17 62.8 Favored 'General case' 0 CA--C 1.493 -1.212 0 CA-C-O 121.121 0.486 . . . . 0.0 110.911 -174.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.503 ' OE1' ' HD2' ' A' ' 11' ' ' LYS . 36.4 mt-10 -70.88 -19.13 62.65 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.119 -176.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -79.84 -24.73 41.11 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-N 115.065 -0.97 . . . . 0.0 109.314 -176.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 35.0 m -92.83 159.71 15.26 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.3 m -64.33 174.06 1.8 Allowed 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.536 177.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.6 mtpt -75.99 -33.4 59.72 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 121.655 0.741 . . . . 0.0 110.978 -171.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 36.3 m80 -81.8 6.57 15.15 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.208 178.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.2 mp -131.84 -180.0 5.73 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-O 121.066 0.46 . . . . 0.0 110.797 -178.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -148.03 163.04 28.86 Favored Glycine 0 N--CA 1.424 -2.115 0 N-CA-C 109.661 -1.376 . . . . 0.0 109.661 177.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.1 t -95.96 120.34 36.07 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 117.304 0.552 . . . . 0.0 109.714 -178.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -81.62 107.28 14.24 Favored 'General case' 0 CA--C 1.453 -2.774 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 172.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -75.56 -3.16 32.65 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.411 -173.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -90.44 -31.68 16.72 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-O 122.198 0.999 . . . . 0.0 109.081 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 87.9 mmm -111.86 -9.9 14.03 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.964 -175.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp 63.71 36.69 10.53 Favored 'General case' 0 CA--C 1.503 -0.843 0 C-N-CA 124.455 1.102 . . . . 0.0 111.852 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -143.07 159.04 43.01 Favored 'General case' 0 CA--C 1.486 -1.505 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.438 177.036 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.484 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 39.2 m -82.03 130.28 35.03 Favored 'General case' 0 C--N 1.284 -2.264 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.988 -176.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -121.31 -175.47 3.08 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 106.025 -1.843 . . . . 0.0 106.025 176.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -79.8 10.97 3.54 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 119.588 1.085 . . . . 0.0 113.115 -175.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 N--CA 1.415 -2.18 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 178.725 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.6 p . . . . . 0 N--CA 1.413 -2.295 0 CA-C-O 122.031 0.92 . . . . 0.0 112.237 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -91.15 136.82 32.82 Favored 'General case' 0 C--N 1.279 -2.498 0 CA-C-N 113.964 -1.471 . . . . 0.0 108.609 177.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.401 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 51.2 m-85 -85.19 -167.55 1.88 Allowed 'General case' 0 N--CA 1.401 -2.923 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.087 178.077 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 12.6 ttt -66.54 136.51 55.75 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 -175.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 76.46 9.58 3.06 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 124.99 1.316 . . . . 0.0 111.765 -178.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . 0.429 ' O ' ' HA ' ' A' ' 27' ' ' TYR . . . -88.14 145.45 19.16 Favored Glycine 0 N--CA 1.44 -1.08 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 173.833 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.537 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 15.3 t70 -60.91 143.02 55.83 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.704 0.802 . . . . 0.0 112.258 -177.373 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 21.1 p -153.75 148.92 26.91 Favored 'General case' 0 C--N 1.311 -1.092 0 C-N-CA 119.226 -0.99 . . . . 0.0 113.374 -177.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -106.02 -38.53 6.28 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 173.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.569 ' HG2' ' OD1' ' A' ' 14' ' ' ASP . 5.0 ptpp? -137.37 177.21 8.04 Favored 'General case' 0 N--CA 1.414 -2.258 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -175.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -74.54 -18.12 60.64 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-O 121.163 0.506 . . . . 0.0 111.038 -175.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -72.98 -21.58 60.82 Favored 'General case' 0 CA--C 1.495 -1.141 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.919 -178.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.569 ' OD1' ' HG2' ' A' ' 11' ' ' LYS . 31.0 m-20 -72.99 -27.61 61.9 Favored 'General case' 0 N--CA 1.431 -1.391 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.0 m -92.6 164.32 13.47 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.893 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.4 m -70.57 176.51 4.05 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.93 175.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -68.91 -49.9 54.16 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-O 121.542 0.687 . . . . 0.0 112.089 -170.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 55.9 m80 -76.94 15.67 0.65 Allowed 'General case' 0 C--N 1.287 -2.122 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.385 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.433 HD22 ' CE3' ' A' ' 30' ' ' TRP . 87.0 mt -122.08 174.68 6.79 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.88 144.09 11.56 Favored Glycine 0 C--N 1.306 -1.09 0 N-CA-C 110.221 -1.152 . . . . 0.0 110.221 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 39.2 t -90.23 123.02 33.68 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -174.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 41.2 mmtt -90.13 110.8 21.8 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.786 -0.571 . . . . 0.0 110.106 168.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -76.26 -12.79 60.14 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.79 -177.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -87.88 -26.28 22.83 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 -178.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.506 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 91.9 mmm -108.0 -16.2 14.35 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 114.721 -1.127 . . . . 0.0 110.687 -173.529 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.537 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 32.2 mmmt 66.29 33.04 7.4 Favored 'General case' 0 CA--C 1.492 -1.28 0 C-N-CA 124.574 1.15 . . . . 0.0 112.31 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.506 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 11.4 p90 -150.05 159.26 44.54 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.925 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.7 m -82.33 130.85 35.19 Favored 'General case' 0 C--N 1.289 -2.057 0 CA-C-N 113.806 -1.543 . . . . 0.0 110.469 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -115.84 -172.27 2.13 Favored 'General case' 0 C--N 1.291 -1.939 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 175.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.433 ' CE3' HD22 ' A' ' 19' ' ' LEU . 96.6 m95 -76.52 -19.18 58.23 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.65 1.114 . . . . 0.0 111.056 178.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 46.2 t0 . . . . . 0 C--N 1.282 -2.358 0 N-CA-C 103.873 -2.64 . . . . 0.0 103.873 177.881 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.1 p . . . . . 0 N--CA 1.431 -1.419 0 CA-C-O 121.574 0.702 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -92.29 140.73 29.3 Favored 'General case' 0 C--N 1.273 -2.721 0 CA-C-N 114.744 -1.117 . . . . 0.0 109.966 -178.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.457 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 60.2 m-85 -93.23 -165.9 1.42 Allowed 'General case' 0 N--CA 1.396 -3.16 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.919 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.475 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 10.7 ttt -62.81 135.04 57.13 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 -176.121 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 76.8 3.99 3.41 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 125.452 1.501 . . . . 0.0 111.753 -178.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.39 149.21 38.44 Favored Glycine 0 N--CA 1.439 -1.101 0 N-CA-C 108.428 -1.869 . . . . 0.0 108.428 171.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -76.63 146.34 38.27 Favored 'General case' 0 CA--C 1.483 -1.602 0 CA-C-N 117.258 0.529 . . . . 0.0 110.073 -174.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.3 p -146.02 150.7 36.48 Favored 'General case' 0 C--N 1.278 -2.505 0 C-N-CA 118.556 -1.258 . . . . 0.0 112.368 -176.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -108.16 -43.76 4.31 Favored 'General case' 0 N--CA 1.433 -1.319 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 173.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.538 ' HD2' ' OE1' ' A' ' 13' ' ' GLU . 46.1 pttt -131.2 169.91 15.29 Favored 'General case' 0 N--CA 1.419 -1.991 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.152 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -68.06 -18.76 64.77 Favored 'General case' 0 CA--C 1.491 -1.327 0 CA-C-O 121.093 0.473 . . . . 0.0 110.864 -179.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.538 ' OE1' ' HD2' ' A' ' 11' ' ' LYS . 1.2 mp0 -67.15 -24.7 65.92 Favored 'General case' 0 CA--C 1.492 -1.253 0 CA-C-N 115.084 -0.962 . . . . 0.0 111.027 -179.637 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -72.19 -26.62 62.13 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 121.419 0.628 . . . . 0.0 109.634 -178.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 18.4 m -93.49 159.19 15.35 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.793 -178.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.9 m -67.08 176.0 2.33 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.727 174.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -58.74 -57.12 14.43 Favored 'General case' 0 CA--C 1.504 -0.801 0 C-N-CA 123.909 0.884 . . . . 0.0 113.079 -171.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 28.9 m80 -79.08 15.01 1.23 Allowed 'General case' 0 C--N 1.283 -2.304 0 CA-C-N 114.928 -1.033 . . . . 0.0 112.017 -174.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.457 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 68.1 mt -123.6 169.05 11.84 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.8 154.19 25.7 Favored Glycine 0 N--CA 1.418 -2.557 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 178.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.4 t -89.24 108.93 19.89 Favored 'General case' 0 C--N 1.285 -2.223 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -177.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -70.88 112.94 7.45 Favored 'General case' 0 CA--C 1.473 -2.013 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 176.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -74.45 -8.43 56.27 Favored 'General case' 0 C--N 1.292 -1.933 0 O-C-N 124.748 1.28 . . . . 0.0 110.119 -176.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -88.97 -36.35 15.91 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 -176.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.424 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 96.9 mmm -112.74 -12.85 13.3 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 114.43 -1.259 . . . . 0.0 112.931 -171.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp 66.95 38.08 3.7 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 125.006 1.322 . . . . 0.0 111.542 -179.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.424 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 8.0 p90 -145.53 161.45 39.74 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.375 -0.83 . . . . 0.0 112.114 178.131 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 59.2 m -81.3 128.6 33.99 Favored 'General case' 0 N--CA 1.419 -1.992 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.452 -176.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.475 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -124.67 -171.65 2.4 Favored 'General case' 0 C--N 1.284 -2.245 0 N-CA-C 106.292 -1.744 . . . . 0.0 106.292 175.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -75.31 3.01 9.75 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 118.767 0.712 . . . . 0.0 112.748 -178.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.3 p30 . . . . . 0 N--CA 1.416 -2.154 0 N-CA-C 106.65 -1.611 . . . . 0.0 106.65 175.752 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.4 p . . . . . 0 N--CA 1.423 -1.779 0 CA-C-O 121.306 0.574 . . . . 0.0 110.558 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . 0.544 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 39.0 mmt180 -102.58 135.39 44.31 Favored 'General case' 0 C--N 1.291 -1.959 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.501 -179.599 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.528 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 87.5 m-85 -95.23 -161.77 0.89 Allowed 'General case' 0 N--CA 1.403 -2.777 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 174.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.581 ' HA ' ' O ' ' A' ' 28' ' ' CYS . 49.4 ttm -62.72 135.87 57.58 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 82.13 -8.82 1.24 Allowed 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 125.069 1.348 . . . . 0.0 112.115 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . 0.405 ' HA3' ' HB3' ' A' ' 3' ' ' ARG . . . -76.8 139.65 23.91 Favored Glycine 0 N--CA 1.434 -1.44 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 176.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.544 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 17.2 t70 -69.54 141.12 53.9 Favored 'General case' 0 CA--C 1.487 -1.476 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -173.466 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.414 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 23.4 p -143.42 152.77 41.95 Favored 'General case' 0 N--CA 1.414 -2.235 0 C-N-CA 119.783 -0.767 . . . . 0.0 111.51 -176.242 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -113.59 -35.72 5.14 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 174.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 45.7 pttt -141.57 177.52 8.08 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 124.45 1.1 . . . . 0.0 108.36 179.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -73.63 -16.07 61.24 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 122.227 -0.296 . . . . 0.0 111.197 -175.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -67.87 -25.24 65.42 Favored 'General case' 0 CA--C 1.496 -1.134 0 CA-C-O 121.656 0.741 . . . . 0.0 110.497 179.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -68.7 -31.78 71.12 Favored 'General case' 0 N--CA 1.425 -1.677 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.121 -179.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.9 m -86.82 159.19 19.17 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.257 -176.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.9 m -66.14 178.47 1.14 Allowed 'General case' 0 C--N 1.307 -1.283 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.288 174.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -61.46 -52.31 65.05 Favored 'General case' 0 CA--C 1.485 -1.552 0 CA-C-O 121.701 0.762 . . . . 0.0 112.246 -171.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 30.3 m-70 -74.52 3.92 6.89 Favored 'General case' 0 C--N 1.28 -2.427 0 CA-C-N 114.204 -1.362 . . . . 0.0 113.35 -175.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.0 mp -123.93 167.94 13.46 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.571 0.701 . . . . 0.0 112.781 -177.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -135.5 159.96 24.31 Favored Glycine 0 N--CA 1.433 -1.558 0 N-CA-C 109.157 -1.577 . . . . 0.0 109.157 179.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 32.1 t -94.35 130.65 40.59 Favored 'General case' 0 C--N 1.285 -2.221 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -174.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -96.95 107.21 19.69 Favored 'General case' 0 CA--C 1.474 -1.952 0 CA-C-O 121.351 0.596 . . . . 0.0 110.731 172.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -72.22 -12.04 60.99 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 114.563 -1.198 . . . . 0.0 111.837 -176.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -89.32 -26.68 20.98 Favored 'General case' 0 C--N 1.302 -1.5 0 CA-C-O 121.972 0.891 . . . . 0.0 108.858 -176.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.437 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 97.5 mmm -112.1 -8.6 14.01 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.19 -176.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm 63.45 28.75 15.48 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.846 1.258 . . . . 0.0 112.642 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.437 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 8.7 p90 -143.71 161.06 39.55 Favored 'General case' 0 C--N 1.286 -2.179 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.662 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.581 ' O ' ' HA ' ' A' ' 5' ' ' MET . 66.6 m -81.14 140.17 35.17 Favored 'General case' 0 C--N 1.285 -2.213 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.666 -179.005 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -131.52 178.53 6.66 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 105.499 -2.037 . . . . 0.0 105.499 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -68.56 -12.16 60.91 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 119.935 1.243 . . . . 0.0 113.801 -175.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 34.6 t70 . . . . . 0 N--CA 1.415 -2.194 0 CA-C-O 121.335 0.588 . . . . 0.0 109.76 -179.671 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 20.9 p . . . . . 0 N--CA 1.405 -2.709 0 CA-C-O 121.629 0.728 . . . . 0.0 110.835 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -86.06 129.86 34.71 Favored 'General case' 0 C--N 1.273 -2.728 0 CA-C-N 114.357 -1.292 . . . . 0.0 108.717 -178.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -86.55 -168.31 2.19 Favored 'General case' 0 N--CA 1.408 -2.544 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.062 178.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.441 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 12.8 ttt -69.56 140.08 53.8 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 120.828 0.347 . . . . 0.0 111.16 -172.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 74.48 -2.37 2.83 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.745 1.618 . . . . 0.0 112.253 -179.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.17 148.64 30.02 Favored Glycine 0 N--CA 1.422 -2.236 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 176.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -63.13 139.76 58.8 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 123.774 0.83 . . . . 0.0 112.636 -177.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 23.5 p -146.0 153.9 41.28 Favored 'General case' 0 C--N 1.287 -2.109 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.452 -178.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -112.47 -36.27 5.3 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 177.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -145.54 167.56 22.73 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 114.159 -1.382 . . . . 0.0 108.475 -179.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -67.72 -18.48 64.92 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.23 0.538 . . . . 0.0 111.509 -176.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -66.01 -27.26 67.99 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.853 -178.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -79.24 -27.2 42.41 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.56 -175.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.6 m -88.65 163.49 15.77 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.417 -178.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 31.4 m -69.37 172.03 7.74 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.113 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -66.18 -47.15 74.91 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.568 0.699 . . . . 0.0 112.027 -172.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 51.4 m80 -72.02 1.79 6.74 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.719 179.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.3 mp -117.65 178.47 4.38 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-O 121.093 0.473 . . . . 0.0 111.256 179.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -151.09 151.93 23.83 Favored Glycine 0 N--CA 1.423 -2.179 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 177.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 38.0 t -93.26 116.56 29.12 Favored 'General case' 0 C--N 1.27 -2.872 0 CA-C-N 117.014 0.407 . . . . 0.0 110.251 -175.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -77.33 110.52 12.13 Favored 'General case' 0 CA--C 1.461 -2.45 0 N-CA-C 106.565 -1.643 . . . . 0.0 106.565 172.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -76.8 -13.25 60.03 Favored 'General case' 0 C--N 1.286 -2.18 0 O-C-N 123.884 0.74 . . . . 0.0 109.22 -173.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -90.74 -24.71 20.3 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 122.181 0.991 . . . . 0.0 109.21 -177.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.552 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 96.8 mmm -110.0 -7.06 15.0 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.229 -175.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.536 ' N ' ' HD2' ' A' ' 26' ' ' LYS . 3.4 mptp? 61.92 26.28 15.87 Favored 'General case' 0 CA--C 1.505 -0.769 0 C-N-CA 125.271 1.428 . . . . 0.0 111.769 177.09 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.552 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 23.1 p90 -140.42 158.88 43.34 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.788 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.5 m -81.69 131.7 35.27 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.111 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.441 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -124.14 -174.17 2.94 Favored 'General case' 0 C--N 1.288 -2.102 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 176.229 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -76.61 -1.83 29.55 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 120.248 1.386 . . . . 0.0 113.203 -176.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 . . . . . 0 N--CA 1.417 -2.107 0 N-CA-C 106.439 -1.689 . . . . 0.0 106.439 179.053 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.6 p . . . . . 0 CA--C 1.494 -1.188 0 CA-C-O 121.63 0.728 . . . . 0.0 111.319 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -93.47 132.8 37.4 Favored 'General case' 0 C--N 1.278 -2.528 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.679 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.497 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 53.6 m-85 -85.05 -170.79 3.3 Favored 'General case' 0 N--CA 1.398 -3.05 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.579 176.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.3 ttt -62.97 134.09 55.63 Favored 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 -178.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 81.65 2.44 1.47 Allowed 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 125.067 1.347 . . . . 0.0 112.139 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -86.45 146.6 20.96 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 174.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.443 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 28.4 t70 -65.96 142.77 57.75 Favored 'General case' 0 CA--C 1.493 -1.222 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -175.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 26.8 p -150.99 154.72 37.61 Favored 'General case' 0 C--N 1.291 -1.954 0 C-N-CA 120.103 -0.639 . . . . 0.0 111.202 -177.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -115.12 -36.6 4.34 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.0 pttm -138.55 175.58 9.44 Favored 'General case' 0 N--CA 1.427 -1.613 0 CA-C-N 115.222 -0.899 . . . . 0.0 108.612 177.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -72.04 -16.75 62.05 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 120.512 0.196 . . . . 0.0 111.42 -174.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -61.65 -36.99 82.38 Favored 'General case' 0 CA--C 1.502 -0.888 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 179.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -63.2 -32.48 73.88 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.604 -177.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.0 m -88.59 159.18 18.01 Favored 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.316 -177.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 58.5 m -66.83 176.88 1.85 Allowed 'General case' 0 C--N 1.303 -1.416 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.55 175.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HA ' ' HE2' ' A' ' 17' ' ' LYS . 10.3 mmpt? -64.47 -52.6 57.1 Favored 'General case' 0 CA--C 1.502 -0.895 0 CA-C-O 121.192 0.52 . . . . 0.0 111.889 -171.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -72.9 9.95 1.02 Allowed 'General case' 0 C--N 1.297 -1.679 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.504 -178.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.497 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 64.8 mt -125.01 177.12 6.23 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 -175.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -151.26 166.57 30.6 Favored Glycine 0 N--CA 1.434 -1.488 0 N-CA-C 108.64 -1.784 . . . . 0.0 108.64 176.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -99.46 129.5 45.64 Favored 'General case' 0 C--N 1.288 -2.069 0 CA-C-N 118.125 0.962 . . . . 0.0 112.064 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.6 mmmt -96.53 107.53 19.96 Favored 'General case' 0 CA--C 1.473 -1.997 0 CA-C-O 121.255 0.55 . . . . 0.0 111.0 173.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -69.1 -15.3 63.4 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 114.208 -1.36 . . . . 0.0 113.169 -175.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -89.33 -27.59 20.41 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.897 0.856 . . . . 0.0 109.177 -177.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 74.7 mmm -109.54 -10.97 14.84 Favored 'General case' 0 N--CA 1.426 -1.666 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.838 -172.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.443 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 71.1 mmtt 63.61 30.22 15.01 Favored 'General case' 0 CA--C 1.5 -0.958 0 C-N-CA 124.75 1.22 . . . . 0.0 111.194 -178.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -145.35 159.43 43.07 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.301 -179.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 72.0 m -76.68 134.7 39.18 Favored 'General case' 0 C--N 1.287 -2.125 0 CA-C-N 114.519 -1.219 . . . . 0.0 111.473 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -122.09 -167.59 1.57 Allowed 'General case' 0 C--N 1.296 -1.717 0 N-CA-C 105.731 -1.951 . . . . 0.0 105.731 177.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.426 ' CE3' HD23 ' A' ' 19' ' ' LEU . 99.4 m95 -81.66 -6.14 58.73 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 119.691 1.132 . . . . 0.0 112.723 -176.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.9 t70 . . . . . 0 N--CA 1.405 -2.693 0 N-CA-C 103.821 -2.659 . . . . 0.0 103.821 178.747 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 . . . . . 0 CA--C 1.496 -1.108 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.7 p -80.38 164.62 22.96 Favored 'General case' 0 N--CA 1.433 -1.307 0 CA-C-O 121.946 0.879 . . . . 0.0 112.659 -177.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.6 mpp_? -103.17 134.67 46.2 Favored 'General case' 0 C--N 1.285 -2.196 0 CA-C-N 114.107 -1.406 . . . . 0.0 109.83 177.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.431 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 89.7 m-85 -91.38 -162.03 0.88 Allowed 'General case' 0 N--CA 1.404 -2.742 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.459 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 6.8 ttt -65.8 136.72 56.57 Favored 'General case' 0 C--N 1.32 -0.688 0 O-C-N 122.295 -0.253 . . . . 0.0 110.91 -171.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 79.52 2.68 2.22 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.061 1.344 . . . . 0.0 111.997 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -87.44 144.88 19.32 Favored Glycine 0 N--CA 1.438 -1.203 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 174.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.497 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 19.3 t70 -61.93 148.07 44.81 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.244 0.618 . . . . 0.0 112.598 -176.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.5 p -152.4 146.63 25.47 Favored 'General case' 0 N--CA 1.423 -1.81 0 C-N-CA 120.097 -0.641 . . . . 0.0 111.786 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -101.95 -44.27 5.54 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 106.726 -1.583 . . . . 0.0 106.726 172.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.56 ' HG2' ' OD1' ' A' ' 14' ' ' ASP . 4.4 ptpp? -134.52 177.47 7.75 Favored 'General case' 0 N--CA 1.409 -2.523 0 CA-C-N 113.752 -1.567 . . . . 0.0 107.549 -176.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -74.53 -19.76 60.23 Favored 'General case' 0 C--N 1.29 -2.014 0 CA-C-O 121.154 0.502 . . . . 0.0 110.959 -175.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -69.24 -23.52 63.88 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.849 -177.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.56 ' OD1' ' HG2' ' A' ' 11' ' ' LYS . 40.0 m-20 -74.78 -29.89 61.27 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-O 121.758 0.789 . . . . 0.0 109.157 -178.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.1 m -87.33 163.32 16.88 Favored 'General case' 0 N--CA 1.426 -1.658 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.226 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 m -69.97 169.25 13.65 Favored 'General case' 0 N--CA 1.419 -2.003 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 173.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -87.81 -0.19 56.62 Favored 'General case' 0 C--N 1.287 -2.152 0 CA-C-O 122.728 1.252 . . . . 0.0 111.384 -170.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 89.3 m-70 -95.08 2.05 55.11 Favored 'General case' 0 C--N 1.273 -2.748 0 CA-C-N 113.08 -1.873 . . . . 0.0 108.656 172.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.0 mp -136.41 -177.05 4.55 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.464 -175.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.64 160.55 28.52 Favored Glycine 0 N--CA 1.425 -2.067 0 N-CA-C 108.818 -1.713 . . . . 0.0 108.818 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.6 t -92.48 127.89 38.14 Favored 'General case' 0 C--N 1.285 -2.221 0 CA-C-N 117.84 0.82 . . . . 0.0 111.429 -176.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm -96.68 112.58 24.27 Favored 'General case' 0 CA--C 1.468 -2.183 0 O-C-N 121.36 -0.838 . . . . 0.0 108.894 169.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -72.73 -8.72 56.79 Favored 'General case' 0 C--N 1.294 -1.832 0 CA-C-N 114.289 -1.323 . . . . 0.0 111.51 -176.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -88.91 -27.82 20.72 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-O 122.201 1.0 . . . . 0.0 108.378 -177.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.54 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 0.9 OUTLIER -110.03 -8.44 14.82 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 114.513 -1.222 . . . . 0.0 111.03 -176.022 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.503 ' N ' ' HD2' ' A' ' 26' ' ' LYS . 3.7 mptp? 59.85 26.36 15.55 Favored 'General case' 0 CA--C 1.486 -1.499 0 C-N-CA 124.61 1.164 . . . . 0.0 110.847 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.54 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 2.5 p90 -141.27 156.62 45.86 Favored 'General case' 0 C--N 1.286 -2.164 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.521 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 59.3 m -72.29 133.53 45.07 Favored 'General case' 0 N--CA 1.411 -2.418 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.508 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.459 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -120.11 173.81 6.87 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 176.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -71.98 -0.06 10.59 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 119.59 1.086 . . . . 0.0 113.331 -175.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -162.32 158.96 24.88 Favored 'General case' 0 N--CA 1.407 -2.592 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 -178.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -108.99 -30.13 8.23 Favored 'General case' 0 C--N 1.274 -2.677 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.658 176.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.5 m -68.74 137.81 54.36 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.684 -177.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -78.69 111.44 14.79 Favored 'General case' 0 C--N 1.308 -1.239 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 177.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 10.0 t . . . . . 0 C--N 1.297 -1.69 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.666 -176.43 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 CA--C 1.498 -1.038 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 24.8 p -109.66 158.78 17.72 Favored 'General case' 0 N--CA 1.407 -2.592 0 CA-C-O 121.704 0.764 . . . . 0.0 110.58 175.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.7 mpp_? -94.04 133.88 37.04 Favored 'General case' 0 C--N 1.268 -2.977 0 CA-C-N 114.263 -1.335 . . . . 0.0 109.632 176.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.479 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 43.6 m-85 -85.07 -165.83 1.32 Allowed 'General case' 0 N--CA 1.409 -2.483 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 176.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 12.4 ttt -63.96 134.21 54.66 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 77.88 1.19 2.84 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.509 1.524 . . . . 0.0 111.66 -178.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -76.31 154.49 44.4 Favored Glycine 0 N--CA 1.44 -1.062 0 N-CA-C 109.172 -1.571 . . . . 0.0 109.172 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -74.81 143.53 43.93 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 117.099 0.449 . . . . 0.0 111.929 -174.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.448 ' O ' ' HE2' ' A' ' 26' ' ' LYS . 28.9 p -151.45 154.86 37.42 Favored 'General case' 0 N--CA 1.412 -2.331 0 C-N-CA 119.988 -0.685 . . . . 0.0 111.232 -177.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -112.83 -36.57 5.11 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 107.324 -1.361 . . . . 0.0 107.324 171.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -141.98 178.15 7.72 Favored 'General case' 0 N--CA 1.425 -1.709 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.835 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -71.4 -17.81 62.38 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 120.606 0.241 . . . . 0.0 111.311 -174.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -64.36 -26.47 68.49 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-O 121.492 0.663 . . . . 0.0 110.319 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -72.88 -29.49 63.22 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.124 -178.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.2 m -91.4 162.64 14.5 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.516 -176.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.8 m -71.35 177.83 3.72 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.575 175.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -57.65 -56.44 21.94 Favored 'General case' 0 CA--C 1.502 -0.885 0 C-N-CA 124.114 0.966 . . . . 0.0 112.293 -174.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 -77.13 19.88 0.3 Allowed 'General case' 0 C--N 1.293 -1.862 0 CA-C-N 114.801 -1.09 . . . . 0.0 112.882 -176.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.417 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 60.7 mt -132.51 167.45 19.96 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.248 0.547 . . . . 0.0 110.764 -176.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.37 148.92 20.92 Favored Glycine 0 N--CA 1.434 -1.476 0 N-CA-C 108.994 -1.642 . . . . 0.0 108.994 177.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.9 t -84.61 128.27 34.51 Favored 'General case' 0 C--N 1.285 -2.215 0 CA-C-N 117.236 0.518 . . . . 0.0 111.208 -175.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 35.0 mmtm -88.29 112.9 23.34 Favored 'General case' 0 CA--C 1.465 -2.318 0 O-C-N 121.934 -0.479 . . . . 0.0 109.796 172.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.2 mpt_? -73.95 -9.78 58.98 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.601 -1.181 . . . . 0.0 111.505 -178.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -89.34 -29.14 19.35 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 -178.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.432 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 95.0 mmm -112.44 -20.36 11.81 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 114.68 -1.145 . . . . 0.0 112.3 -171.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.448 ' HE2' ' O ' ' A' ' 9' ' ' CYS . 14.4 mmmm 69.69 36.39 2.14 Favored 'General case' 0 CA--C 1.503 -0.843 0 C-N-CA 125.458 1.503 . . . . 0.0 111.304 -178.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.432 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 3.4 p90 -144.25 160.17 41.43 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-N 114.365 -1.289 . . . . 0.0 111.696 178.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 70.2 m -79.92 130.04 34.97 Favored 'General case' 0 C--N 1.289 -2.045 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.832 -178.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.84 -174.48 2.83 Favored 'General case' 0 C--N 1.289 -2.034 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 177.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -75.45 -6.16 48.69 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -176.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -170.0 164.22 9.47 Favored 'General case' 0 N--CA 1.407 -2.611 0 N-CA-C 105.194 -2.15 . . . . 0.0 105.194 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -84.64 -18.14 36.39 Favored 'General case' 0 C--N 1.269 -2.891 0 CA-C-O 121.241 0.543 . . . . 0.0 109.619 179.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.4 m -91.2 156.4 17.87 Favored 'General case' 0 N--CA 1.432 -1.362 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -126.21 100.1 6.16 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 176.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 63.1 m . . . . . 0 C--N 1.3 -1.572 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.718 -179.012 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 . . . . . 0 CA--C 1.505 -0.77 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.7 p -96.07 -172.61 2.6 Favored 'General case' 0 N--CA 1.418 -2.029 0 CA-C-O 121.78 0.8 . . . . 0.0 109.5 -177.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -115.07 135.73 53.88 Favored 'General case' 0 N--CA 1.402 -2.842 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.618 171.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.449 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 64.4 m-85 -96.16 -159.04 0.7 Allowed 'General case' 0 N--CA 1.387 -3.619 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 175.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 11.1 ttt -67.47 135.57 53.29 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.386 -0.926 . . . . 0.0 109.661 -175.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 76.26 5.98 3.63 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.529 1.132 . . . . 0.0 111.059 -178.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.402 ' O ' ' HA ' ' A' ' 27' ' ' TYR . . . -87.25 149.7 22.2 Favored Glycine 0 N--CA 1.434 -1.493 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 175.364 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.408 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 7.2 t70 -71.22 141.84 50.62 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 123.682 0.793 . . . . 0.0 112.924 -173.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.5 p -149.95 150.34 31.7 Favored 'General case' 0 C--N 1.284 -2.279 0 C-N-CA 119.626 -0.829 . . . . 0.0 111.432 -177.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -113.76 -35.13 5.26 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 172.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.574 ' HG2' ' OD2' ' A' ' 14' ' ' ASP . 3.9 ptpp? -138.06 175.14 9.84 Favored 'General case' 0 N--CA 1.413 -2.281 0 CA-C-N 114.417 -1.265 . . . . 0.0 107.82 -176.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -75.34 -16.57 60.39 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-O 121.16 0.505 . . . . 0.0 111.443 -175.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.435 ' HB2' ' HG3' ' A' ' 11' ' ' LYS . 46.1 mt-10 -68.87 -25.99 64.9 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.818 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.574 ' OD2' ' HG2' ' A' ' 11' ' ' LYS . 45.0 m-20 -72.92 -26.79 61.53 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.109 -177.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 13.0 m -96.68 156.92 16.14 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 120.978 0.418 . . . . 0.0 110.088 -178.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.16 179.71 3.72 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 173.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -49.99 -61.46 2.13 Favored 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 127.15 2.18 . . . . 0.0 113.867 -172.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -76.25 15.57 0.56 Allowed 'General case' 0 C--N 1.29 -1.986 0 CA-C-N 114.854 -1.066 . . . . 0.0 112.746 -174.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.2 mp -135.54 176.76 8.38 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-O 120.925 0.393 . . . . 0.0 110.942 -177.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -150.38 161.06 28.83 Favored Glycine 0 N--CA 1.425 -2.088 0 N-CA-C 108.902 -1.679 . . . . 0.0 108.902 176.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.2 t -87.16 130.59 34.48 Favored 'General case' 0 C--N 1.297 -1.699 0 CA-C-N 117.554 0.677 . . . . 0.0 112.333 -176.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.566 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 74.4 mmtt -100.63 105.1 16.46 Favored 'General case' 0 CA--C 1.465 -2.312 0 CA-C-O 121.358 0.599 . . . . 0.0 109.43 170.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -72.92 -3.7 27.44 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 114.385 -1.28 . . . . 0.0 111.115 -176.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -89.77 -31.68 17.3 Favored 'General case' 0 CA--C 1.5 -0.972 0 CA-C-O 121.998 0.904 . . . . 0.0 108.694 -177.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.491 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 96.2 mmm -112.29 -7.97 13.97 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 114.537 -1.211 . . . . 0.0 111.867 -176.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.408 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 70.7 mmtt 65.35 30.01 11.23 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.723 1.209 . . . . 0.0 111.717 -179.053 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.491 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 7.0 p90 -144.42 159.79 42.14 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.27 178.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 55.9 m -81.15 131.02 35.28 Favored 'General case' 0 C--N 1.287 -2.139 0 CA-C-N 114.614 -1.176 . . . . 0.0 110.658 -178.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -116.33 -176.59 2.99 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 105.831 -1.915 . . . . 0.0 105.831 175.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -75.54 2.43 11.72 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 119.053 0.842 . . . . 0.0 113.041 -175.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.566 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 2.9 p30 -159.95 157.54 29.08 Favored 'General case' 0 N--CA 1.401 -2.919 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.409 ' CD2' HG21 ' A' ' 33' ' ' THR . 21.1 p90 -96.62 -29.73 13.67 Favored 'General case' 0 C--N 1.276 -2.611 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.252 171.538 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.409 HG21 ' CD2' ' A' ' 32' ' ' PHE . 11.0 t -171.38 166.08 7.01 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 106.118 -1.808 . . . . 0.0 106.118 176.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -73.94 107.31 6.08 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 177.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.9 p . . . . . 0 C--N 1.297 -1.715 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.361 -179.46 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 . . . . . 0 CA--C 1.503 -0.862 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.1 p -99.86 159.89 14.72 Favored 'General case' 0 N--CA 1.418 -2.074 0 C-N-CA 120.246 -0.581 . . . . 0.0 109.798 177.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.428 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 3.4 tpp180 -86.76 131.22 34.19 Favored 'General case' 0 C--N 1.276 -2.602 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 -178.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -90.25 -166.55 1.61 Allowed 'General case' 0 N--CA 1.415 -2.182 0 CA-C-O 120.818 0.342 . . . . 0.0 111.843 -178.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 16.0 ttt -64.9 140.31 58.85 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.755 -174.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 72.22 8.91 5.91 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.514 1.126 . . . . 0.0 111.577 -179.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.61 137.92 14.16 Favored Glycine 0 N--CA 1.419 -2.486 0 N-CA-C 109.681 -1.368 . . . . 0.0 109.681 175.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.543 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 18.5 t70 -56.76 143.99 34.6 Favored 'General case' 0 CA--C 1.486 -1.489 0 C-N-CA 124.449 1.1 . . . . 0.0 111.553 -178.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 26.5 p -149.43 151.91 34.8 Favored 'General case' 0 N--CA 1.42 -1.941 0 C-N-CA 119.518 -0.873 . . . . 0.0 111.957 -175.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -115.97 -33.91 4.92 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.292 -0.867 . . . . 0.0 108.71 176.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -138.73 164.04 30.59 Favored 'General case' 0 N--CA 1.42 -1.959 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 176.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -71.55 -16.5 62.32 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-O 121.317 0.58 . . . . 0.0 110.162 -177.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -67.52 -28.22 67.63 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 114.432 -1.258 . . . . 0.0 109.552 -177.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -69.08 -32.8 72.49 Favored 'General case' 0 N--CA 1.436 -1.133 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.911 -177.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 3' ' ' ARG . 69.3 m -100.4 165.74 11.3 Favored 'General case' 0 N--CA 1.429 -1.512 0 CA-C-O 121.378 0.609 . . . . 0.0 112.582 -177.408 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.3 m -64.69 172.34 2.8 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.834 -178.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -79.01 -27.43 43.26 Favored 'General case' 0 CA--C 1.488 -1.432 0 CA-C-O 121.939 0.876 . . . . 0.0 111.647 -172.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 33.9 m170 -77.92 4.14 12.78 Favored 'General case' 0 C--N 1.28 -2.439 0 CA-C-N 114.299 -1.319 . . . . 0.0 110.62 177.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.5 mp -133.14 177.1 7.93 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-O 121.285 0.564 . . . . 0.0 111.304 -177.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -150.6 152.12 24.03 Favored Glycine 0 N--CA 1.421 -2.365 0 N-CA-C 109.774 -1.33 . . . . 0.0 109.774 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 32.5 t -88.96 118.68 28.86 Favored 'General case' 0 C--N 1.292 -1.915 0 C-N-CA 123.153 0.581 . . . . 0.0 111.042 -175.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.42 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 75.3 mmtt -87.97 115.61 25.56 Favored 'General case' 0 CA--C 1.466 -2.269 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 177.199 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.1 mmt180 -73.47 -15.3 61.33 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.326 -175.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.5 pttt -90.68 -25.93 19.83 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.965 -176.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.521 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 89.4 mmm -107.01 -17.19 14.24 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 114.975 -1.012 . . . . 0.0 110.755 -173.39 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.543 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 32.2 mmmt 68.36 33.1 4.3 Favored 'General case' 0 CA--C 1.489 -1.398 0 C-N-CA 124.42 1.088 . . . . 0.0 111.118 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.521 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 7.8 p90 -153.61 166.36 33.03 Favored 'General case' 0 C--N 1.287 -2.127 0 CA-C-N 114.185 -1.371 . . . . 0.0 110.464 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.6 m -95.85 140.37 30.72 Favored 'General case' 0 C--N 1.276 -2.59 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.31 -172.41 2.35 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 177.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -76.71 9.24 2.93 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 119.883 1.219 . . . . 0.0 113.151 -176.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.42 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 4.7 p-10 -166.14 167.65 16.09 Favored 'General case' 0 N--CA 1.405 -2.677 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -108.84 -33.6 6.91 Favored 'General case' 0 C--N 1.277 -2.548 0 O-C-N 123.793 0.683 . . . . 0.0 112.078 177.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.2 t -132.5 147.84 52.37 Favored 'General case' 0 N--CA 1.432 -1.347 0 C-N-CA 119.476 -0.89 . . . . 0.0 110.786 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 50.5 p90 -74.9 155.3 37.62 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.907 -178.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.1 m . . . . . 0 C--N 1.304 -1.378 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 176.381 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 26.6 t70 . . . . . 0 CA--C 1.492 -1.281 0 CA-C-O 121.295 0.569 . . . . 0.0 109.918 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.7 p -100.52 163.7 12.24 Favored 'General case' 0 C--N 1.284 -2.274 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.164 -177.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.503 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 39.6 mmt180 -80.12 131.48 35.75 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-N 114.565 -1.198 . . . . 0.0 109.524 178.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.426 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 55.8 m-85 -90.91 -158.88 0.58 Allowed 'General case' 0 N--CA 1.397 -3.109 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 173.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.1 ttt -71.66 137.28 47.75 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 120.31 -0.556 . . . . 0.0 109.901 -173.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 77.61 2.36 3.01 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.137 1.375 . . . . 0.0 111.266 -178.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.38 142.9 26.56 Favored Glycine 0 N--CA 1.43 -1.713 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 174.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.503 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 12.7 t70 -69.32 144.54 53.5 Favored 'General case' 0 CA--C 1.492 -1.259 0 C-N-CA 123.339 0.656 . . . . 0.0 111.116 -176.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.401 ' O ' ' HE2' ' A' ' 26' ' ' LYS . 32.0 p -152.47 155.97 38.53 Favored 'General case' 0 C--N 1.29 -1.991 0 C-N-CA 119.65 -0.82 . . . . 0.0 111.883 -176.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -113.73 -36.93 4.71 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 171.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.4 pttm -135.68 167.52 20.98 Favored 'General case' 0 N--CA 1.426 -1.666 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.153 -178.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -67.46 -19.13 65.31 Favored 'General case' 0 CA--C 1.488 -1.411 0 CA-C-O 120.994 0.426 . . . . 0.0 111.49 -178.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -70.94 -23.7 62.29 Favored 'General case' 0 CA--C 1.497 -1.095 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.34 -177.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -77.16 -27.98 53.94 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.1 -178.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 20.8 m -89.68 158.95 17.35 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 59.1 m -65.23 169.9 5.18 Favored 'General case' 0 N--CA 1.421 -1.923 0 CA-C-O 121.448 0.642 . . . . 0.0 110.632 174.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -66.71 -47.91 70.88 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.647 -169.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 47.5 m80 -64.82 -3.9 3.84 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 114.872 -1.058 . . . . 0.0 113.196 179.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.7 mp -120.96 -178.77 3.83 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.289 0.566 . . . . 0.0 111.583 -177.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -148.18 153.16 25.1 Favored Glycine 0 N--CA 1.419 -2.471 0 N-CA-C 110.27 -1.132 . . . . 0.0 110.27 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.3 t -86.31 127.78 34.83 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-O 120.6 0.238 . . . . 0.0 110.481 -177.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.501 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 73.1 mmtt -92.51 113.57 25.88 Favored 'General case' 0 CA--C 1.46 -2.497 0 CA-C-O 121.24 0.543 . . . . 0.0 110.439 176.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -71.45 -12.78 61.57 Favored 'General case' 0 C--N 1.29 -1.979 0 CA-C-N 113.474 -1.694 . . . . 0.0 112.091 -175.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.429 ' HB3' ' HZ2' ' A' ' 24' ' ' LYS . 3.3 mmmp? -90.38 -30.66 17.27 Favored 'General case' 0 C--N 1.297 -1.702 0 C-N-CA 119.457 -0.897 . . . . 0.0 109.633 -177.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.429 ' HB3' ' CD2' ' A' ' 27' ' ' TYR . 16.5 mmt -113.15 -13.84 12.97 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -174.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.404 ' HA ' ' HD2' ' A' ' 26' ' ' LYS . 14.5 mmmm 66.81 36.67 4.42 Favored 'General case' 0 CA--C 1.498 -1.055 0 C-N-CA 124.444 1.098 . . . . 0.0 110.767 -179.027 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.429 ' CD2' ' HB3' ' A' ' 25' ' ' MET . 10.0 p90 -142.99 159.84 41.49 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.657 177.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.426 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 42.2 m -84.72 129.47 34.83 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.938 -176.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.16 -173.8 2.64 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -79.62 8.46 6.48 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 119.775 1.17 . . . . 0.0 113.1 -176.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.501 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 3.3 p-10 -168.18 169.5 10.91 Favored 'General case' 0 N--CA 1.409 -2.479 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -179.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -111.92 -32.8 6.48 Favored 'General case' 0 C--N 1.279 -2.481 0 O-C-N 123.539 0.524 . . . . 0.0 110.989 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 7.2 p -48.0 116.94 1.68 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.724 1.209 . . . . 0.0 113.933 -175.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -112.63 125.51 54.36 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.646 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.9 t . . . . . 0 C--N 1.298 -1.663 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.622 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 . . . . . 0 CA--C 1.511 -0.555 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 13.1 p -87.22 168.93 12.78 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-O 121.854 0.835 . . . . 0.0 112.397 -177.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -94.48 132.04 39.56 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.08 176.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.455 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 70.3 m-85 -92.09 -162.96 0.98 Allowed 'General case' 0 N--CA 1.398 -3.029 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 175.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.7 ttt -61.88 137.56 58.26 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 120.51 0.195 . . . . 0.0 110.57 -175.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 76.84 -5.09 2.24 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.926 1.291 . . . . 0.0 111.888 -179.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.92 146.39 36.58 Favored Glycine 0 N--CA 1.435 -1.394 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 176.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.46 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 16.2 t70 -73.23 145.37 46.26 Favored 'General case' 0 CA--C 1.485 -1.548 0 CA-C-O 120.947 0.404 . . . . 0.0 111.081 -176.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.7 p -153.73 152.75 31.12 Favored 'General case' 0 N--CA 1.41 -2.472 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.459 -178.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -113.34 -32.88 6.12 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 173.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -131.71 165.44 23.72 Favored 'General case' 0 N--CA 1.417 -2.097 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 176.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -70.03 -16.18 63.12 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 121.552 0.691 . . . . 0.0 110.469 -175.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -72.92 -23.75 60.74 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.974 -177.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -76.72 -16.24 59.56 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.154 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 33.9 m -99.14 156.56 16.89 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.805 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 36.4 m -64.45 173.82 1.95 Allowed 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.797 176.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -60.8 -51.91 67.31 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.63 1.172 . . . . 0.0 113.024 -171.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 41.3 m80 -70.82 2.37 4.33 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 114.202 -1.363 . . . . 0.0 113.237 -178.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.6 mp -122.52 173.17 7.85 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.564 0.697 . . . . 0.0 112.561 -177.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -138.97 156.92 24.61 Favored Glycine 0 N--CA 1.43 -1.766 0 N-CA-C 108.304 -1.919 . . . . 0.0 108.304 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.3 t -100.74 121.57 41.88 Favored 'General case' 0 C--N 1.286 -2.159 0 CA-C-N 117.774 0.787 . . . . 0.0 110.783 -175.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -75.31 110.66 9.85 Favored 'General case' 0 CA--C 1.461 -2.445 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 171.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -77.36 -11.55 59.85 Favored 'General case' 0 C--N 1.291 -1.967 0 O-C-N 124.531 1.145 . . . . 0.0 109.578 -176.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -89.59 -27.69 20.05 Favored 'General case' 0 N--CA 1.433 -1.3 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.441 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 93.4 mmm -112.84 -6.82 13.8 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -172.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.46 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 4.9 mptp? 59.65 33.13 21.88 Favored 'General case' 0 CA--C 1.495 -1.17 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.441 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 17.3 p90 -144.66 153.3 41.6 Favored 'General case' 0 CA--C 1.486 -1.49 0 C-N-CA 118.881 -1.128 . . . . 0.0 112.946 177.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 39.7 m -80.04 131.42 35.78 Favored 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 113.966 -1.47 . . . . 0.0 110.046 -179.264 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -124.13 175.5 6.97 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 178.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -70.63 -4.66 24.45 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -175.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -175.81 159.65 2.28 Favored 'General case' 0 N--CA 1.418 -2.03 0 N-CA-C 103.59 -2.745 . . . . 0.0 103.59 175.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.2 p90 -100.02 -8.78 23.43 Favored 'General case' 0 C--N 1.279 -2.486 0 C-N-CA 120.114 -0.634 . . . . 0.0 112.672 -178.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.9 p -84.21 -94.49 0.07 Allowed 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -175.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -137.94 106.67 5.91 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 61.2 m . . . . . 0 C--N 1.298 -1.65 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.323 179.433 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 28.9 t70 . . . . . 0 CA--C 1.508 -0.67 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.9 p -116.36 166.33 12.18 Favored 'General case' 0 C--N 1.299 -1.611 0 CA-C-O 121.281 0.562 . . . . 0.0 111.25 -177.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 33.9 mmt180 -82.09 125.93 31.42 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 115.004 -0.998 . . . . 0.0 108.425 176.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.481 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 76.9 m-85 -88.39 -164.91 1.2 Allowed 'General case' 0 N--CA 1.387 -3.625 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.532 178.28 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.496 ' HA ' ' O ' ' A' ' 28' ' ' CYS . 16.3 ttt -63.97 134.03 54.3 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 120.817 0.342 . . . . 0.0 110.354 -173.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 78.79 -1.77 2.35 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 125.631 1.572 . . . . 0.0 111.717 -179.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.3 145.06 32.71 Favored Glycine 0 N--CA 1.439 -1.105 0 N-CA-C 110.201 -1.16 . . . . 0.0 110.201 176.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.416 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 13.5 t70 -67.7 144.9 55.24 Favored 'General case' 0 CA--C 1.495 -1.151 0 C-N-CA 123.117 0.567 . . . . 0.0 111.742 -177.268 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.1 p -149.36 161.3 42.33 Favored 'General case' 0 N--CA 1.419 -1.982 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.201 -177.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -118.25 -32.34 4.71 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 172.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.8 pttt -147.42 177.28 9.37 Favored 'General case' 0 N--CA 1.426 -1.663 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 178.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -71.84 -16.32 62.16 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -175.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.24 -30.64 71.68 Favored 'General case' 0 CA--C 1.488 -1.428 0 CA-C-O 121.317 0.58 . . . . 0.0 110.498 177.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -68.83 -32.27 71.84 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.893 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 17.7 m -94.99 155.26 16.8 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.109 -177.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 25.1 m -60.77 173.47 0.74 Allowed 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 123.885 0.874 . . . . 0.0 111.351 175.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -68.54 -39.4 81.13 Favored 'General case' 0 CA--C 1.5 -0.956 0 CA-C-O 121.884 0.85 . . . . 0.0 111.919 -171.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 20.2 m170 -86.87 9.25 19.81 Favored 'General case' 0 C--N 1.278 -2.527 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.206 -176.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.465 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 68.8 mt -126.71 162.83 24.88 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 -178.012 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -139.39 150.96 21.64 Favored Glycine 0 C--N 1.299 -1.51 0 N-CA-C 110.754 -0.939 . . . . 0.0 110.754 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -87.08 106.21 17.7 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -176.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -64.3 114.9 4.56 Favored 'General case' 0 CA--C 1.468 -2.193 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 175.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -65.62 -24.1 66.97 Favored 'General case' 0 C--N 1.308 -1.227 0 O-C-N 125.237 1.585 . . . . 0.0 110.475 -175.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.413 ' HZ1' ' HB3' ' A' ' 24' ' ' LYS . 2.8 mmmp? -90.05 -21.47 22.31 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 119.597 -0.841 . . . . 0.0 110.695 -168.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -112.3 -29.98 7.35 Favored 'General case' 0 N--CA 1.419 -2.018 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.334 -176.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp 72.06 49.59 0.24 Allowed 'General case' 0 CA--C 1.494 -1.188 0 C-N-CA 125.227 1.411 . . . . 0.0 110.925 -171.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -145.04 160.05 41.99 Favored 'General case' 0 CA--C 1.486 -1.483 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.233 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.496 ' O ' ' HA ' ' A' ' 5' ' ' MET . 56.3 m -85.57 122.81 30.22 Favored 'General case' 0 C--N 1.282 -2.344 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.252 -177.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.49 -165.18 1.17 Allowed 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 106.317 -1.735 . . . . 0.0 106.317 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -75.84 -5.84 47.87 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -176.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -170.65 177.43 3.93 Favored 'General case' 0 N--CA 1.41 -2.432 0 N-CA-C 105.92 -1.881 . . . . 0.0 105.92 173.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 36.6 p90 -102.26 -3.31 27.48 Favored 'General case' 0 C--N 1.273 -2.721 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 -172.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.9 m -77.67 149.11 34.7 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.099 0.476 . . . . 0.0 110.764 -174.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -134.07 147.43 50.9 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 47.2 m . . . . . 0 C--N 1.294 -1.845 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.892 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 . . . . . 0 CA--C 1.506 -0.725 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.5 p -109.45 172.21 6.99 Favored 'General case' 0 N--CA 1.424 -1.767 0 CA-C-O 121.649 0.738 . . . . 0.0 111.758 -177.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.72 135.42 41.16 Favored 'General case' 0 C--N 1.283 -2.284 0 CA-C-N 114.388 -1.278 . . . . 0.0 109.476 176.328 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.473 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 87.7 m-85 -91.46 -162.75 0.95 Allowed 'General case' 0 N--CA 1.399 -2.992 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 176.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.416 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 10.5 ttt -64.44 135.35 56.01 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 -175.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 75.77 9.67 3.45 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.828 1.251 . . . . 0.0 111.938 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.34 144.22 17.36 Favored Glycine 0 N--CA 1.434 -1.44 0 N-CA-C 109.161 -1.575 . . . . 0.0 109.161 173.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -62.47 145.6 53.75 Favored 'General case' 0 CA--C 1.493 -1.217 0 C-N-CA 123.079 0.551 . . . . 0.0 112.138 -176.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 21.6 p -153.47 155.13 35.71 Favored 'General case' 0 N--CA 1.422 -1.85 0 C-N-CA 120.011 -0.676 . . . . 0.0 110.757 -179.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -121.44 -34.33 3.47 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 172.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.6 pttt -131.36 174.09 10.42 Favored 'General case' 0 N--CA 1.42 -1.974 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 176.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -74.03 -16.06 61.06 Favored 'General case' 0 C--N 1.297 -1.717 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 -174.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -71.19 -24.7 62.27 Favored 'General case' 0 CA--C 1.483 -1.632 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.732 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -69.54 -25.54 64.06 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.609 -178.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 25.7 m -96.58 155.61 16.69 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.709 -178.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.7 m -66.13 178.01 1.26 Allowed 'General case' 0 C--N 1.291 -1.977 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.421 176.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 36.3 mmtp -57.61 -55.64 32.26 Favored 'General case' 0 CA--C 1.505 -0.763 0 C-N-CA 124.304 1.041 . . . . 0.0 113.066 -171.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 39.5 m80 -72.8 1.47 8.51 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 115.204 -0.907 . . . . 0.0 113.342 -176.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.3 mp -124.7 166.95 15.25 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-O 121.682 0.753 . . . . 0.0 111.961 -175.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -135.46 161.88 24.77 Favored Glycine 0 N--CA 1.419 -2.467 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 178.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.4 t -88.23 122.1 31.38 Favored 'General case' 0 C--N 1.285 -2.22 0 CA-C-N 116.92 0.36 . . . . 0.0 110.851 -176.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -83.9 114.37 21.62 Favored 'General case' 0 CA--C 1.465 -2.316 0 C-N-CA 119.426 -0.91 . . . . 0.0 110.06 175.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.457 ' NH1' ' HB2' ' A' ' 32' ' ' PHE . 6.5 mpt_? -67.11 -24.17 65.91 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 113.804 -1.544 . . . . 0.0 110.222 -178.392 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -87.39 -26.38 23.35 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 115.263 -0.88 . . . . 0.0 109.569 -174.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.501 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 76.3 mmm -110.4 -15.66 13.88 Favored 'General case' 0 C--N 1.291 -1.96 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.007 -170.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm 62.56 33.35 15.96 Favored 'General case' 0 CA--C 1.496 -1.124 0 C-N-CA 124.856 1.263 . . . . 0.0 110.348 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.501 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 3.3 p90 -151.18 161.23 43.1 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.419 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 57.6 m -79.28 135.36 36.73 Favored 'General case' 0 C--N 1.278 -2.536 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.719 -177.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.416 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -130.46 -178.89 4.96 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 176.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -71.91 0.38 9.36 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -175.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -166.48 -178.24 4.36 Favored 'General case' 0 N--CA 1.416 -2.152 0 N-CA-C 105.034 -2.21 . . . . 0.0 105.034 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.457 ' HB2' ' NH1' ' A' ' 23' ' ' ARG . 43.0 p90 -132.66 -21.81 2.19 Favored 'General case' 0 C--N 1.275 -2.637 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -171.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 44.3 p -66.84 157.96 31.71 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -173.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -91.19 97.64 11.26 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 63.6 m . . . . . 0 C--N 1.297 -1.706 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.293 -179.6 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 CA--C 1.507 -0.685 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.2 p -136.19 169.02 18.31 Favored 'General case' 0 N--CA 1.411 -2.421 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -95.29 132.7 40.0 Favored 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.205 177.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.411 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 78.7 m-85 -92.11 -165.43 1.35 Allowed 'General case' 0 N--CA 1.409 -2.505 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.867 -177.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.2 ttt -61.61 136.06 57.87 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -176.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 78.58 -4.99 2.1 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.571 1.149 . . . . 0.0 111.743 -178.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.13 147.72 36.65 Favored Glycine 0 N--CA 1.44 -1.089 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 174.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -63.66 143.71 57.61 Favored 'General case' 0 CA--C 1.484 -1.563 0 C-N-CA 123.25 0.62 . . . . 0.0 112.243 -174.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.7 p -152.9 147.68 26.27 Favored 'General case' 0 C--N 1.279 -2.496 0 C-N-CA 118.544 -1.262 . . . . 0.0 111.192 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -125.79 -23.29 4.02 Favored 'General case' 0 N--CA 1.424 -1.733 0 CA-C-N 114.642 -1.163 . . . . 0.0 108.646 172.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -139.64 165.08 28.21 Favored 'General case' 0 N--CA 1.424 -1.752 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 176.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -71.69 -15.69 62.22 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.232 0.539 . . . . 0.0 110.634 -176.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -65.3 -28.15 69.12 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 114.838 -1.073 . . . . 0.0 110.931 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -73.06 -30.12 63.47 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.206 -176.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 12.2 m -95.77 155.58 16.69 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.773 -176.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 18.3 m -61.67 171.15 1.65 Allowed 'General case' 0 C--N 1.304 -1.372 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.673 174.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -72.05 -42.89 65.75 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-O 121.281 0.562 . . . . 0.0 110.933 -173.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 36.0 m80 -64.03 0.35 0.93 Allowed 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 114.855 -1.066 . . . . 0.0 112.788 175.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.6 mp -128.73 -175.98 3.7 Favored 'General case' 0 N--CA 1.421 -1.916 0 CA-C-O 121.078 0.466 . . . . 0.0 110.616 -178.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -152.28 161.29 29.34 Favored Glycine 0 N--CA 1.418 -2.556 0 N-CA-C 108.918 -1.673 . . . . 0.0 108.918 175.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.3 t -87.6 131.62 34.35 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-N 117.446 0.623 . . . . 0.0 111.136 -178.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -103.1 107.52 18.36 Favored 'General case' 0 CA--C 1.469 -2.148 0 CA-C-O 121.477 0.656 . . . . 0.0 110.259 172.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -74.75 -5.32 42.71 Favored 'General case' 0 C--N 1.293 -1.853 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.627 -177.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -89.03 -29.98 19.06 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 95.8 mmm -112.65 -9.98 13.69 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 114.791 -1.095 . . . . 0.0 112.589 -177.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp 65.15 28.71 12.15 Favored 'General case' 0 CA--C 1.504 -0.799 0 C-N-CA 124.901 1.28 . . . . 0.0 111.306 -178.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.3 p90 -145.56 162.44 37.45 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-N 114.849 -1.069 . . . . 0.0 111.747 179.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 52.3 m -77.24 135.21 38.45 Favored 'General case' 0 C--N 1.287 -2.14 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.589 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -124.67 -178.81 4.26 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 176.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -71.04 -3.92 22.24 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.471 1.285 . . . . 0.0 114.471 -175.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -163.13 162.05 25.44 Favored 'General case' 0 N--CA 1.41 -2.446 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 7.3 p90 -103.06 -0.53 30.59 Favored 'General case' 0 C--N 1.272 -2.793 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.372 -178.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 33.5 m -82.9 88.19 6.82 Favored 'General case' 0 N--CA 1.428 -1.562 0 CA-C-O 122.097 0.951 . . . . 0.0 110.728 -174.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -81.83 113.25 19.66 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 114.942 -1.026 . . . . 0.0 108.956 178.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 31.5 p . . . . . 0 C--N 1.291 -1.975 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.847 -179.631 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 . . . . . 0 CA--C 1.485 -1.547 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.4 p -127.37 169.4 13.63 Favored 'General case' 0 N--CA 1.413 -2.278 0 CA-C-O 121.385 0.612 . . . . 0.0 110.529 179.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.44 ' HB3' ' HA3' ' A' ' 7' ' ' GLY . 8.6 mpt_? -99.06 137.07 38.12 Favored 'General case' 0 C--N 1.285 -2.223 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.828 176.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.506 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 74.0 m-85 -86.98 -166.99 1.73 Allowed 'General case' 0 N--CA 1.399 -2.991 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.572 174.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 13.0 ttt -60.56 133.62 56.27 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 -175.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 74.99 5.59 4.31 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.618 1.167 . . . . 0.0 112.023 -178.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.44 ' HA3' ' HB3' ' A' ' 3' ' ' ARG . . . -80.03 160.84 44.98 Favored Glycine 0 N--CA 1.442 -0.932 0 N-CA-C 109.22 -1.552 . . . . 0.0 109.22 173.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.43 141.52 45.03 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -174.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.2 p -151.19 155.13 38.21 Favored 'General case' 0 N--CA 1.423 -1.775 0 C-N-CA 119.828 -0.749 . . . . 0.0 111.915 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -119.42 -39.23 2.91 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 124.725 1.21 . . . . 0.0 108.169 172.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.8 pttm -132.36 175.42 9.3 Favored 'General case' 0 N--CA 1.423 -1.785 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -74.84 -17.43 60.6 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 121.1 0.476 . . . . 0.0 110.294 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -69.68 -23.43 63.44 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.333 -177.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -76.81 -25.14 52.94 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 -177.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 39.5 m -91.73 159.66 15.73 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.758 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 69.9 m -67.09 178.66 1.36 Allowed 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.255 176.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -55.23 -61.29 2.43 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-O 121.855 0.836 . . . . 0.0 112.587 -172.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 63.8 m80 -78.93 22.06 0.4 Allowed 'General case' 0 C--N 1.281 -2.372 0 CA-C-N 113.93 -1.486 . . . . 0.0 112.362 -174.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.506 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 61.6 mt -131.49 157.77 42.64 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 120.893 0.378 . . . . 0.0 110.141 -178.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -135.12 152.28 20.75 Favored Glycine 0 N--CA 1.43 -1.761 0 N-CA-C 108.95 -1.66 . . . . 0.0 108.95 177.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.6 t -87.72 123.85 32.96 Favored 'General case' 0 C--N 1.287 -2.129 0 CA-C-N 117.293 0.546 . . . . 0.0 111.174 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.5 mmtm -87.16 108.9 19.12 Favored 'General case' 0 CA--C 1.468 -2.188 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.114 172.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? -69.45 -5.0 20.95 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 114.336 -1.302 . . . . 0.0 112.06 -177.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -87.82 -39.49 14.81 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 -176.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 93.1 mmm -113.17 -3.35 13.93 Favored 'General case' 0 N--CA 1.427 -1.582 0 CA-C-N 114.519 -1.219 . . . . 0.0 112.136 -175.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.422 ' HD3' ' HA ' ' A' ' 26' ' ' LYS . 32.6 mmtp 55.11 45.67 25.62 Favored 'General case' 0 C--O 1.248 1.007 0 C-N-CA 124.555 1.142 . . . . 0.0 113.454 -178.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -142.14 162.81 34.54 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.945 176.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 61.4 m -81.76 127.36 32.87 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 115.316 -0.857 . . . . 0.0 111.288 -177.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -118.91 -176.12 3.04 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 106.516 -1.661 . . . . 0.0 106.516 177.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -73.34 -9.95 59.24 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -176.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -171.61 151.43 2.94 Favored 'General case' 0 N--CA 1.425 -1.715 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 176.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -76.03 -58.18 3.43 Favored 'General case' 0 C--N 1.279 -2.472 0 C-N-CA 119.971 -0.691 . . . . 0.0 109.353 175.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.5 m -162.92 80.88 0.49 Allowed 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 177.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -95.39 113.43 25.09 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.134 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.9 m . . . . . 0 C--N 1.298 -1.671 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.185 179.785 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 . . . . . 0 CA--C 1.476 -1.871 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.9 p -71.18 150.79 45.01 Favored 'General case' 0 N--CA 1.418 -2.06 0 C-N-CA 119.191 -1.004 . . . . 0.0 111.08 178.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 28.5 mmt180 -95.07 143.4 26.56 Favored 'General case' 0 C--N 1.27 -2.86 0 CA-C-N 113.939 -1.482 . . . . 0.0 108.369 -177.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.43 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 65.6 m-85 -92.65 -165.71 1.4 Allowed 'General case' 0 N--CA 1.394 -3.23 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.9 ttt -64.32 138.14 58.28 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -175.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 74.1 6.53 4.76 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.576 1.15 . . . . 0.0 111.815 -179.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -85.96 146.95 21.54 Favored Glycine 0 N--CA 1.436 -1.333 0 N-CA-C 109.819 -1.313 . . . . 0.0 109.819 174.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.409 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 16.2 t70 -67.11 139.92 57.55 Favored 'General case' 0 CA--C 1.495 -1.172 0 C-N-CA 123.694 0.798 . . . . 0.0 112.498 -176.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.549 ' O ' ' HE2' ' A' ' 26' ' ' LYS . 31.3 p -157.63 157.53 33.8 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.409 -177.185 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -113.29 -37.42 4.71 Favored 'General case' 0 CA--C 1.507 -0.678 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 169.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 23.9 pttm -126.42 170.2 12.21 Favored 'General case' 0 N--CA 1.418 -2.034 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.01 -176.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -73.01 -19.26 61.24 Favored 'General case' 0 CA--C 1.486 -1.514 0 CA-C-O 121.122 0.487 . . . . 0.0 110.053 -176.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -72.44 -24.84 61.27 Favored 'General case' 0 CA--C 1.482 -1.66 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.996 -177.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -71.0 -29.2 65.09 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 -178.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 33.5 m -88.76 162.29 16.31 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.266 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 82.0 m -71.7 178.03 3.82 Favored 'General case' 0 N--CA 1.427 -1.62 0 CA-C-O 121.048 0.451 . . . . 0.0 111.48 176.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -54.84 -59.44 4.72 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.453 1.101 . . . . 0.0 113.926 -169.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 27.1 m170 -81.86 21.85 0.81 Allowed 'General case' 0 C--N 1.285 -2.229 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.076 -173.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 51.6 mt -125.02 167.92 14.06 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -140.87 146.2 17.35 Favored Glycine 0 N--CA 1.423 -2.207 0 N-CA-C 108.671 -1.772 . . . . 0.0 108.671 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 47.5 t -88.25 127.32 35.46 Favored 'General case' 0 C--N 1.283 -2.325 0 CA-C-O 121.333 0.587 . . . . 0.0 110.423 -176.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 56.4 mmtt -93.59 107.95 19.74 Favored 'General case' 0 N--CA 1.413 -2.302 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.0 175.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -72.48 -5.2 35.11 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.023 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -86.23 -37.52 18.54 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.476 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 95.6 mmm -112.86 -9.57 13.64 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.368 -174.314 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.549 ' HE2' ' O ' ' A' ' 9' ' ' CYS . 13.9 mmmm 66.4 35.04 5.91 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 124.738 1.215 . . . . 0.0 112.275 -179.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.476 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 14.2 p90 -147.18 160.46 42.43 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.879 178.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.43 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 57.1 m -79.78 130.71 35.55 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.308 -178.037 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.32 -175.53 3.02 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -79.4 1.97 23.41 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.321 0.964 . . . . 0.0 112.789 -178.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -176.27 151.13 0.98 Allowed 'General case' 0 N--CA 1.425 -1.69 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 -177.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.472 ' O ' ' HB ' ' A' ' 33' ' ' THR . 29.3 p90 -101.77 -1.92 31.29 Favored 'General case' 0 C--N 1.283 -2.299 0 O-C-N 123.69 0.619 . . . . 0.0 112.522 -177.06 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.472 ' HB ' ' O ' ' A' ' 32' ' ' PHE . 94.8 m 77.82 98.44 0.06 Allowed 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.817 0.847 . . . . 0.0 109.471 -172.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -81.68 100.22 9.34 Favored 'General case' 0 C--N 1.294 -1.819 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.414 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 46.7 m . . . . . 0 C--N 1.301 -1.522 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.503 179.35 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 . . . . . 0 CA--C 1.486 -1.517 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.4 p -81.09 163.9 22.83 Favored 'General case' 0 N--CA 1.419 -2.001 0 CA-C-O 121.633 0.73 . . . . 0.0 110.883 178.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.556 ' HB2' ' SG ' ' A' ' 28' ' ' CYS . 20.6 mmt180 -90.85 132.16 36.06 Favored 'General case' 0 C--N 1.28 -2.456 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 178.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.442 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 48.0 m-85 -84.93 -165.66 1.26 Allowed 'General case' 0 N--CA 1.397 -3.1 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 172.144 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.7 ttt -66.39 137.53 56.94 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -175.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 77.47 1.09 2.98 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.74 1.216 . . . . 0.0 111.436 -178.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.18 136.27 16.5 Favored Glycine 0 N--CA 1.429 -1.768 0 N-CA-C 108.877 -1.689 . . . . 0.0 108.877 174.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -60.0 140.49 56.74 Favored 'General case' 0 CA--C 1.492 -1.26 0 C-N-CA 123.266 0.627 . . . . 0.0 112.588 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 19.2 p -141.51 154.95 45.81 Favored 'General case' 0 N--CA 1.416 -2.174 0 C-N-CA 119.585 -0.846 . . . . 0.0 111.249 -176.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -118.14 -39.64 3.04 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 175.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.9 pttm -135.23 172.9 12.35 Favored 'General case' 0 N--CA 1.422 -1.872 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.099 -178.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -75.6 -16.13 60.26 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-O 121.022 0.439 . . . . 0.0 111.025 -176.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -70.37 -24.07 62.89 Favored 'General case' 0 CA--C 1.489 -1.4 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.486 -178.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -72.23 -31.55 65.93 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -178.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 17.3 m -89.28 155.08 19.61 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.504 -176.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.9 m -67.01 178.03 1.53 Allowed 'General case' 0 C--N 1.302 -1.466 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.562 177.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -63.07 -55.12 28.17 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -171.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -74.09 11.48 0.91 Allowed 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.945 -178.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.442 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 62.2 mt -128.21 -179.42 5.0 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 -177.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -161.5 165.36 35.52 Favored Glycine 0 N--CA 1.418 -2.554 0 N-CA-C 108.936 -1.666 . . . . 0.0 108.936 177.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.3 t -92.51 124.83 36.84 Favored 'General case' 0 C--N 1.289 -2.052 0 CA-C-O 121.343 0.592 . . . . 0.0 110.31 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.407 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 30.1 mmtp -99.86 112.29 24.56 Favored 'General case' 0 C--N 1.287 -2.124 0 CA-C-O 121.103 0.477 . . . . 0.0 110.374 173.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.9 mpt_? -73.11 -10.84 60.21 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 114.357 -1.292 . . . . 0.0 111.109 -177.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -85.26 -30.21 23.99 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -177.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 80.8 mmm -111.22 -10.69 14.27 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 114.407 -1.27 . . . . 0.0 110.856 -173.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.587 ' N ' ' HD2' ' A' ' 26' ' ' LYS . 9.6 mptt 62.1 26.1 15.68 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 125.816 1.646 . . . . 0.0 110.864 179.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -142.59 165.97 25.95 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.605 179.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.556 ' SG ' ' HB2' ' A' ' 3' ' ' ARG . 63.1 m -81.38 131.28 35.28 Favored 'General case' 0 N--CA 1.414 -2.253 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.37 -179.163 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.406 ' C ' ' H ' ' A' ' 31' ' ' ASP . . . -118.55 -175.82 2.96 Favored 'General case' 0 C--N 1.283 -2.308 0 N-CA-C 105.583 -2.006 . . . . 0.0 105.583 176.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.417 ' HA ' HD23 ' A' ' 19' ' ' LEU . 98.5 m95 -80.87 19.52 0.85 Allowed 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 119.303 0.956 . . . . 0.0 110.349 178.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.406 ' H ' ' C ' ' A' ' 29' ' ' ALA . 36.1 t70 -159.5 134.73 8.24 Favored 'General case' 0 N--CA 1.401 -2.878 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.387 -170.365 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 47.0 p90 -81.35 -174.19 4.78 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.735 177.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.9 m -94.73 106.8 18.8 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-O 121.537 0.684 . . . . 0.0 112.269 -178.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -116.21 98.77 6.79 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.363 -0.976 . . . . 0.0 108.363 176.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 50.2 m . . . . . 0 C--O 1.25 1.109 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 179.257 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 . . . . . 0 CA--C 1.496 -1.128 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.3 p -86.28 158.55 19.66 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 121.818 0.818 . . . . 0.0 111.796 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 39.5 mmt180 -86.92 133.95 33.56 Favored 'General case' 0 C--N 1.282 -2.332 0 CA-C-N 114.3 -1.318 . . . . 0.0 110.079 178.445 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.404 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 25.0 m-85 -84.71 -166.6 1.52 Allowed 'General case' 0 N--CA 1.399 -3.008 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.156 174.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.484 ' HA ' ' O ' ' A' ' 28' ' ' CYS . 11.3 ttt -65.74 138.8 58.19 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 -176.221 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 77.03 2.6 3.27 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.205 1.402 . . . . 0.0 111.832 -179.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -82.62 146.69 24.75 Favored Glycine 0 N--CA 1.435 -1.427 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 175.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.41 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 14.5 t70 -64.3 145.14 56.5 Favored 'General case' 0 CA--C 1.492 -1.251 0 C-N-CA 123.106 0.562 . . . . 0.0 112.207 -178.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 31.0 p -152.59 149.24 28.26 Favored 'General case' 0 N--CA 1.417 -2.094 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.145 -178.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -113.21 -23.73 9.79 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 173.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.8 pttm -145.67 172.25 13.55 Favored 'General case' 0 N--CA 1.423 -1.816 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 179.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -74.2 -16.71 60.96 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 121.337 0.589 . . . . 0.0 110.143 -177.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -73.15 -22.36 60.53 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.393 -178.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -77.02 -24.98 52.08 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 -179.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.8 m -89.94 161.62 15.82 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 115.157 -0.928 . . . . 0.0 109.034 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 56.4 m -70.38 178.42 2.91 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.517 174.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -61.55 -51.01 70.36 Favored 'General case' 0 CA--C 1.498 -1.019 0 CA-C-O 121.542 0.687 . . . . 0.0 112.799 -171.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 38.4 m-70 -76.55 14.06 0.86 Allowed 'General case' 0 C--N 1.283 -2.298 0 CA-C-N 114.658 -1.155 . . . . 0.0 112.417 -176.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 46.7 mt -128.93 153.2 47.74 Favored 'General case' 0 N--CA 1.433 -1.318 0 CA-C-O 121.151 0.5 . . . . 0.0 110.207 -175.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -131.16 145.77 17.25 Favored Glycine 0 N--CA 1.426 -1.992 0 N-CA-C 108.814 -1.714 . . . . 0.0 108.814 177.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 39.0 t -84.81 111.88 20.02 Favored 'General case' 0 C--N 1.284 -2.248 0 CA-C-N 116.96 0.38 . . . . 0.0 111.231 -175.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.439 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 71.3 mmtt -72.53 113.34 9.45 Favored 'General case' 0 CA--C 1.482 -1.66 0 O-C-N 121.301 -0.874 . . . . 0.0 108.667 177.119 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.6 mmt180 -69.38 -12.74 61.91 Favored 'General case' 0 C--N 1.315 -0.897 0 O-C-N 124.49 1.119 . . . . 0.0 109.896 -178.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -89.59 -29.93 18.52 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-O 122.093 0.949 . . . . 0.0 109.378 -175.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.53 ' HB3' ' CD1' ' A' ' 27' ' ' TYR . 23.3 mmt -111.81 -16.28 13.2 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.268 -173.08 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 66.44 33.7 6.69 Favored 'General case' 0 CA--C 1.499 -1.015 0 C-N-CA 124.372 1.069 . . . . 0.0 110.119 -178.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.53 ' CD1' ' HB3' ' A' ' 25' ' ' MET . 4.0 p90 -143.45 158.29 43.76 Favored 'General case' 0 CA--C 1.489 -1.369 0 CA-C-N 114.511 -1.222 . . . . 0.0 112.55 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.484 ' O ' ' HA ' ' A' ' 5' ' ' MET . 77.0 m -78.86 123.84 27.63 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.963 -178.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.445 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -119.61 -172.39 2.32 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 177.601 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -78.55 1.15 23.44 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 119.155 0.889 . . . . 0.0 112.915 -176.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.439 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 19.5 t70 -179.73 148.78 0.34 Allowed 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 125.158 1.383 . . . . 0.0 107.914 177.706 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.1 p90 -83.04 -28.16 29.8 Favored 'General case' 0 C--N 1.287 -2.132 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 -175.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.6 m -56.97 136.62 56.17 Favored 'General case' 0 C--O 1.246 0.911 0 C-N-CA 123.759 0.824 . . . . 0.0 112.355 -173.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -98.53 177.09 5.44 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.692 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 C--N 1.302 -1.468 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 -179.467 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 . . . . . 0 CA--C 1.482 -1.647 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 6.2 p -92.63 168.78 11.0 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 174.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -92.26 124.98 36.73 Favored 'General case' 0 C--N 1.272 -2.761 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 -179.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -88.39 -167.36 1.86 Allowed 'General case' 0 N--CA 1.412 -2.363 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.707 -177.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 13.3 ttt -64.23 139.16 58.74 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.704 -173.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 74.28 8.6 4.56 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.934 1.294 . . . . 0.0 111.674 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -95.06 145.07 17.56 Favored Glycine 0 N--CA 1.419 -2.498 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 175.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.472 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 20.9 t70 -64.78 143.66 57.78 Favored 'General case' 0 CA--C 1.493 -1.248 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -176.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 23.9 p -150.51 149.69 30.29 Favored 'General case' 0 N--CA 1.417 -2.11 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.872 -177.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -112.14 -35.52 5.62 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 175.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.9 pttp -134.34 162.33 32.5 Favored 'General case' 0 N--CA 1.42 -1.95 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.16 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -64.14 -18.68 64.68 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-O 121.04 0.447 . . . . 0.0 111.946 -178.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -71.48 -21.96 61.87 Favored 'General case' 0 CA--C 1.493 -1.245 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.953 -177.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -75.24 -30.8 60.64 Favored 'General case' 0 N--CA 1.42 -1.928 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.971 -178.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 20.7 m -90.22 155.46 18.99 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.042 -178.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 32.5 m -61.41 176.97 0.42 Allowed 'General case' 0 C--N 1.298 -1.651 0 C-N-CA 124.515 1.126 . . . . 0.0 112.942 176.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.1 mttp -66.36 -48.48 70.06 Favored 'General case' 0 CA--C 1.496 -1.098 0 CA-C-O 122.377 1.084 . . . . 0.0 109.902 -175.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -68.14 -1.39 5.91 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 113.597 -1.638 . . . . 0.0 112.708 -178.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.8 mp -130.51 176.5 8.11 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-O 121.251 0.548 . . . . 0.0 111.473 -175.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.73 160.77 28.01 Favored Glycine 0 N--CA 1.419 -2.468 0 N-CA-C 108.506 -1.837 . . . . 0.0 108.506 177.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.4 t -93.7 120.58 34.15 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 117.351 0.576 . . . . 0.0 110.412 -177.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.411 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 73.8 mmtt -85.15 108.72 17.83 Favored 'General case' 0 CA--C 1.455 -2.687 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 173.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.409 ' H ' ' HD2' ' A' ' 23' ' ' ARG . 1.3 mpt_? -79.68 -8.08 58.99 Favored 'General case' 0 C--N 1.282 -2.328 0 CA-C-N 114.991 -1.004 . . . . 0.0 108.64 -174.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -90.01 -27.77 19.53 Favored 'General case' 0 CA--C 1.501 -0.918 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.128 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.55 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 90.5 mmm -109.64 -19.06 13.32 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.655 -172.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.472 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 71.8 mmtt 72.84 29.64 1.85 Allowed 'General case' 0 CA--C 1.497 -1.088 0 C-N-CA 125.555 1.542 . . . . 0.0 111.568 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.55 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 27.4 p90 -147.89 158.68 44.16 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.875 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.2 m -77.44 130.8 37.51 Favored 'General case' 0 C--N 1.291 -1.97 0 CA-C-N 114.676 -1.147 . . . . 0.0 110.51 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -122.73 -178.18 3.86 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 177.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -76.05 8.2 3.42 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.307 0.958 . . . . 0.0 113.072 -176.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.411 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 3.8 p30 -169.51 174.67 5.8 Favored 'General case' 0 N--CA 1.409 -2.501 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 -179.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 10.3 p90 -118.45 -47.71 2.53 Favored 'General case' 0 C--N 1.277 -2.552 0 O-C-N 124.018 0.824 . . . . 0.0 111.453 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.3 p -118.77 4.48 11.55 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -177.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -78.59 -52.8 7.94 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.081 -177.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 34.3 p . . . . . 0 C--O 1.259 1.602 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.514 178.62 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 . . . . . 0 CA--C 1.501 -0.933 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.5 p -126.15 159.6 32.46 Favored 'General case' 0 N--CA 1.423 -1.782 0 CA-C-O 121.003 0.43 . . . . 0.0 110.361 177.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.437 ' HB3' ' HA3' ' A' ' 7' ' ' GLY . 9.0 mpt_? -83.83 131.47 34.88 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.882 178.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.484 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 79.1 m-85 -89.79 -163.06 0.95 Allowed 'General case' 0 N--CA 1.391 -3.377 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.2 ttt -66.56 134.0 51.48 Favored 'General case' 0 C--N 1.299 -1.587 0 C-N-CA 120.279 -0.568 . . . . 0.0 109.934 -173.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 76.57 6.48 3.43 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 124.955 1.302 . . . . 0.0 111.966 -178.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.437 ' HA3' ' HB3' ' A' ' 3' ' ' ARG . . . -79.02 156.37 41.84 Favored Glycine 0 N--CA 1.443 -0.839 0 N-CA-C 108.047 -2.021 . . . . 0.0 108.047 172.038 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -88.36 140.2 29.71 Favored 'General case' 0 CA--C 1.476 -1.875 0 CA-C-N 118.256 1.028 . . . . 0.0 110.733 -172.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.9 p -144.04 147.22 33.54 Favored 'General case' 0 C--N 1.272 -2.797 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.984 -175.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -110.34 -30.0 7.88 Favored 'General case' 0 C--N 1.293 -1.89 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 177.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.503 ' HD2' ' OE1' ' A' ' 13' ' ' GLU . 17.2 pttp -139.43 167.18 22.66 Favored 'General case' 0 N--CA 1.426 -1.649 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.268 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -70.73 -18.17 62.8 Favored 'General case' 0 CA--C 1.493 -1.212 0 CA-C-O 121.121 0.486 . . . . 0.0 110.911 -174.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.503 ' OE1' ' HD2' ' A' ' 11' ' ' LYS . 36.4 mt-10 -70.88 -19.13 62.65 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.119 -176.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -79.84 -24.73 41.11 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-N 115.065 -0.97 . . . . 0.0 109.314 -176.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 35.0 m -92.83 159.71 15.26 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.3 m -64.33 174.06 1.8 Allowed 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.536 177.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.6 mtpt -75.99 -33.4 59.72 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 121.655 0.741 . . . . 0.0 110.978 -171.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 36.3 m80 -81.8 6.57 15.15 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.208 178.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.2 mp -131.84 -180.0 5.73 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-O 121.066 0.46 . . . . 0.0 110.797 -178.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -148.03 163.04 28.86 Favored Glycine 0 N--CA 1.424 -2.115 0 N-CA-C 109.661 -1.376 . . . . 0.0 109.661 177.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.1 t -95.96 120.34 36.07 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 117.304 0.552 . . . . 0.0 109.714 -178.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -81.62 107.28 14.24 Favored 'General case' 0 CA--C 1.453 -2.774 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 172.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -75.56 -3.16 32.65 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.411 -173.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -90.44 -31.68 16.72 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-O 122.198 0.999 . . . . 0.0 109.081 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 87.9 mmm -111.86 -9.9 14.03 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.964 -175.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp 63.71 36.69 10.53 Favored 'General case' 0 CA--C 1.503 -0.843 0 C-N-CA 124.455 1.102 . . . . 0.0 111.852 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -143.07 159.04 43.01 Favored 'General case' 0 CA--C 1.486 -1.505 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.438 177.036 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.484 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 39.2 m -82.03 130.28 35.03 Favored 'General case' 0 C--N 1.284 -2.264 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.988 -176.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -121.31 -175.47 3.08 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 106.025 -1.843 . . . . 0.0 106.025 176.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -79.8 10.97 3.54 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 119.588 1.085 . . . . 0.0 113.115 -175.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -172.03 165.79 6.23 Favored 'General case' 0 N--CA 1.415 -2.18 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 178.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.8 p90 -111.25 -53.18 2.73 Favored 'General case' 0 C--N 1.277 -2.581 0 O-C-N 123.97 0.794 . . . . 0.0 110.033 175.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 88.6 m -149.15 106.71 3.65 Favored 'General case' 0 N--CA 1.428 -1.573 0 N-CA-C 106.765 -1.569 . . . . 0.0 106.765 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -75.22 102.6 5.06 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-O 121.156 0.503 . . . . 0.0 110.566 -177.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 38.9 m . . . . . 0 C--N 1.3 -1.563 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.011 175.264 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 . . . . . 0 CA--C 1.489 -1.375 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.6 p -96.54 160.44 14.4 Favored 'General case' 0 N--CA 1.413 -2.295 0 CA-C-O 122.031 0.92 . . . . 0.0 112.237 -177.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -91.15 136.82 32.82 Favored 'General case' 0 C--N 1.279 -2.498 0 CA-C-N 113.964 -1.471 . . . . 0.0 108.609 177.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.401 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 51.2 m-85 -85.19 -167.55 1.88 Allowed 'General case' 0 N--CA 1.401 -2.923 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.087 178.077 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 12.6 ttt -66.54 136.51 55.75 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 -175.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 76.46 9.58 3.06 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 124.99 1.316 . . . . 0.0 111.765 -178.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.429 ' O ' ' HA ' ' A' ' 27' ' ' TYR . . . -88.14 145.45 19.16 Favored Glycine 0 N--CA 1.44 -1.08 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 173.833 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.537 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 15.3 t70 -60.91 143.02 55.83 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.704 0.802 . . . . 0.0 112.258 -177.373 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 21.1 p -153.75 148.92 26.91 Favored 'General case' 0 C--N 1.311 -1.092 0 C-N-CA 119.226 -0.99 . . . . 0.0 113.374 -177.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -106.02 -38.53 6.28 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 173.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.569 ' HG2' ' OD1' ' A' ' 14' ' ' ASP . 5.0 ptpp? -137.37 177.21 8.04 Favored 'General case' 0 N--CA 1.414 -2.258 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -175.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -74.54 -18.12 60.64 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-O 121.163 0.506 . . . . 0.0 111.038 -175.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -72.98 -21.58 60.82 Favored 'General case' 0 CA--C 1.495 -1.141 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.919 -178.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.569 ' OD1' ' HG2' ' A' ' 11' ' ' LYS . 31.0 m-20 -72.99 -27.61 61.9 Favored 'General case' 0 N--CA 1.431 -1.391 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.0 m -92.6 164.32 13.47 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.893 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 62.4 m -70.57 176.51 4.05 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.93 175.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -68.91 -49.9 54.16 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-O 121.542 0.687 . . . . 0.0 112.089 -170.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 55.9 m80 -76.94 15.67 0.65 Allowed 'General case' 0 C--N 1.287 -2.122 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.385 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.433 HD22 ' CE3' ' A' ' 30' ' ' TRP . 87.0 mt -122.08 174.68 6.79 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.88 144.09 11.56 Favored Glycine 0 C--N 1.306 -1.09 0 N-CA-C 110.221 -1.152 . . . . 0.0 110.221 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 39.2 t -90.23 123.02 33.68 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -174.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.527 ' HE2' ' O ' ' A' ' 32' ' ' PHE . 41.2 mmtt -90.13 110.8 21.8 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.786 -0.571 . . . . 0.0 110.106 168.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -76.26 -12.79 60.14 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.79 -177.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -87.88 -26.28 22.83 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 -178.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.506 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 91.9 mmm -108.0 -16.2 14.35 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 114.721 -1.127 . . . . 0.0 110.687 -173.529 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.537 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 32.2 mmmt 66.29 33.04 7.4 Favored 'General case' 0 CA--C 1.492 -1.28 0 C-N-CA 124.574 1.15 . . . . 0.0 112.31 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.506 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 11.4 p90 -150.05 159.26 44.54 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.925 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.7 m -82.33 130.85 35.19 Favored 'General case' 0 C--N 1.289 -2.057 0 CA-C-N 113.806 -1.543 . . . . 0.0 110.469 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -115.84 -172.27 2.13 Favored 'General case' 0 C--N 1.291 -1.939 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 175.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.433 ' CE3' HD22 ' A' ' 19' ' ' LEU . 96.6 m95 -76.52 -19.18 58.23 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.65 1.114 . . . . 0.0 111.056 178.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -175.74 144.2 0.63 Allowed 'General case' 0 C--N 1.282 -2.358 0 N-CA-C 103.873 -2.64 . . . . 0.0 103.873 177.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.527 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 35.5 p90 -79.51 -12.07 59.88 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-O 121.668 0.747 . . . . 0.0 109.344 177.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.3 m -85.96 90.11 7.99 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.736 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -89.57 -28.71 19.39 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.432 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 15.3 t . . . . . 0 C--N 1.309 -1.164 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 178.527 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 CA--C 1.487 -1.46 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.1 p -77.6 158.35 29.83 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 121.574 0.702 . . . . 0.0 110.392 175.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -92.29 140.73 29.3 Favored 'General case' 0 C--N 1.273 -2.721 0 CA-C-N 114.744 -1.117 . . . . 0.0 109.966 -178.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.457 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 60.2 m-85 -93.23 -165.9 1.42 Allowed 'General case' 0 N--CA 1.396 -3.16 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.919 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.475 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 10.7 ttt -62.81 135.04 57.13 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 -176.121 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 76.8 3.99 3.41 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 125.452 1.501 . . . . 0.0 111.753 -178.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.39 149.21 38.44 Favored Glycine 0 N--CA 1.439 -1.101 0 N-CA-C 108.428 -1.869 . . . . 0.0 108.428 171.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -76.63 146.34 38.27 Favored 'General case' 0 CA--C 1.483 -1.602 0 CA-C-N 117.258 0.529 . . . . 0.0 110.073 -174.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.3 p -146.02 150.7 36.48 Favored 'General case' 0 C--N 1.278 -2.505 0 C-N-CA 118.556 -1.258 . . . . 0.0 112.368 -176.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -108.16 -43.76 4.31 Favored 'General case' 0 N--CA 1.433 -1.319 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 173.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.538 ' HD2' ' OE1' ' A' ' 13' ' ' GLU . 46.1 pttt -131.2 169.91 15.29 Favored 'General case' 0 N--CA 1.419 -1.991 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.152 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -68.06 -18.76 64.77 Favored 'General case' 0 CA--C 1.491 -1.327 0 CA-C-O 121.093 0.473 . . . . 0.0 110.864 -179.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.538 ' OE1' ' HD2' ' A' ' 11' ' ' LYS . 1.2 mp0 -67.15 -24.7 65.92 Favored 'General case' 0 CA--C 1.492 -1.253 0 CA-C-N 115.084 -0.962 . . . . 0.0 111.027 -179.637 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -72.19 -26.62 62.13 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 121.419 0.628 . . . . 0.0 109.634 -178.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 18.4 m -93.49 159.19 15.35 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.793 -178.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.9 m -67.08 176.0 2.33 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.727 174.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -58.74 -57.12 14.43 Favored 'General case' 0 CA--C 1.504 -0.801 0 C-N-CA 123.909 0.884 . . . . 0.0 113.079 -171.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 28.9 m80 -79.08 15.01 1.23 Allowed 'General case' 0 C--N 1.283 -2.304 0 CA-C-N 114.928 -1.033 . . . . 0.0 112.017 -174.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.457 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 68.1 mt -123.6 169.05 11.84 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.8 154.19 25.7 Favored Glycine 0 N--CA 1.418 -2.557 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 178.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.4 t -89.24 108.93 19.89 Favored 'General case' 0 C--N 1.285 -2.223 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -177.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -70.88 112.94 7.45 Favored 'General case' 0 CA--C 1.473 -2.013 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 176.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -74.45 -8.43 56.27 Favored 'General case' 0 C--N 1.292 -1.933 0 O-C-N 124.748 1.28 . . . . 0.0 110.119 -176.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -88.97 -36.35 15.91 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 -176.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.424 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 96.9 mmm -112.74 -12.85 13.3 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 114.43 -1.259 . . . . 0.0 112.931 -171.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp 66.95 38.08 3.7 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 125.006 1.322 . . . . 0.0 111.542 -179.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.424 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 8.0 p90 -145.53 161.45 39.74 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.375 -0.83 . . . . 0.0 112.114 178.131 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 59.2 m -81.3 128.6 33.99 Favored 'General case' 0 N--CA 1.419 -1.992 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.452 -176.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.475 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -124.67 -171.65 2.4 Favored 'General case' 0 C--N 1.284 -2.245 0 N-CA-C 106.292 -1.744 . . . . 0.0 106.292 175.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -75.31 3.01 9.75 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 118.767 0.712 . . . . 0.0 112.748 -178.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -173.72 171.31 3.82 Favored 'General case' 0 N--CA 1.416 -2.154 0 N-CA-C 106.65 -1.611 . . . . 0.0 106.65 175.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.465 ' O ' ' HB ' ' A' ' 33' ' ' THR . 26.6 p90 -101.18 5.9 42.86 Favored 'General case' 0 C--N 1.278 -2.502 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -176.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.465 ' HB ' ' O ' ' A' ' 32' ' ' PHE . 99.8 m 73.42 106.52 0.07 Allowed 'General case' 0 C--O 1.24 0.6 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -170.371 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -64.39 104.04 0.72 Allowed 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.926 0.869 . . . . 0.0 112.066 -173.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.3 m . . . . . 0 C--O 1.257 1.488 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 179.697 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 . . . . . 0 CA--C 1.496 -1.127 0 N-CA-C 107.537 -1.282 . . . . 0.0 107.537 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.4 p -91.84 169.34 10.77 Favored 'General case' 0 N--CA 1.423 -1.779 0 CA-C-O 121.306 0.574 . . . . 0.0 110.558 177.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.544 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 39.0 mmt180 -102.58 135.39 44.31 Favored 'General case' 0 C--N 1.291 -1.959 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.501 -179.599 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.528 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 87.5 m-85 -95.23 -161.77 0.89 Allowed 'General case' 0 N--CA 1.403 -2.777 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 174.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.581 ' HA ' ' O ' ' A' ' 28' ' ' CYS . 49.4 ttm -62.72 135.87 57.58 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 82.13 -8.82 1.24 Allowed 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 125.069 1.348 . . . . 0.0 112.115 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.405 ' HA3' ' HB3' ' A' ' 3' ' ' ARG . . . -76.8 139.65 23.91 Favored Glycine 0 N--CA 1.434 -1.44 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 176.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.544 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 17.2 t70 -69.54 141.12 53.9 Favored 'General case' 0 CA--C 1.487 -1.476 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -173.466 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.414 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 23.4 p -143.42 152.77 41.95 Favored 'General case' 0 N--CA 1.414 -2.235 0 C-N-CA 119.783 -0.767 . . . . 0.0 111.51 -176.242 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -113.59 -35.72 5.14 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 174.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 45.7 pttt -141.57 177.52 8.08 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 124.45 1.1 . . . . 0.0 108.36 179.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -73.63 -16.07 61.24 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 122.227 -0.296 . . . . 0.0 111.197 -175.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -67.87 -25.24 65.42 Favored 'General case' 0 CA--C 1.496 -1.134 0 CA-C-O 121.656 0.741 . . . . 0.0 110.497 179.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -68.7 -31.78 71.12 Favored 'General case' 0 N--CA 1.425 -1.677 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.121 -179.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.9 m -86.82 159.19 19.17 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.257 -176.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.9 m -66.14 178.47 1.14 Allowed 'General case' 0 C--N 1.307 -1.283 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.288 174.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -61.46 -52.31 65.05 Favored 'General case' 0 CA--C 1.485 -1.552 0 CA-C-O 121.701 0.762 . . . . 0.0 112.246 -171.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 30.3 m-70 -74.52 3.92 6.89 Favored 'General case' 0 C--N 1.28 -2.427 0 CA-C-N 114.204 -1.362 . . . . 0.0 113.35 -175.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.0 mp -123.93 167.94 13.46 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.571 0.701 . . . . 0.0 112.781 -177.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -135.5 159.96 24.31 Favored Glycine 0 N--CA 1.433 -1.558 0 N-CA-C 109.157 -1.577 . . . . 0.0 109.157 179.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 32.1 t -94.35 130.65 40.59 Favored 'General case' 0 C--N 1.285 -2.221 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -174.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -96.95 107.21 19.69 Favored 'General case' 0 CA--C 1.474 -1.952 0 CA-C-O 121.351 0.596 . . . . 0.0 110.731 172.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -72.22 -12.04 60.99 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 114.563 -1.198 . . . . 0.0 111.837 -176.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -89.32 -26.68 20.98 Favored 'General case' 0 C--N 1.302 -1.5 0 CA-C-O 121.972 0.891 . . . . 0.0 108.858 -176.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.437 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 97.5 mmm -112.1 -8.6 14.01 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.19 -176.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm 63.45 28.75 15.48 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.846 1.258 . . . . 0.0 112.642 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.437 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 8.7 p90 -143.71 161.06 39.55 Favored 'General case' 0 C--N 1.286 -2.179 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.662 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.581 ' O ' ' HA ' ' A' ' 5' ' ' MET . 66.6 m -81.14 140.17 35.17 Favored 'General case' 0 C--N 1.285 -2.213 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.666 -179.005 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -131.52 178.53 6.66 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 105.499 -2.037 . . . . 0.0 105.499 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -68.56 -12.16 60.91 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 119.935 1.243 . . . . 0.0 113.801 -175.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -166.77 142.12 4.31 Favored 'General case' 0 N--CA 1.415 -2.194 0 CA-C-O 121.335 0.588 . . . . 0.0 109.76 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 33.6 p90 -75.79 -22.77 56.07 Favored 'General case' 0 C--N 1.28 -2.431 0 CA-C-N 114.928 -1.033 . . . . 0.0 112.554 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.6 m -95.54 -0.41 52.08 Favored 'General case' 0 CA--C 1.553 1.091 0 CA-C-O 121.781 0.801 . . . . 0.0 109.756 -178.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -55.39 139.26 43.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.226 178.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 15.4 t . . . . . 0 C--N 1.309 -1.159 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.285 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 24.5 t70 . . . . . 0 CA--C 1.494 -1.191 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 20.9 p -108.55 158.22 17.76 Favored 'General case' 0 N--CA 1.405 -2.709 0 CA-C-O 121.629 0.728 . . . . 0.0 110.835 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -86.06 129.86 34.71 Favored 'General case' 0 C--N 1.273 -2.728 0 CA-C-N 114.357 -1.292 . . . . 0.0 108.717 -178.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -86.55 -168.31 2.19 Favored 'General case' 0 N--CA 1.408 -2.544 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.062 178.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.441 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 12.8 ttt -69.56 140.08 53.8 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 120.828 0.347 . . . . 0.0 111.16 -172.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 74.48 -2.37 2.83 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.745 1.618 . . . . 0.0 112.253 -179.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.17 148.64 30.02 Favored Glycine 0 N--CA 1.422 -2.236 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 176.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -63.13 139.76 58.8 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 123.774 0.83 . . . . 0.0 112.636 -177.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 23.5 p -146.0 153.9 41.28 Favored 'General case' 0 C--N 1.287 -2.109 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.452 -178.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -112.47 -36.27 5.3 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 177.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -145.54 167.56 22.73 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 114.159 -1.382 . . . . 0.0 108.475 -179.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -67.72 -18.48 64.92 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.23 0.538 . . . . 0.0 111.509 -176.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -66.01 -27.26 67.99 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.853 -178.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -79.24 -27.2 42.41 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.56 -175.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.6 m -88.65 163.49 15.77 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.417 -178.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 31.4 m -69.37 172.03 7.74 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.113 175.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -66.18 -47.15 74.91 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.568 0.699 . . . . 0.0 112.027 -172.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 51.4 m80 -72.02 1.79 6.74 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.719 179.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.3 mp -117.65 178.47 4.38 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-O 121.093 0.473 . . . . 0.0 111.256 179.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -151.09 151.93 23.83 Favored Glycine 0 N--CA 1.423 -2.179 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 177.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 38.0 t -93.26 116.56 29.12 Favored 'General case' 0 C--N 1.27 -2.872 0 CA-C-N 117.014 0.407 . . . . 0.0 110.251 -175.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.522 ' HE3' ' O ' ' A' ' 33' ' ' THR . 39.9 mmtm -77.33 110.52 12.13 Favored 'General case' 0 CA--C 1.461 -2.45 0 N-CA-C 106.565 -1.643 . . . . 0.0 106.565 172.417 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -76.8 -13.25 60.03 Favored 'General case' 0 C--N 1.286 -2.18 0 O-C-N 123.884 0.74 . . . . 0.0 109.22 -173.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -90.74 -24.71 20.3 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 122.181 0.991 . . . . 0.0 109.21 -177.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.552 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 96.8 mmm -110.0 -7.06 15.0 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.229 -175.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.536 ' N ' ' HD2' ' A' ' 26' ' ' LYS . 3.4 mptp? 61.92 26.28 15.87 Favored 'General case' 0 CA--C 1.505 -0.769 0 C-N-CA 125.271 1.428 . . . . 0.0 111.769 177.09 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.552 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 23.1 p90 -140.42 158.88 43.34 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.788 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 59.5 m -81.69 131.7 35.27 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.111 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.441 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -124.14 -174.17 2.94 Favored 'General case' 0 C--N 1.288 -2.102 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 176.229 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -76.61 -1.83 29.55 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 120.248 1.386 . . . . 0.0 113.203 -176.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -169.27 163.14 10.79 Favored 'General case' 0 N--CA 1.417 -2.107 0 N-CA-C 106.439 -1.689 . . . . 0.0 106.439 179.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -103.72 4.66 35.55 Favored 'General case' 0 C--N 1.268 -2.937 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -173.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.522 ' O ' ' HE3' ' A' ' 22' ' ' LYS . 25.8 m -84.99 132.31 34.36 Favored 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 120.269 -0.573 . . . . 0.0 110.28 -175.211 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -52.01 -54.26 32.06 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-O 121.436 0.636 . . . . 0.0 111.232 -177.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 25.4 m . . . . . 0 C--N 1.303 -1.441 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.167 179.865 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 . . . . . 0 C--O 1.237 0.401 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.6 p -90.54 164.26 14.29 Favored 'General case' 0 CA--C 1.494 -1.188 0 CA-C-O 121.63 0.728 . . . . 0.0 111.319 -179.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -93.47 132.8 37.4 Favored 'General case' 0 C--N 1.278 -2.528 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.679 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.497 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 53.6 m-85 -85.05 -170.79 3.3 Favored 'General case' 0 N--CA 1.398 -3.05 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.579 176.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.3 ttt -62.97 134.09 55.63 Favored 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 -178.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 81.65 2.44 1.47 Allowed 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 125.067 1.347 . . . . 0.0 112.139 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -86.45 146.6 20.96 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 174.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.443 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 28.4 t70 -65.96 142.77 57.75 Favored 'General case' 0 CA--C 1.493 -1.222 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -175.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 26.8 p -150.99 154.72 37.61 Favored 'General case' 0 C--N 1.291 -1.954 0 C-N-CA 120.103 -0.639 . . . . 0.0 111.202 -177.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -115.12 -36.6 4.34 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.0 pttm -138.55 175.58 9.44 Favored 'General case' 0 N--CA 1.427 -1.613 0 CA-C-N 115.222 -0.899 . . . . 0.0 108.612 177.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -72.04 -16.75 62.05 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 120.512 0.196 . . . . 0.0 111.42 -174.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -61.65 -36.99 82.38 Favored 'General case' 0 CA--C 1.502 -0.888 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 179.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -63.2 -32.48 73.88 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.604 -177.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.0 m -88.59 159.18 18.01 Favored 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.316 -177.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 58.5 m -66.83 176.88 1.85 Allowed 'General case' 0 C--N 1.303 -1.416 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.55 175.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HA ' ' HE2' ' A' ' 17' ' ' LYS . 10.3 mmpt? -64.47 -52.6 57.1 Favored 'General case' 0 CA--C 1.502 -0.895 0 CA-C-O 121.192 0.52 . . . . 0.0 111.889 -171.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -72.9 9.95 1.02 Allowed 'General case' 0 C--N 1.297 -1.679 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.504 -178.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.497 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 64.8 mt -125.01 177.12 6.23 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 -175.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -151.26 166.57 30.6 Favored Glycine 0 N--CA 1.434 -1.488 0 N-CA-C 108.64 -1.784 . . . . 0.0 108.64 176.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -99.46 129.5 45.64 Favored 'General case' 0 C--N 1.288 -2.069 0 CA-C-N 118.125 0.962 . . . . 0.0 112.064 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.6 mmmt -96.53 107.53 19.96 Favored 'General case' 0 CA--C 1.473 -1.997 0 CA-C-O 121.255 0.55 . . . . 0.0 111.0 173.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -69.1 -15.3 63.4 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 114.208 -1.36 . . . . 0.0 113.169 -175.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -89.33 -27.59 20.41 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.897 0.856 . . . . 0.0 109.177 -177.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 74.7 mmm -109.54 -10.97 14.84 Favored 'General case' 0 N--CA 1.426 -1.666 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.838 -172.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.443 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 71.1 mmtt 63.61 30.22 15.01 Favored 'General case' 0 CA--C 1.5 -0.958 0 C-N-CA 124.75 1.22 . . . . 0.0 111.194 -178.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -145.35 159.43 43.07 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.301 -179.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 72.0 m -76.68 134.7 39.18 Favored 'General case' 0 C--N 1.287 -2.125 0 CA-C-N 114.519 -1.219 . . . . 0.0 111.473 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -122.09 -167.59 1.57 Allowed 'General case' 0 C--N 1.296 -1.717 0 N-CA-C 105.731 -1.951 . . . . 0.0 105.731 177.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.426 ' CE3' HD23 ' A' ' 19' ' ' LEU . 99.4 m95 -81.66 -6.14 58.73 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 119.691 1.132 . . . . 0.0 112.723 -176.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -169.13 171.61 7.99 Favored 'General case' 0 N--CA 1.405 -2.693 0 N-CA-C 103.821 -2.659 . . . . 0.0 103.821 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 33.9 p90 -77.48 -13.7 59.86 Favored 'General case' 0 C--N 1.277 -2.574 0 CA-C-O 121.258 0.552 . . . . 0.0 110.825 179.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.6 m -95.37 115.26 27.19 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-N 115.337 -0.847 . . . . 0.0 108.856 178.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -156.6 121.97 4.73 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 179.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 39.9 m . . . . . 0 C--N 1.299 -1.626 0 CA-C-O 120.648 0.261 . . . . 0.0 110.932 -178.597 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.7 p . . . . . 0 N--CA 1.433 -1.307 0 CA-C-O 121.946 0.879 . . . . 0.0 112.659 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.6 mpp_? -103.17 134.67 46.2 Favored 'General case' 0 C--N 1.285 -2.196 0 CA-C-N 114.107 -1.406 . . . . 0.0 109.83 177.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.437 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 89.7 m-85 -91.38 -162.03 0.88 Allowed 'General case' 0 N--CA 1.404 -2.742 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.422 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.477 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 6.8 ttt -65.8 136.72 56.57 Favored 'General case' 0 C--N 1.32 -0.688 0 O-C-N 122.295 -0.253 . . . . 0.0 110.91 -171.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 79.52 2.68 2.22 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.061 1.344 . . . . 0.0 111.997 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -87.44 144.88 19.32 Favored Glycine 0 N--CA 1.438 -1.203 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 174.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.506 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 19.3 t70 -61.93 148.07 44.81 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.244 0.618 . . . . 0.0 112.598 -176.682 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.409 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 30.5 p -152.4 146.63 25.47 Favored 'General case' 0 N--CA 1.423 -1.81 0 C-N-CA 120.097 -0.641 . . . . 0.0 111.786 -179.005 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -101.95 -44.27 5.54 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 106.726 -1.583 . . . . 0.0 106.726 172.686 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.57 ' HG2' ' OD1' ' A' ' 14' ' ' ASP . 4.4 ptpp? -134.52 177.47 7.75 Favored 'General case' 0 N--CA 1.409 -2.523 0 CA-C-N 113.752 -1.567 . . . . 0.0 107.549 -176.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -74.53 -19.76 60.23 Favored 'General case' 0 C--N 1.29 -2.014 0 CA-C-O 121.154 0.502 . . . . 0.0 110.959 -175.314 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.458 ' H ' ' HG3' ' A' ' 11' ' ' LYS . 9.8 tp10 -69.24 -23.52 63.88 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.849 -177.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.57 ' OD1' ' HG2' ' A' ' 11' ' ' LYS . 40.0 m-20 -74.78 -29.89 61.27 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-O 121.758 0.789 . . . . 0.0 109.157 -178.867 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.1 m -87.33 163.32 16.88 Favored 'General case' 0 N--CA 1.426 -1.658 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.226 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 m -69.97 169.25 13.65 Favored 'General case' 0 N--CA 1.419 -2.003 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 173.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -87.81 -0.19 56.62 Favored 'General case' 0 C--N 1.287 -2.152 0 CA-C-O 122.728 1.252 . . . . 0.0 111.384 -170.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 89.3 m-70 -95.08 2.05 55.11 Favored 'General case' 0 C--N 1.273 -2.748 0 CA-C-N 113.08 -1.873 . . . . 0.0 108.656 172.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.4 ' HB3' ' O ' ' A' ' 29' ' ' ALA . 5.0 mp -136.41 -177.05 4.55 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.464 -175.333 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.64 160.55 28.52 Favored Glycine 0 N--CA 1.425 -2.067 0 N-CA-C 108.818 -1.713 . . . . 0.0 108.818 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.6 t -92.48 127.89 38.14 Favored 'General case' 0 C--N 1.285 -2.221 0 CA-C-N 117.84 0.82 . . . . 0.0 111.429 -176.573 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm -96.68 112.58 24.27 Favored 'General case' 0 CA--C 1.468 -2.183 0 O-C-N 121.36 -0.838 . . . . 0.0 108.894 169.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -72.73 -8.72 56.79 Favored 'General case' 0 C--N 1.294 -1.832 0 CA-C-N 114.289 -1.323 . . . . 0.0 111.51 -176.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -88.91 -27.82 20.72 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-O 122.201 1.0 . . . . 0.0 108.378 -177.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.572 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 0.9 OUTLIER -110.03 -8.44 14.82 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 114.513 -1.222 . . . . 0.0 111.03 -176.022 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.506 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 3.7 mptp? 59.85 26.36 15.55 Favored 'General case' 0 CA--C 1.486 -1.499 0 C-N-CA 124.61 1.164 . . . . 0.0 110.847 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.572 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 2.5 p90 -141.27 156.62 45.86 Favored 'General case' 0 C--N 1.286 -2.164 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.521 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.437 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 59.3 m -72.29 133.53 45.07 Favored 'General case' 0 N--CA 1.411 -2.418 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.508 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.477 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -120.11 173.81 6.87 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 176.073 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -71.98 -0.06 10.59 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 119.59 1.086 . . . . 0.0 113.331 -175.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.1 p30 . . . . . 0 N--CA 1.407 -2.592 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 -178.604 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 24.8 p . . . . . 0 N--CA 1.407 -2.592 0 CA-C-O 121.704 0.764 . . . . 0.0 110.58 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.7 mpp_? -94.04 133.88 37.04 Favored 'General case' 0 C--N 1.268 -2.977 0 CA-C-N 114.263 -1.335 . . . . 0.0 109.632 176.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.489 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 43.6 m-85 -85.07 -165.83 1.32 Allowed 'General case' 0 N--CA 1.409 -2.483 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 176.61 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 12.4 ttt -63.96 134.21 54.66 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 77.88 1.19 2.84 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.509 1.524 . . . . 0.0 111.66 -178.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -76.31 154.49 44.4 Favored Glycine 0 N--CA 1.44 -1.062 0 N-CA-C 109.172 -1.571 . . . . 0.0 109.172 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -74.81 143.53 43.93 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 117.099 0.449 . . . . 0.0 111.929 -174.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.462 ' O ' ' HE2' ' A' ' 26' ' ' LYS . 28.9 p -151.45 154.86 37.42 Favored 'General case' 0 N--CA 1.412 -2.331 0 C-N-CA 119.988 -0.685 . . . . 0.0 111.232 -177.523 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -112.83 -36.57 5.11 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 107.324 -1.361 . . . . 0.0 107.324 171.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -141.98 178.15 7.72 Favored 'General case' 0 N--CA 1.425 -1.709 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.835 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -71.4 -17.81 62.38 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 120.606 0.241 . . . . 0.0 111.311 -174.079 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -64.36 -26.47 68.49 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-O 121.492 0.663 . . . . 0.0 110.319 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -72.88 -29.49 63.22 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.124 -178.356 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.2 m -91.4 162.64 14.5 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.516 -176.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.418 ' HB2' HD12 ' A' ' 19' ' ' LEU . 60.8 m -71.35 177.83 3.72 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.575 175.869 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -57.65 -56.44 21.94 Favored 'General case' 0 CA--C 1.502 -0.885 0 C-N-CA 124.114 0.966 . . . . 0.0 112.293 -174.215 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 -77.13 19.88 0.3 Allowed 'General case' 0 C--N 1.293 -1.862 0 CA-C-N 114.801 -1.09 . . . . 0.0 112.882 -176.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.432 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 60.7 mt -132.51 167.45 19.96 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.248 0.547 . . . . 0.0 110.764 -176.643 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.37 148.92 20.92 Favored Glycine 0 N--CA 1.434 -1.476 0 N-CA-C 108.994 -1.642 . . . . 0.0 108.994 177.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.9 t -84.61 128.27 34.51 Favored 'General case' 0 C--N 1.285 -2.215 0 CA-C-N 117.236 0.518 . . . . 0.0 111.208 -175.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 35.0 mmtm -88.29 112.9 23.34 Favored 'General case' 0 CA--C 1.465 -2.318 0 O-C-N 121.934 -0.479 . . . . 0.0 109.796 172.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.2 mpt_? -73.95 -9.78 58.98 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.601 -1.181 . . . . 0.0 111.505 -178.516 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -89.34 -29.14 19.35 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 -178.134 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.468 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 95.0 mmm -112.44 -20.36 11.81 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 114.68 -1.145 . . . . 0.0 112.3 -171.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.462 ' HE2' ' O ' ' A' ' 9' ' ' CYS . 14.4 mmmm 69.69 36.39 2.14 Favored 'General case' 0 CA--C 1.503 -0.843 0 C-N-CA 125.458 1.503 . . . . 0.0 111.304 -178.257 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.468 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 3.4 p90 -144.25 160.17 41.43 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-N 114.365 -1.289 . . . . 0.0 111.696 178.6 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.489 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 70.2 m -79.92 130.04 34.97 Favored 'General case' 0 C--N 1.289 -2.045 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.832 -178.726 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.84 -174.48 2.83 Favored 'General case' 0 C--N 1.289 -2.034 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 177.179 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.423 ' HA ' HD23 ' A' ' 19' ' ' LEU . 99.5 m95 -75.45 -6.16 48.69 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -176.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 N--CA 1.407 -2.611 0 N-CA-C 105.194 -2.15 . . . . 0.0 105.194 -179.987 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.7 p . . . . . 0 N--CA 1.418 -2.029 0 CA-C-O 121.78 0.8 . . . . 0.0 109.5 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -115.07 135.73 53.88 Favored 'General case' 0 N--CA 1.402 -2.842 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.618 171.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.455 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 64.4 m-85 -96.16 -159.04 0.7 Allowed 'General case' 0 N--CA 1.387 -3.619 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 175.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 11.1 ttt -67.47 135.57 53.29 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.386 -0.926 . . . . 0.0 109.661 -175.349 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 76.26 5.98 3.63 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.529 1.132 . . . . 0.0 111.059 -178.416 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLY . . . . . 0.41 ' O ' ' HA ' ' A' ' 27' ' ' TYR . . . -87.25 149.7 22.2 Favored Glycine 0 N--CA 1.434 -1.493 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 175.364 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.423 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 7.2 t70 -71.22 141.84 50.62 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 123.682 0.793 . . . . 0.0 112.924 -173.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.444 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 20.5 p -149.95 150.34 31.7 Favored 'General case' 0 C--N 1.284 -2.279 0 C-N-CA 119.626 -0.829 . . . . 0.0 111.432 -177.608 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -113.76 -35.13 5.26 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 172.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.585 ' HG2' ' OD2' ' A' ' 14' ' ' ASP . 3.9 ptpp? -138.06 175.14 9.84 Favored 'General case' 0 N--CA 1.413 -2.281 0 CA-C-N 114.417 -1.265 . . . . 0.0 107.82 -176.323 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -75.34 -16.57 60.39 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-O 121.16 0.505 . . . . 0.0 111.443 -175.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.5 ' HB2' ' HG3' ' A' ' 11' ' ' LYS . 46.1 mt-10 -68.87 -25.99 64.9 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.818 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.585 ' OD2' ' HG2' ' A' ' 11' ' ' LYS . 45.0 m-20 -72.92 -26.79 61.53 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.109 -177.233 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 13.0 m -96.68 156.92 16.14 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 120.978 0.418 . . . . 0.0 110.088 -178.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.16 179.71 3.72 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 173.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -49.99 -61.46 2.13 Favored 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 127.15 2.18 . . . . 0.0 113.867 -172.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -76.25 15.57 0.56 Allowed 'General case' 0 C--N 1.29 -1.986 0 CA-C-N 114.854 -1.066 . . . . 0.0 112.746 -174.125 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.2 mp -135.54 176.76 8.38 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-O 120.925 0.393 . . . . 0.0 110.942 -177.543 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -150.38 161.06 28.83 Favored Glycine 0 N--CA 1.425 -2.088 0 N-CA-C 108.902 -1.679 . . . . 0.0 108.902 176.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.2 t -87.16 130.59 34.48 Favored 'General case' 0 C--N 1.297 -1.699 0 CA-C-N 117.554 0.677 . . . . 0.0 112.333 -176.4 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.574 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 74.4 mmtt -100.63 105.1 16.46 Favored 'General case' 0 CA--C 1.465 -2.312 0 CA-C-O 121.358 0.599 . . . . 0.0 109.43 170.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -72.92 -3.7 27.44 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 114.385 -1.28 . . . . 0.0 111.115 -176.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -89.77 -31.68 17.3 Favored 'General case' 0 CA--C 1.5 -0.972 0 CA-C-O 121.998 0.904 . . . . 0.0 108.694 -177.422 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.533 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 96.2 mmm -112.29 -7.97 13.97 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 114.537 -1.211 . . . . 0.0 111.867 -176.212 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.423 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 70.7 mmtt 65.35 30.01 11.23 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.723 1.209 . . . . 0.0 111.717 -179.053 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.533 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 7.0 p90 -144.42 159.79 42.14 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.27 178.776 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 55.9 m -81.15 131.02 35.28 Favored 'General case' 0 C--N 1.287 -2.139 0 CA-C-N 114.614 -1.176 . . . . 0.0 110.658 -178.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -116.33 -176.59 2.99 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 105.831 -1.915 . . . . 0.0 105.831 175.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -75.54 2.43 11.72 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 119.053 0.842 . . . . 0.0 113.041 -175.099 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.574 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 2.9 p30 . . . . . 0 N--CA 1.401 -2.919 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.1 p . . . . . 0 N--CA 1.418 -2.074 0 CA-C-O 121.114 0.483 . . . . 0.0 109.798 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ARG . . . . . 0.436 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 3.4 tpp180 -86.76 131.22 34.19 Favored 'General case' 0 C--N 1.276 -2.602 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 -178.324 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -90.25 -166.55 1.61 Allowed 'General case' 0 N--CA 1.415 -2.182 0 CA-C-O 120.818 0.342 . . . . 0.0 111.843 -178.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 16.0 ttt -64.9 140.31 58.85 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.755 -174.419 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 72.22 8.91 5.91 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.514 1.126 . . . . 0.0 111.577 -179.544 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.61 137.92 14.16 Favored Glycine 0 N--CA 1.419 -2.486 0 N-CA-C 109.681 -1.368 . . . . 0.0 109.681 175.208 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.554 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 18.5 t70 -56.76 143.99 34.6 Favored 'General case' 0 CA--C 1.486 -1.489 0 C-N-CA 124.449 1.1 . . . . 0.0 111.553 -178.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 26.5 p -149.43 151.91 34.8 Favored 'General case' 0 N--CA 1.42 -1.941 0 C-N-CA 119.518 -0.873 . . . . 0.0 111.957 -175.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -115.97 -33.91 4.92 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.292 -0.867 . . . . 0.0 108.71 176.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -138.73 164.04 30.59 Favored 'General case' 0 N--CA 1.42 -1.959 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 176.231 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -71.55 -16.5 62.32 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-O 121.317 0.58 . . . . 0.0 110.162 -177.469 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -67.52 -28.22 67.63 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 114.432 -1.258 . . . . 0.0 109.552 -177.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -69.08 -32.8 72.49 Favored 'General case' 0 N--CA 1.436 -1.133 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.911 -177.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.436 ' SG ' ' HB3' ' A' ' 3' ' ' ARG . 69.3 m -100.4 165.74 11.3 Favored 'General case' 0 N--CA 1.429 -1.512 0 CA-C-O 121.378 0.609 . . . . 0.0 112.582 -177.408 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.431 ' HB2' HD13 ' A' ' 19' ' ' LEU . 11.3 m -64.69 172.34 2.8 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.834 -178.578 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -79.01 -27.43 43.26 Favored 'General case' 0 CA--C 1.488 -1.432 0 CA-C-O 121.939 0.876 . . . . 0.0 111.647 -172.009 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 33.9 m170 -77.92 4.14 12.78 Favored 'General case' 0 C--N 1.28 -2.439 0 CA-C-N 114.299 -1.319 . . . . 0.0 110.62 177.029 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.431 HD13 ' HB2' ' A' ' 16' ' ' CYS . 5.5 mp -133.14 177.1 7.93 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-O 121.285 0.564 . . . . 0.0 111.304 -177.369 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -150.6 152.12 24.03 Favored Glycine 0 N--CA 1.421 -2.365 0 N-CA-C 109.774 -1.33 . . . . 0.0 109.774 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 32.5 t -88.96 118.68 28.86 Favored 'General case' 0 C--N 1.292 -1.915 0 C-N-CA 123.153 0.581 . . . . 0.0 111.042 -175.22 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 75.3 mmtt -87.97 115.61 25.56 Favored 'General case' 0 CA--C 1.466 -2.269 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 177.199 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.1 mmt180 -73.47 -15.3 61.33 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.326 -175.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.448 ' HG3' ' HG2' ' A' ' 25' ' ' MET . 64.5 pttt -90.68 -25.93 19.83 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.965 -176.483 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.574 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 89.4 mmm -107.01 -17.19 14.24 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 114.975 -1.012 . . . . 0.0 110.755 -173.39 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.554 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 32.2 mmmt 68.36 33.1 4.3 Favored 'General case' 0 CA--C 1.489 -1.398 0 C-N-CA 124.42 1.088 . . . . 0.0 111.118 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.574 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 7.8 p90 -153.61 166.36 33.03 Favored 'General case' 0 C--N 1.287 -2.127 0 CA-C-N 114.185 -1.371 . . . . 0.0 110.464 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.6 m -95.85 140.37 30.72 Favored 'General case' 0 C--N 1.276 -2.59 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.31 -172.41 2.35 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 177.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -76.71 9.24 2.93 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 119.883 1.219 . . . . 0.0 113.151 -176.046 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.423 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 4.7 p-10 . . . . . 0 N--CA 1.405 -2.677 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.7 p . . . . . 0 N--CA 1.426 -1.635 0 CA-C-O 121.263 0.554 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ARG . . . . . 0.509 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 39.6 mmt180 -80.12 131.48 35.75 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-N 114.565 -1.198 . . . . 0.0 109.524 178.395 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.43 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 55.8 m-85 -90.91 -158.88 0.58 Allowed 'General case' 0 N--CA 1.397 -3.109 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 173.774 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.1 ttt -71.66 137.28 47.75 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 120.31 -0.556 . . . . 0.0 109.901 -173.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 77.61 2.36 3.01 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.137 1.375 . . . . 0.0 111.266 -178.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.38 142.9 26.56 Favored Glycine 0 N--CA 1.43 -1.713 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 174.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.509 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 12.7 t70 -69.32 144.54 53.5 Favored 'General case' 0 CA--C 1.492 -1.259 0 C-N-CA 123.339 0.656 . . . . 0.0 111.116 -176.641 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.415 ' O ' ' HE2' ' A' ' 26' ' ' LYS . 32.0 p -152.47 155.97 38.53 Favored 'General case' 0 C--N 1.29 -1.991 0 C-N-CA 119.65 -0.82 . . . . 0.0 111.883 -176.32 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -113.73 -36.93 4.71 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 171.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.4 pttm -135.68 167.52 20.98 Favored 'General case' 0 N--CA 1.426 -1.666 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.153 -178.416 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -67.46 -19.13 65.31 Favored 'General case' 0 CA--C 1.488 -1.411 0 CA-C-O 120.994 0.426 . . . . 0.0 111.49 -178.349 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -70.94 -23.7 62.29 Favored 'General case' 0 CA--C 1.497 -1.095 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.34 -177.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -77.16 -27.98 53.94 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.1 -178.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 20.8 m -89.68 158.95 17.35 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 59.1 m -65.23 169.9 5.18 Favored 'General case' 0 N--CA 1.421 -1.923 0 CA-C-O 121.448 0.642 . . . . 0.0 110.632 174.08 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -66.71 -47.91 70.88 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.647 -169.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 47.5 m80 -64.82 -3.9 3.84 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 114.872 -1.058 . . . . 0.0 113.196 179.099 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.7 mp -120.96 -178.77 3.83 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.289 0.566 . . . . 0.0 111.583 -177.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -148.18 153.16 25.1 Favored Glycine 0 N--CA 1.419 -2.471 0 N-CA-C 110.27 -1.132 . . . . 0.0 110.27 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.3 t -86.31 127.78 34.83 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-O 120.6 0.238 . . . . 0.0 110.481 -177.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.503 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 73.1 mmtt -92.51 113.57 25.88 Favored 'General case' 0 CA--C 1.46 -2.497 0 CA-C-O 121.24 0.543 . . . . 0.0 110.439 176.218 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -71.45 -12.78 61.57 Favored 'General case' 0 C--N 1.29 -1.979 0 CA-C-N 113.474 -1.694 . . . . 0.0 112.091 -175.617 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.3 mmmp? -90.38 -30.66 17.27 Favored 'General case' 0 C--N 1.297 -1.702 0 C-N-CA 119.457 -0.897 . . . . 0.0 109.633 -177.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.448 ' HB3' ' CD2' ' A' ' 27' ' ' TYR . 16.5 mmt -113.15 -13.84 12.97 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -174.635 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.415 ' HE2' ' O ' ' A' ' 9' ' ' CYS . 14.5 mmmm 66.81 36.67 4.42 Favored 'General case' 0 CA--C 1.498 -1.055 0 C-N-CA 124.444 1.098 . . . . 0.0 110.767 -179.027 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.448 ' CD2' ' HB3' ' A' ' 25' ' ' MET . 10.0 p90 -142.99 159.84 41.49 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.657 177.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.43 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 42.2 m -84.72 129.47 34.83 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.938 -176.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.16 -173.8 2.64 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -79.62 8.46 6.48 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 119.775 1.17 . . . . 0.0 113.1 -176.348 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.503 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 3.3 p-10 . . . . . 0 N--CA 1.409 -2.479 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 13.1 p . . . . . 0 N--CA 1.439 -0.992 0 CA-C-O 121.854 0.835 . . . . 0.0 112.397 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 3' ' ' ARG . 0.4 OUTLIER -94.48 132.04 39.56 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.08 176.767 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.459 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 70.3 m-85 -92.09 -162.96 0.98 Allowed 'General case' 0 N--CA 1.398 -3.029 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 175.719 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.7 ttt -61.88 137.56 58.26 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 120.51 0.195 . . . . 0.0 110.57 -175.057 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 76.84 -5.09 2.24 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.926 1.291 . . . . 0.0 111.888 -179.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.92 146.39 36.58 Favored Glycine 0 N--CA 1.435 -1.394 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 176.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.467 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 16.2 t70 -73.23 145.37 46.26 Favored 'General case' 0 CA--C 1.485 -1.548 0 CA-C-O 120.947 0.404 . . . . 0.0 111.081 -176.353 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.7 p -153.73 152.75 31.12 Favored 'General case' 0 N--CA 1.41 -2.472 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.459 -178.352 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -113.34 -32.88 6.12 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 173.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -131.71 165.44 23.72 Favored 'General case' 0 N--CA 1.417 -2.097 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 176.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -70.03 -16.18 63.12 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 121.552 0.691 . . . . 0.0 110.469 -175.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -72.92 -23.75 60.74 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.974 -177.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -76.72 -16.24 59.56 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.154 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 33.9 m -99.14 156.56 16.89 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.805 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 36.4 m -64.45 173.82 1.95 Allowed 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.797 176.601 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -60.8 -51.91 67.31 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.63 1.172 . . . . 0.0 113.024 -171.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 41.3 m80 -70.82 2.37 4.33 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 114.202 -1.363 . . . . 0.0 113.237 -178.125 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.6 mp -122.52 173.17 7.85 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.564 0.697 . . . . 0.0 112.561 -177.445 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -138.97 156.92 24.61 Favored Glycine 0 N--CA 1.43 -1.766 0 N-CA-C 108.304 -1.919 . . . . 0.0 108.304 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.3 t -100.74 121.57 41.88 Favored 'General case' 0 C--N 1.286 -2.159 0 CA-C-N 117.774 0.787 . . . . 0.0 110.783 -175.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -75.31 110.66 9.85 Favored 'General case' 0 CA--C 1.461 -2.445 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 171.664 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.43 ' H ' ' HD2' ' A' ' 23' ' ' ARG . 2.3 mpt_? -77.36 -11.55 59.85 Favored 'General case' 0 C--N 1.291 -1.967 0 O-C-N 124.531 1.145 . . . . 0.0 109.578 -176.114 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -89.59 -27.69 20.05 Favored 'General case' 0 N--CA 1.433 -1.3 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.455 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 93.4 mmm -112.84 -6.82 13.8 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -172.318 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.467 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 4.9 mptp? 59.65 33.13 21.88 Favored 'General case' 0 CA--C 1.495 -1.17 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.455 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 17.3 p90 -144.66 153.3 41.6 Favored 'General case' 0 CA--C 1.486 -1.49 0 C-N-CA 118.881 -1.128 . . . . 0.0 112.946 177.131 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 39.7 m -80.04 131.42 35.78 Favored 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 113.966 -1.47 . . . . 0.0 110.046 -179.264 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -124.13 175.5 6.97 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 178.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -70.63 -4.66 24.45 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -175.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 . . . . . 0 N--CA 1.418 -2.03 0 N-CA-C 103.59 -2.745 . . . . 0.0 103.59 175.517 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.9 p . . . . . 0 N--CA 1.429 -1.479 0 CA-C-O 121.281 0.562 . . . . 0.0 111.25 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 33.9 mmt180 -82.09 125.93 31.42 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 115.004 -0.998 . . . . 0.0 108.425 176.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.501 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 76.9 m-85 -88.39 -164.91 1.2 Allowed 'General case' 0 N--CA 1.387 -3.625 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.532 178.28 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.491 ' HA ' ' O ' ' A' ' 28' ' ' CYS . 16.3 ttt -63.97 134.03 54.3 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 120.817 0.342 . . . . 0.0 110.354 -173.455 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 78.79 -1.77 2.35 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 125.631 1.572 . . . . 0.0 111.717 -179.301 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.3 145.06 32.71 Favored Glycine 0 N--CA 1.439 -1.105 0 N-CA-C 110.201 -1.16 . . . . 0.0 110.201 176.372 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.415 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 13.5 t70 -67.7 144.9 55.24 Favored 'General case' 0 CA--C 1.495 -1.151 0 C-N-CA 123.117 0.567 . . . . 0.0 111.742 -177.268 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.1 p -149.36 161.3 42.33 Favored 'General case' 0 N--CA 1.419 -1.982 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.201 -177.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -118.25 -32.34 4.71 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 172.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.8 pttt -147.42 177.28 9.37 Favored 'General case' 0 N--CA 1.426 -1.663 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 178.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -71.84 -16.32 62.16 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -175.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.24 -30.64 71.68 Favored 'General case' 0 CA--C 1.488 -1.428 0 CA-C-O 121.317 0.58 . . . . 0.0 110.498 177.144 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -68.83 -32.27 71.84 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.893 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 17.7 m -94.99 155.26 16.8 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.109 -177.242 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.404 ' HB2' HD12 ' A' ' 19' ' ' LEU . 25.1 m -60.77 173.47 0.74 Allowed 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 123.885 0.874 . . . . 0.0 111.351 175.641 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -68.54 -39.4 81.13 Favored 'General case' 0 CA--C 1.5 -0.956 0 CA-C-O 121.884 0.85 . . . . 0.0 111.919 -171.739 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 20.2 m170 -86.87 9.25 19.81 Favored 'General case' 0 C--N 1.278 -2.527 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.206 -176.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.501 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 68.8 mt -126.71 162.83 24.88 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 -178.012 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -139.39 150.96 21.64 Favored Glycine 0 C--N 1.299 -1.51 0 N-CA-C 110.754 -0.939 . . . . 0.0 110.754 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -87.08 106.21 17.7 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -176.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -64.3 114.9 4.56 Favored 'General case' 0 CA--C 1.468 -2.193 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 175.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -65.62 -24.1 66.97 Favored 'General case' 0 C--N 1.308 -1.227 0 O-C-N 125.237 1.585 . . . . 0.0 110.475 -175.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -90.05 -21.47 22.31 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 119.597 -0.841 . . . . 0.0 110.695 -168.779 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -112.3 -29.98 7.35 Favored 'General case' 0 N--CA 1.419 -2.018 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.334 -176.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.447 ' HD3' ' HA ' ' A' ' 26' ' ' LYS . 32.5 mmtp 72.06 49.59 0.24 Allowed 'General case' 0 CA--C 1.494 -1.188 0 C-N-CA 125.227 1.411 . . . . 0.0 110.925 -171.744 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -145.04 160.05 41.99 Favored 'General case' 0 CA--C 1.486 -1.483 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.233 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.491 ' O ' ' HA ' ' A' ' 5' ' ' MET . 56.3 m -85.57 122.81 30.22 Favored 'General case' 0 C--N 1.282 -2.344 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.252 -177.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.49 -165.18 1.17 Allowed 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 106.317 -1.735 . . . . 0.0 106.317 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -75.84 -5.84 47.87 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -176.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 . . . . . 0 N--CA 1.41 -2.432 0 N-CA-C 105.92 -1.881 . . . . 0.0 105.92 173.94 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.5 p . . . . . 0 N--CA 1.424 -1.767 0 CA-C-O 121.649 0.738 . . . . 0.0 111.758 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.72 135.42 41.16 Favored 'General case' 0 C--N 1.283 -2.284 0 CA-C-N 114.388 -1.278 . . . . 0.0 109.476 176.328 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.481 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 87.7 m-85 -91.46 -162.75 0.95 Allowed 'General case' 0 N--CA 1.399 -2.992 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 176.417 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.422 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 10.5 ttt -64.44 135.35 56.01 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 -175.773 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 75.77 9.67 3.45 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.828 1.251 . . . . 0.0 111.938 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.34 144.22 17.36 Favored Glycine 0 N--CA 1.434 -1.44 0 N-CA-C 109.161 -1.575 . . . . 0.0 109.161 173.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -62.47 145.6 53.75 Favored 'General case' 0 CA--C 1.493 -1.217 0 C-N-CA 123.079 0.551 . . . . 0.0 112.138 -176.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 21.6 p -153.47 155.13 35.71 Favored 'General case' 0 N--CA 1.422 -1.85 0 C-N-CA 120.011 -0.676 . . . . 0.0 110.757 -179.003 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -121.44 -34.33 3.47 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 172.464 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.6 pttt -131.36 174.09 10.42 Favored 'General case' 0 N--CA 1.42 -1.974 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 176.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -74.03 -16.06 61.06 Favored 'General case' 0 C--N 1.297 -1.717 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 -174.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -71.19 -24.7 62.27 Favored 'General case' 0 CA--C 1.483 -1.632 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.732 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -69.54 -25.54 64.06 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.609 -178.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 25.7 m -96.58 155.61 16.69 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.709 -178.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.7 m -66.13 178.01 1.26 Allowed 'General case' 0 C--N 1.291 -1.977 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.421 176.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 36.3 mmtp -57.61 -55.64 32.26 Favored 'General case' 0 CA--C 1.505 -0.763 0 C-N-CA 124.304 1.041 . . . . 0.0 113.066 -171.15 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 39.5 m80 -72.8 1.47 8.51 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 115.204 -0.907 . . . . 0.0 113.342 -176.595 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.3 mp -124.7 166.95 15.25 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-O 121.682 0.753 . . . . 0.0 111.961 -175.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -135.46 161.88 24.77 Favored Glycine 0 N--CA 1.419 -2.467 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 178.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.4 t -88.23 122.1 31.38 Favored 'General case' 0 C--N 1.285 -2.22 0 CA-C-N 116.92 0.36 . . . . 0.0 110.851 -176.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -83.9 114.37 21.62 Favored 'General case' 0 CA--C 1.465 -2.316 0 C-N-CA 119.426 -0.91 . . . . 0.0 110.06 175.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -67.11 -24.17 65.91 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 113.804 -1.544 . . . . 0.0 110.222 -178.392 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -87.39 -26.38 23.35 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 115.263 -0.88 . . . . 0.0 109.569 -174.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.548 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 76.3 mmm -110.4 -15.66 13.88 Favored 'General case' 0 C--N 1.291 -1.96 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.007 -170.057 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm 62.56 33.35 15.96 Favored 'General case' 0 CA--C 1.496 -1.124 0 C-N-CA 124.856 1.263 . . . . 0.0 110.348 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.548 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 3.3 p90 -151.18 161.23 43.1 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.419 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.481 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 57.6 m -79.28 135.36 36.73 Favored 'General case' 0 C--N 1.278 -2.536 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.719 -177.565 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.422 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -130.46 -178.89 4.96 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 176.204 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -71.91 0.38 9.36 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -175.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.3 t70 . . . . . 0 N--CA 1.416 -2.152 0 N-CA-C 105.034 -2.21 . . . . 0.0 105.034 179.422 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.2 p . . . . . 0 N--CA 1.411 -2.421 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -95.29 132.7 40.0 Favored 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.205 177.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.413 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 78.7 m-85 -92.11 -165.43 1.35 Allowed 'General case' 0 N--CA 1.409 -2.505 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.867 -177.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.2 ttt -61.61 136.06 57.87 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -176.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 78.58 -4.99 2.1 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.571 1.149 . . . . 0.0 111.743 -178.237 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.13 147.72 36.65 Favored Glycine 0 N--CA 1.44 -1.089 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 174.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -63.66 143.71 57.61 Favored 'General case' 0 CA--C 1.484 -1.563 0 C-N-CA 123.25 0.62 . . . . 0.0 112.243 -174.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.7 p -152.9 147.68 26.27 Favored 'General case' 0 C--N 1.279 -2.496 0 C-N-CA 118.544 -1.262 . . . . 0.0 111.192 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -125.79 -23.29 4.02 Favored 'General case' 0 N--CA 1.424 -1.733 0 CA-C-N 114.642 -1.163 . . . . 0.0 108.646 172.132 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -139.64 165.08 28.21 Favored 'General case' 0 N--CA 1.424 -1.752 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 176.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -71.69 -15.69 62.22 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.232 0.539 . . . . 0.0 110.634 -176.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -65.3 -28.15 69.12 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 114.838 -1.073 . . . . 0.0 110.931 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -73.06 -30.12 63.47 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.206 -176.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 12.2 m -95.77 155.58 16.69 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.773 -176.143 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 18.3 m -61.67 171.15 1.65 Allowed 'General case' 0 C--N 1.304 -1.372 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.673 174.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -72.05 -42.89 65.75 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-O 121.281 0.562 . . . . 0.0 110.933 -173.231 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 36.0 m80 -64.03 0.35 0.93 Allowed 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 114.855 -1.066 . . . . 0.0 112.788 175.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.6 mp -128.73 -175.98 3.7 Favored 'General case' 0 N--CA 1.421 -1.916 0 CA-C-O 121.078 0.466 . . . . 0.0 110.616 -178.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -152.28 161.29 29.34 Favored Glycine 0 N--CA 1.418 -2.556 0 N-CA-C 108.918 -1.673 . . . . 0.0 108.918 175.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.3 t -87.6 131.62 34.35 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-N 117.446 0.623 . . . . 0.0 111.136 -178.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -103.1 107.52 18.36 Favored 'General case' 0 CA--C 1.469 -2.148 0 CA-C-O 121.477 0.656 . . . . 0.0 110.259 172.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -74.75 -5.32 42.71 Favored 'General case' 0 C--N 1.293 -1.853 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.627 -177.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -89.03 -29.98 19.06 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.414 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 95.8 mmm -112.65 -9.98 13.69 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 114.791 -1.095 . . . . 0.0 112.589 -177.289 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp 65.15 28.71 12.15 Favored 'General case' 0 CA--C 1.504 -0.799 0 C-N-CA 124.901 1.28 . . . . 0.0 111.306 -178.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.414 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 1.3 p90 -145.56 162.44 37.45 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-N 114.849 -1.069 . . . . 0.0 111.747 179.357 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 52.3 m -77.24 135.21 38.45 Favored 'General case' 0 C--N 1.287 -2.14 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.589 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -124.67 -178.81 4.26 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 176.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -71.04 -3.92 22.24 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.471 1.285 . . . . 0.0 114.471 -175.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 . . . . . 0 N--CA 1.41 -2.446 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 178.028 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.4 p . . . . . 0 N--CA 1.413 -2.278 0 CA-C-O 121.385 0.612 . . . . 0.0 110.529 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ARG . . . . . 0.466 ' HB3' ' HA3' ' A' ' 7' ' ' GLY . 8.6 mpt_? -99.06 137.07 38.12 Favored 'General case' 0 C--N 1.285 -2.223 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.828 176.844 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.53 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 74.0 m-85 -86.98 -166.99 1.73 Allowed 'General case' 0 N--CA 1.399 -2.991 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.572 174.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 13.0 ttt -60.56 133.62 56.27 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 -175.094 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 74.99 5.59 4.31 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.618 1.167 . . . . 0.0 112.023 -178.265 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLY . . . . . 0.466 ' HA3' ' HB3' ' A' ' 3' ' ' ARG . . . -80.03 160.84 44.98 Favored Glycine 0 N--CA 1.442 -0.932 0 N-CA-C 109.22 -1.552 . . . . 0.0 109.22 173.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.43 141.52 45.03 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -174.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.2 p -151.19 155.13 38.21 Favored 'General case' 0 N--CA 1.423 -1.775 0 C-N-CA 119.828 -0.749 . . . . 0.0 111.915 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -119.42 -39.23 2.91 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 124.725 1.21 . . . . 0.0 108.169 172.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.8 pttm -132.36 175.42 9.3 Favored 'General case' 0 N--CA 1.423 -1.785 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -74.84 -17.43 60.6 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 121.1 0.476 . . . . 0.0 110.294 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -69.68 -23.43 63.44 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.333 -177.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -76.81 -25.14 52.94 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 -177.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 39.5 m -91.73 159.66 15.73 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.758 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.511 ' HB2' HD12 ' A' ' 19' ' ' LEU . 69.9 m -67.09 178.66 1.36 Allowed 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.255 176.599 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -55.23 -61.29 2.43 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-O 121.855 0.836 . . . . 0.0 112.587 -172.552 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 63.8 m80 -78.93 22.06 0.4 Allowed 'General case' 0 C--N 1.281 -2.372 0 CA-C-N 113.93 -1.486 . . . . 0.0 112.362 -174.708 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.53 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 61.6 mt -131.49 157.77 42.64 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 120.893 0.378 . . . . 0.0 110.141 -178.164 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -135.12 152.28 20.75 Favored Glycine 0 N--CA 1.43 -1.761 0 N-CA-C 108.95 -1.66 . . . . 0.0 108.95 177.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.6 t -87.72 123.85 32.96 Favored 'General case' 0 C--N 1.287 -2.129 0 CA-C-N 117.293 0.546 . . . . 0.0 111.174 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 33.5 mmtm -87.16 108.9 19.12 Favored 'General case' 0 CA--C 1.468 -2.188 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.114 172.714 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? -69.45 -5.0 20.95 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 114.336 -1.302 . . . . 0.0 112.06 -177.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -87.82 -39.49 14.81 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 -176.069 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 93.1 mmm -113.17 -3.35 13.93 Favored 'General case' 0 N--CA 1.427 -1.582 0 CA-C-N 114.519 -1.219 . . . . 0.0 112.136 -175.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.462 ' HD3' ' HA ' ' A' ' 26' ' ' LYS . 32.6 mmtp 55.11 45.67 25.62 Favored 'General case' 0 C--O 1.248 1.007 0 C-N-CA 124.555 1.142 . . . . 0.0 113.454 -178.024 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -142.14 162.81 34.54 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.945 176.385 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 61.4 m -81.76 127.36 32.87 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 115.316 -0.857 . . . . 0.0 111.288 -177.671 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -118.91 -176.12 3.04 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 106.516 -1.661 . . . . 0.0 106.516 177.291 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -73.34 -9.95 59.24 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -176.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 . . . . . 0 N--CA 1.425 -1.715 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 176.756 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.9 p . . . . . 0 N--CA 1.418 -2.06 0 CA-C-O 121.937 0.875 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ARG . . . . . 0.418 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 28.5 mmt180 -95.07 143.4 26.56 Favored 'General case' 0 C--N 1.27 -2.86 0 CA-C-N 113.939 -1.482 . . . . 0.0 108.369 -177.379 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.433 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 65.6 m-85 -92.65 -165.71 1.4 Allowed 'General case' 0 N--CA 1.394 -3.23 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.574 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.9 ttt -64.32 138.14 58.28 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -175.515 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 74.1 6.53 4.76 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.576 1.15 . . . . 0.0 111.815 -179.009 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -85.96 146.95 21.54 Favored Glycine 0 N--CA 1.436 -1.333 0 N-CA-C 109.819 -1.313 . . . . 0.0 109.819 174.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.418 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 16.2 t70 -67.11 139.92 57.55 Favored 'General case' 0 CA--C 1.495 -1.172 0 C-N-CA 123.694 0.798 . . . . 0.0 112.498 -176.672 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.568 ' O ' ' HE2' ' A' ' 26' ' ' LYS . 31.3 p -157.63 157.53 33.8 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.409 -177.185 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -113.29 -37.42 4.71 Favored 'General case' 0 CA--C 1.507 -0.678 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 169.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.436 ' HE2' ' HB2' ' A' ' 13' ' ' GLU . 23.9 pttm -126.42 170.2 12.21 Favored 'General case' 0 N--CA 1.418 -2.034 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.01 -176.149 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -73.01 -19.26 61.24 Favored 'General case' 0 CA--C 1.486 -1.514 0 CA-C-O 121.122 0.487 . . . . 0.0 110.053 -176.353 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.436 ' HB2' ' HE2' ' A' ' 11' ' ' LYS . 47.2 mt-10 -72.44 -24.84 61.27 Favored 'General case' 0 CA--C 1.482 -1.66 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.996 -177.603 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -71.0 -29.2 65.09 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 -178.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 33.5 m -88.76 162.29 16.31 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.266 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 82.0 m -71.7 178.03 3.82 Favored 'General case' 0 N--CA 1.427 -1.62 0 CA-C-O 121.048 0.451 . . . . 0.0 111.48 176.301 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -54.84 -59.44 4.72 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.453 1.101 . . . . 0.0 113.926 -169.241 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 27.1 m170 -81.86 21.85 0.81 Allowed 'General case' 0 C--N 1.285 -2.229 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.076 -173.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.406 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 51.6 mt -125.02 167.92 14.06 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -178.73 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -140.87 146.2 17.35 Favored Glycine 0 N--CA 1.423 -2.207 0 N-CA-C 108.671 -1.772 . . . . 0.0 108.671 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 47.5 t -88.25 127.32 35.46 Favored 'General case' 0 C--N 1.283 -2.325 0 CA-C-O 121.333 0.587 . . . . 0.0 110.423 -176.142 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.437 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 56.4 mmtt -93.59 107.95 19.74 Favored 'General case' 0 N--CA 1.413 -2.302 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.0 175.641 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -72.48 -5.2 35.11 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.023 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -86.23 -37.52 18.54 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.509 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 95.6 mmm -112.86 -9.57 13.64 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.368 -174.314 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.568 ' HE2' ' O ' ' A' ' 9' ' ' CYS . 13.9 mmmm 66.4 35.04 5.91 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 124.738 1.215 . . . . 0.0 112.275 -179.488 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.509 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 14.2 p90 -147.18 160.46 42.43 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.879 178.771 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.433 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 57.1 m -79.78 130.71 35.55 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.308 -178.037 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.32 -175.53 3.02 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -79.4 1.97 23.41 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.321 0.964 . . . . 0.0 112.789 -178.2 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.0 t70 . . . . . 0 N--CA 1.425 -1.69 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 -177.73 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.4 p . . . . . 0 N--CA 1.419 -2.001 0 CA-C-O 121.633 0.73 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ARG . . . . . 0.573 ' HB2' ' SG ' ' A' ' 28' ' ' CYS . 20.6 mmt180 -90.85 132.16 36.06 Favored 'General case' 0 C--N 1.28 -2.456 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 178.532 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.456 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 48.0 m-85 -84.93 -165.66 1.26 Allowed 'General case' 0 N--CA 1.397 -3.1 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 172.144 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.7 ttt -66.39 137.53 56.94 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -175.388 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 77.47 1.09 2.98 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.74 1.216 . . . . 0.0 111.436 -178.578 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.18 136.27 16.5 Favored Glycine 0 N--CA 1.429 -1.768 0 N-CA-C 108.877 -1.689 . . . . 0.0 108.877 174.152 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -60.0 140.49 56.74 Favored 'General case' 0 CA--C 1.492 -1.26 0 C-N-CA 123.266 0.627 . . . . 0.0 112.588 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.485 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 19.2 p -141.51 154.95 45.81 Favored 'General case' 0 N--CA 1.416 -2.174 0 C-N-CA 119.585 -0.846 . . . . 0.0 111.249 -176.152 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -118.14 -39.64 3.04 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 175.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.9 pttm -135.23 172.9 12.35 Favored 'General case' 0 N--CA 1.422 -1.872 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.099 -178.232 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -75.6 -16.13 60.26 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-O 121.022 0.439 . . . . 0.0 111.025 -176.373 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -70.37 -24.07 62.89 Favored 'General case' 0 CA--C 1.489 -1.4 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.486 -178.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -72.23 -31.55 65.93 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -178.161 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 17.3 m -89.28 155.08 19.61 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.504 -176.109 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.432 ' HB2' HD12 ' A' ' 19' ' ' LEU . 43.9 m -67.01 178.03 1.53 Allowed 'General case' 0 C--N 1.302 -1.466 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.562 177.457 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -63.07 -55.12 28.17 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -171.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -74.09 11.48 0.91 Allowed 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.945 -178.286 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.556 HD23 ' HA ' ' A' ' 30' ' ' TRP . 62.2 mt -128.21 -179.42 5.0 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 -177.336 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -161.5 165.36 35.52 Favored Glycine 0 N--CA 1.418 -2.554 0 N-CA-C 108.936 -1.666 . . . . 0.0 108.936 177.727 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.3 t -92.51 124.83 36.84 Favored 'General case' 0 C--N 1.289 -2.052 0 CA-C-O 121.343 0.592 . . . . 0.0 110.31 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.452 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 30.1 mmtp -99.86 112.29 24.56 Favored 'General case' 0 C--N 1.287 -2.124 0 CA-C-O 121.103 0.477 . . . . 0.0 110.374 173.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.9 mpt_? -73.11 -10.84 60.21 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 114.357 -1.292 . . . . 0.0 111.109 -177.171 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -85.26 -30.21 23.99 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -177.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 80.8 mmm -111.22 -10.69 14.27 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 114.407 -1.27 . . . . 0.0 110.856 -173.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.56 ' HD2' ' N ' ' A' ' 26' ' ' LYS . 9.6 mptt 62.1 26.1 15.68 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 125.816 1.646 . . . . 0.0 110.864 179.554 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -142.59 165.97 25.95 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.605 179.274 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.573 ' SG ' ' HB2' ' A' ' 3' ' ' ARG . 63.1 m -81.38 131.28 35.28 Favored 'General case' 0 N--CA 1.414 -2.253 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.37 -179.163 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.404 ' C ' ' H ' ' A' ' 31' ' ' ASP . . . -118.55 -175.82 2.96 Favored 'General case' 0 C--N 1.283 -2.308 0 N-CA-C 105.583 -2.006 . . . . 0.0 105.583 176.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.556 ' HA ' HD23 ' A' ' 19' ' ' LEU . 98.5 m95 -80.87 19.52 0.85 Allowed 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 119.303 0.956 . . . . 0.0 110.349 178.705 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.404 ' H ' ' C ' ' A' ' 29' ' ' ALA . 36.1 t70 . . . . . 0 N--CA 1.401 -2.878 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.387 -170.365 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.3 p . . . . . 0 N--CA 1.43 -1.46 0 CA-C-O 121.818 0.818 . . . . 0.0 111.796 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 39.5 mmt180 -86.92 133.95 33.56 Favored 'General case' 0 C--N 1.282 -2.332 0 CA-C-N 114.3 -1.318 . . . . 0.0 110.079 178.445 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.416 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 25.0 m-85 -84.71 -166.6 1.52 Allowed 'General case' 0 N--CA 1.399 -3.008 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.156 174.214 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.473 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 11.3 ttt -65.74 138.8 58.19 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 -176.221 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 77.03 2.6 3.27 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.205 1.402 . . . . 0.0 111.832 -179.02 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -82.62 146.69 24.75 Favored Glycine 0 N--CA 1.435 -1.427 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 175.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.417 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 14.5 t70 -64.3 145.14 56.5 Favored 'General case' 0 CA--C 1.492 -1.251 0 C-N-CA 123.106 0.562 . . . . 0.0 112.207 -178.328 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.423 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 31.0 p -152.59 149.24 28.26 Favored 'General case' 0 N--CA 1.417 -2.094 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.145 -178.112 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -113.21 -23.73 9.79 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 173.441 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.8 pttm -145.67 172.25 13.55 Favored 'General case' 0 N--CA 1.423 -1.816 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 179.45 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -74.2 -16.71 60.96 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 121.337 0.589 . . . . 0.0 110.143 -177.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -73.15 -22.36 60.53 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.393 -178.093 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -77.02 -24.98 52.08 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 -179.456 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.8 m -89.94 161.62 15.82 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 115.157 -0.928 . . . . 0.0 109.034 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.417 ' HB2' HD12 ' A' ' 19' ' ' LEU . 56.4 m -70.38 178.42 2.91 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.517 174.621 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -61.55 -51.01 70.36 Favored 'General case' 0 CA--C 1.498 -1.019 0 CA-C-O 121.542 0.687 . . . . 0.0 112.799 -171.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 38.4 m-70 -76.55 14.06 0.86 Allowed 'General case' 0 C--N 1.283 -2.298 0 CA-C-N 114.658 -1.155 . . . . 0.0 112.417 -176.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.417 HD12 ' HB2' ' A' ' 16' ' ' CYS . 46.7 mt -128.93 153.2 47.74 Favored 'General case' 0 N--CA 1.433 -1.318 0 CA-C-O 121.151 0.5 . . . . 0.0 110.207 -175.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -131.16 145.77 17.25 Favored Glycine 0 N--CA 1.426 -1.992 0 N-CA-C 108.814 -1.714 . . . . 0.0 108.814 177.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 39.0 t -84.81 111.88 20.02 Favored 'General case' 0 C--N 1.284 -2.248 0 CA-C-N 116.96 0.38 . . . . 0.0 111.231 -175.486 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.437 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 71.3 mmtt -72.53 113.34 9.45 Favored 'General case' 0 CA--C 1.482 -1.66 0 O-C-N 121.301 -0.874 . . . . 0.0 108.667 177.119 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.6 mmt180 -69.38 -12.74 61.91 Favored 'General case' 0 C--N 1.315 -0.897 0 O-C-N 124.49 1.119 . . . . 0.0 109.896 -178.289 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -89.59 -29.93 18.52 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-O 122.093 0.949 . . . . 0.0 109.378 -175.637 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.577 ' HB3' ' CD1' ' A' ' 27' ' ' TYR . 23.3 mmt -111.81 -16.28 13.2 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.268 -173.08 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 66.44 33.7 6.69 Favored 'General case' 0 CA--C 1.499 -1.015 0 C-N-CA 124.372 1.069 . . . . 0.0 110.119 -178.574 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.577 ' CD1' ' HB3' ' A' ' 25' ' ' MET . 4.0 p90 -143.45 158.29 43.76 Favored 'General case' 0 CA--C 1.489 -1.369 0 CA-C-N 114.511 -1.222 . . . . 0.0 112.55 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.468 ' O ' ' HA ' ' A' ' 5' ' ' MET . 77.0 m -78.86 123.84 27.63 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.963 -178.71 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.473 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -119.61 -172.39 2.32 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 177.601 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -78.55 1.15 23.44 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 119.155 0.889 . . . . 0.0 112.915 -176.753 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.437 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 19.5 t70 . . . . . 0 N--CA 1.434 -1.269 0 C-N-CA 125.158 1.383 . . . . 0.0 107.914 177.706 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 6.2 p . . . . . 0 N--CA 1.424 -1.769 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ARG . . . . . 0.45 ' HD2' ' HA3' ' A' ' 7' ' ' GLY . 16.4 tpp180 -92.26 124.98 36.73 Favored 'General case' 0 C--N 1.272 -2.761 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -88.39 -167.36 1.86 Allowed 'General case' 0 N--CA 1.412 -2.363 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.707 -177.406 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 13.3 ttt -64.23 139.16 58.74 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.704 -173.266 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 74.28 8.6 4.56 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.934 1.294 . . . . 0.0 111.674 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLY . . . . . 0.45 ' HA3' ' HD2' ' A' ' 3' ' ' ARG . . . -95.06 145.07 17.56 Favored Glycine 0 N--CA 1.419 -2.498 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 175.296 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.485 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 20.9 t70 -64.78 143.66 57.78 Favored 'General case' 0 CA--C 1.493 -1.248 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -176.172 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 23.9 p -150.51 149.69 30.29 Favored 'General case' 0 N--CA 1.417 -2.11 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.872 -177.571 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -112.14 -35.52 5.62 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 175.584 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.9 pttp -134.34 162.33 32.5 Favored 'General case' 0 N--CA 1.42 -1.95 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.16 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -64.14 -18.68 64.68 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-O 121.04 0.447 . . . . 0.0 111.946 -178.144 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -71.48 -21.96 61.87 Favored 'General case' 0 CA--C 1.493 -1.245 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.953 -177.429 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -75.24 -30.8 60.64 Favored 'General case' 0 N--CA 1.42 -1.928 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.971 -178.242 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 20.7 m -90.22 155.46 18.99 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.042 -178.221 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.498 ' HB2' HD13 ' A' ' 19' ' ' LEU . 32.5 m -61.41 176.97 0.42 Allowed 'General case' 0 C--N 1.298 -1.651 0 C-N-CA 124.515 1.126 . . . . 0.0 112.942 176.213 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.1 mttp -66.36 -48.48 70.06 Favored 'General case' 0 CA--C 1.496 -1.098 0 CA-C-O 122.377 1.084 . . . . 0.0 109.902 -175.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -68.14 -1.39 5.91 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 113.597 -1.638 . . . . 0.0 112.708 -178.346 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.498 HD13 ' HB2' ' A' ' 16' ' ' CYS . 5.8 mp -130.51 176.5 8.11 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-O 121.251 0.548 . . . . 0.0 111.473 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.73 160.77 28.01 Favored Glycine 0 N--CA 1.419 -2.468 0 N-CA-C 108.506 -1.837 . . . . 0.0 108.506 177.413 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.4 t -93.7 120.58 34.15 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 117.351 0.576 . . . . 0.0 110.412 -177.176 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.415 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 73.8 mmtt -85.15 108.72 17.83 Favored 'General case' 0 CA--C 1.455 -2.687 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 173.795 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.538 ' H ' ' HD2' ' A' ' 23' ' ' ARG . 1.3 mpt_? -79.68 -8.08 58.99 Favored 'General case' 0 C--N 1.282 -2.328 0 CA-C-N 114.991 -1.004 . . . . 0.0 108.64 -174.83 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -90.01 -27.77 19.53 Favored 'General case' 0 CA--C 1.501 -0.918 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.128 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.589 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 90.5 mmm -109.64 -19.06 13.32 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.655 -172.76 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.485 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 71.8 mmtt 72.84 29.64 1.85 Allowed 'General case' 0 CA--C 1.497 -1.088 0 C-N-CA 125.555 1.542 . . . . 0.0 111.568 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.589 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 27.4 p90 -147.89 158.68 44.16 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.875 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.2 m -77.44 130.8 37.51 Favored 'General case' 0 C--N 1.291 -1.97 0 CA-C-N 114.676 -1.147 . . . . 0.0 110.51 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -122.73 -178.18 3.86 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 177.249 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -76.05 8.2 3.42 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.307 0.958 . . . . 0.0 113.072 -176.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.415 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 3.8 p30 . . . . . 0 N--CA 1.409 -2.501 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.5 p . . . . . 0 N--CA 1.423 -1.782 0 CA-C-O 121.003 0.43 . . . . 0.0 110.361 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ARG . . . . . 0.453 ' HB3' ' HA3' ' A' ' 7' ' ' GLY . 9.0 mpt_? -83.83 131.47 34.88 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.882 178.36 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.486 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 79.1 m-85 -89.79 -163.06 0.95 Allowed 'General case' 0 N--CA 1.391 -3.377 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.2 ttt -66.56 134.0 51.48 Favored 'General case' 0 C--N 1.299 -1.587 0 C-N-CA 120.279 -0.568 . . . . 0.0 109.934 -173.293 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 76.57 6.48 3.43 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 124.955 1.302 . . . . 0.0 111.966 -178.325 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLY . . . . . 0.453 ' HA3' ' HB3' ' A' ' 3' ' ' ARG . . . -79.02 156.37 41.84 Favored Glycine 0 N--CA 1.443 -0.839 0 N-CA-C 108.047 -2.021 . . . . 0.0 108.047 172.038 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -88.36 140.2 29.71 Favored 'General case' 0 CA--C 1.476 -1.875 0 CA-C-N 118.256 1.028 . . . . 0.0 110.733 -172.196 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.9 p -144.04 147.22 33.54 Favored 'General case' 0 C--N 1.272 -2.797 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.984 -175.559 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -110.34 -30.0 7.88 Favored 'General case' 0 C--N 1.293 -1.89 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 177.131 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.509 ' HD2' ' OE1' ' A' ' 13' ' ' GLU . 17.2 pttp -139.43 167.18 22.66 Favored 'General case' 0 N--CA 1.426 -1.649 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.268 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -70.73 -18.17 62.8 Favored 'General case' 0 CA--C 1.493 -1.212 0 CA-C-O 121.121 0.486 . . . . 0.0 110.911 -174.256 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.509 ' OE1' ' HD2' ' A' ' 11' ' ' LYS . 36.4 mt-10 -70.88 -19.13 62.65 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.119 -176.345 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -79.84 -24.73 41.11 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-N 115.065 -0.97 . . . . 0.0 109.314 -176.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 35.0 m -92.83 159.71 15.26 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.425 ' HB2' HD13 ' A' ' 19' ' ' LEU . 38.3 m -64.33 174.06 1.8 Allowed 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.536 177.245 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.6 mtpt -75.99 -33.4 59.72 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 121.655 0.741 . . . . 0.0 110.978 -171.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 36.3 m80 -81.8 6.57 15.15 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.208 178.221 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.425 HD13 ' HB2' ' A' ' 16' ' ' CYS . 5.2 mp -131.84 -180.0 5.73 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-O 121.066 0.46 . . . . 0.0 110.797 -178.69 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -148.03 163.04 28.86 Favored Glycine 0 N--CA 1.424 -2.115 0 N-CA-C 109.661 -1.376 . . . . 0.0 109.661 177.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.1 t -95.96 120.34 36.07 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 117.304 0.552 . . . . 0.0 109.714 -178.127 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.457 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 73.1 mmtt -81.62 107.28 14.24 Favored 'General case' 0 CA--C 1.453 -2.774 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 172.902 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.464 ' H ' ' HD2' ' A' ' 23' ' ' ARG . 2.1 mpt_? -75.56 -3.16 32.65 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.411 -173.469 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -90.44 -31.68 16.72 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-O 122.198 0.999 . . . . 0.0 109.081 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 87.9 mmm -111.86 -9.9 14.03 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.964 -175.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp 63.71 36.69 10.53 Favored 'General case' 0 CA--C 1.503 -0.843 0 C-N-CA 124.455 1.102 . . . . 0.0 111.852 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -143.07 159.04 43.01 Favored 'General case' 0 CA--C 1.486 -1.505 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.438 177.036 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.486 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 39.2 m -82.03 130.28 35.03 Favored 'General case' 0 C--N 1.284 -2.264 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.988 -176.662 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -121.31 -175.47 3.08 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 106.025 -1.843 . . . . 0.0 106.025 176.241 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -79.8 10.97 3.54 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 119.588 1.085 . . . . 0.0 113.115 -175.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 N--CA 1.415 -2.18 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 178.725 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.6 p . . . . . 0 N--CA 1.413 -2.295 0 CA-C-O 122.031 0.92 . . . . 0.0 112.237 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -91.15 136.82 32.82 Favored 'General case' 0 C--N 1.279 -2.498 0 CA-C-N 113.964 -1.471 . . . . 0.0 108.609 177.51 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.426 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 51.2 m-85 -85.19 -167.55 1.88 Allowed 'General case' 0 N--CA 1.401 -2.923 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.087 178.077 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 12.6 ttt -66.54 136.51 55.75 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 -175.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 76.46 9.58 3.06 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 124.99 1.316 . . . . 0.0 111.765 -178.44 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLY . . . . . 0.417 ' O ' ' HA ' ' A' ' 27' ' ' TYR . . . -88.14 145.45 19.16 Favored Glycine 0 N--CA 1.44 -1.08 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 173.833 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.555 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 15.3 t70 -60.91 143.02 55.83 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.704 0.802 . . . . 0.0 112.258 -177.373 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 21.1 p -153.75 148.92 26.91 Favored 'General case' 0 C--N 1.311 -1.092 0 C-N-CA 119.226 -0.99 . . . . 0.0 113.374 -177.634 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -106.02 -38.53 6.28 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 173.031 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.579 ' HG2' ' OD1' ' A' ' 14' ' ' ASP . 5.0 ptpp? -137.37 177.21 8.04 Favored 'General case' 0 N--CA 1.414 -2.258 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -175.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -74.54 -18.12 60.64 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-O 121.163 0.506 . . . . 0.0 111.038 -175.91 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.485 ' H ' ' HG3' ' A' ' 11' ' ' LYS . 12.0 mm-40 -72.98 -21.58 60.82 Favored 'General case' 0 CA--C 1.495 -1.141 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.919 -178.65 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.579 ' OD1' ' HG2' ' A' ' 11' ' ' LYS . 31.0 m-20 -72.99 -27.61 61.9 Favored 'General case' 0 N--CA 1.431 -1.391 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.0 m -92.6 164.32 13.47 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.893 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.41 ' HB2' HD12 ' A' ' 19' ' ' LEU . 62.4 m -70.57 176.51 4.05 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.93 175.121 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -68.91 -49.9 54.16 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-O 121.542 0.687 . . . . 0.0 112.089 -170.133 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 55.9 m80 -76.94 15.67 0.65 Allowed 'General case' 0 C--N 1.287 -2.122 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.385 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.426 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 87.0 mt -122.08 174.68 6.79 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.88 144.09 11.56 Favored Glycine 0 C--N 1.306 -1.09 0 N-CA-C 110.221 -1.152 . . . . 0.0 110.221 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 39.2 t -90.23 123.02 33.68 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -174.122 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 41.2 mmtt -90.13 110.8 21.8 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.786 -0.571 . . . . 0.0 110.106 168.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -76.26 -12.79 60.14 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.79 -177.01 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -87.88 -26.28 22.83 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 -178.63 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.549 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 91.9 mmm -108.0 -16.2 14.35 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 114.721 -1.127 . . . . 0.0 110.687 -173.529 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.555 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 32.2 mmmt 66.29 33.04 7.4 Favored 'General case' 0 CA--C 1.492 -1.28 0 C-N-CA 124.574 1.15 . . . . 0.0 112.31 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.549 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 11.4 p90 -150.05 159.26 44.54 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.925 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.7 m -82.33 130.85 35.19 Favored 'General case' 0 C--N 1.289 -2.057 0 CA-C-N 113.806 -1.543 . . . . 0.0 110.469 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -115.84 -172.27 2.13 Favored 'General case' 0 C--N 1.291 -1.939 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 175.81 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -76.52 -19.18 58.23 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.65 1.114 . . . . 0.0 111.056 178.715 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 46.2 t0 . . . . . 0 C--N 1.282 -2.358 0 N-CA-C 103.873 -2.64 . . . . 0.0 103.873 177.881 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.1 p . . . . . 0 N--CA 1.431 -1.419 0 CA-C-O 121.574 0.702 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -92.29 140.73 29.3 Favored 'General case' 0 C--N 1.273 -2.721 0 CA-C-N 114.744 -1.117 . . . . 0.0 109.966 -178.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.49 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 60.2 m-85 -93.23 -165.9 1.42 Allowed 'General case' 0 N--CA 1.396 -3.16 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.919 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.514 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 10.7 ttt -62.81 135.04 57.13 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 -176.121 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 76.8 3.99 3.41 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 125.452 1.501 . . . . 0.0 111.753 -178.319 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.39 149.21 38.44 Favored Glycine 0 N--CA 1.439 -1.101 0 N-CA-C 108.428 -1.869 . . . . 0.0 108.428 171.629 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -76.63 146.34 38.27 Favored 'General case' 0 CA--C 1.483 -1.602 0 CA-C-N 117.258 0.529 . . . . 0.0 110.073 -174.801 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.3 p -146.02 150.7 36.48 Favored 'General case' 0 C--N 1.278 -2.505 0 C-N-CA 118.556 -1.258 . . . . 0.0 112.368 -176.494 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -108.16 -43.76 4.31 Favored 'General case' 0 N--CA 1.433 -1.319 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 173.375 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.547 ' HD2' ' OE1' ' A' ' 13' ' ' GLU . 46.1 pttt -131.2 169.91 15.29 Favored 'General case' 0 N--CA 1.419 -1.991 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.152 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -68.06 -18.76 64.77 Favored 'General case' 0 CA--C 1.491 -1.327 0 CA-C-O 121.093 0.473 . . . . 0.0 110.864 -179.335 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.547 ' OE1' ' HD2' ' A' ' 11' ' ' LYS . 1.2 mp0 -67.15 -24.7 65.92 Favored 'General case' 0 CA--C 1.492 -1.253 0 CA-C-N 115.084 -0.962 . . . . 0.0 111.027 -179.637 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -72.19 -26.62 62.13 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 121.419 0.628 . . . . 0.0 109.634 -178.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 18.4 m -93.49 159.19 15.35 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.793 -178.353 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.425 ' HB2' HD12 ' A' ' 19' ' ' LEU . 63.9 m -67.08 176.0 2.33 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.727 174.442 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -58.74 -57.12 14.43 Favored 'General case' 0 CA--C 1.504 -0.801 0 C-N-CA 123.909 0.884 . . . . 0.0 113.079 -171.336 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 28.9 m80 -79.08 15.01 1.23 Allowed 'General case' 0 C--N 1.283 -2.304 0 CA-C-N 114.928 -1.033 . . . . 0.0 112.017 -174.358 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.49 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 68.1 mt -123.6 169.05 11.84 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.8 154.19 25.7 Favored Glycine 0 N--CA 1.418 -2.557 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 178.687 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.4 t -89.24 108.93 19.89 Favored 'General case' 0 C--N 1.285 -2.223 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -177.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.415 ' HE2' ' HB3' ' A' ' 29' ' ' ALA . 72.8 mmtt -70.88 112.94 7.45 Favored 'General case' 0 CA--C 1.473 -2.013 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 176.534 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -74.45 -8.43 56.27 Favored 'General case' 0 C--N 1.292 -1.933 0 O-C-N 124.748 1.28 . . . . 0.0 110.119 -176.132 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -88.97 -36.35 15.91 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 -176.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.446 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 96.9 mmm -112.74 -12.85 13.3 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 114.43 -1.259 . . . . 0.0 112.931 -171.254 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp 66.95 38.08 3.7 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 125.006 1.322 . . . . 0.0 111.542 -179.267 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.446 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 8.0 p90 -145.53 161.45 39.74 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.375 -0.83 . . . . 0.0 112.114 178.131 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 59.2 m -81.3 128.6 33.99 Favored 'General case' 0 N--CA 1.419 -1.992 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.452 -176.688 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.514 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -124.67 -171.65 2.4 Favored 'General case' 0 C--N 1.284 -2.245 0 N-CA-C 106.292 -1.744 . . . . 0.0 106.292 175.519 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -75.31 3.01 9.75 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 118.767 0.712 . . . . 0.0 112.748 -178.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.3 p30 . . . . . 0 N--CA 1.416 -2.154 0 N-CA-C 106.65 -1.611 . . . . 0.0 106.65 175.752 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.4 p . . . . . 0 N--CA 1.423 -1.779 0 CA-C-O 121.306 0.574 . . . . 0.0 110.558 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ARG . . . . . 0.552 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 39.0 mmt180 -102.58 135.39 44.31 Favored 'General case' 0 C--N 1.291 -1.959 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.501 -179.599 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.539 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 87.5 m-85 -95.23 -161.77 0.89 Allowed 'General case' 0 N--CA 1.403 -2.777 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 174.771 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.59 ' HA ' ' O ' ' A' ' 28' ' ' CYS . 49.4 ttm -62.72 135.87 57.58 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.726 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 82.13 -8.82 1.24 Allowed 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 125.069 1.348 . . . . 0.0 112.115 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLY . . . . . 0.426 ' HA3' ' HB3' ' A' ' 3' ' ' ARG . . . -76.8 139.65 23.91 Favored Glycine 0 N--CA 1.434 -1.44 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 176.178 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.552 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 17.2 t70 -69.54 141.12 53.9 Favored 'General case' 0 CA--C 1.487 -1.476 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -173.466 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.489 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 23.4 p -143.42 152.77 41.95 Favored 'General case' 0 N--CA 1.414 -2.235 0 C-N-CA 119.783 -0.767 . . . . 0.0 111.51 -176.242 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -113.59 -35.72 5.14 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 174.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 45.7 pttt -141.57 177.52 8.08 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 124.45 1.1 . . . . 0.0 108.36 179.058 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -73.63 -16.07 61.24 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 122.227 -0.296 . . . . 0.0 111.197 -175.599 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -67.87 -25.24 65.42 Favored 'General case' 0 CA--C 1.496 -1.134 0 CA-C-O 121.656 0.741 . . . . 0.0 110.497 179.394 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -68.7 -31.78 71.12 Favored 'General case' 0 N--CA 1.425 -1.677 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.121 -179.031 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.9 m -86.82 159.19 19.17 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.257 -176.631 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.9 m -66.14 178.47 1.14 Allowed 'General case' 0 C--N 1.307 -1.283 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.288 174.407 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -61.46 -52.31 65.05 Favored 'General case' 0 CA--C 1.485 -1.552 0 CA-C-O 121.701 0.762 . . . . 0.0 112.246 -171.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 30.3 m-70 -74.52 3.92 6.89 Favored 'General case' 0 C--N 1.28 -2.427 0 CA-C-N 114.204 -1.362 . . . . 0.0 113.35 -175.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.0 mp -123.93 167.94 13.46 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.571 0.701 . . . . 0.0 112.781 -177.612 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -135.5 159.96 24.31 Favored Glycine 0 N--CA 1.433 -1.558 0 N-CA-C 109.157 -1.577 . . . . 0.0 109.157 179.231 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 32.1 t -94.35 130.65 40.59 Favored 'General case' 0 C--N 1.285 -2.221 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -174.708 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.436 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 58.9 mmtt -96.95 107.21 19.69 Favored 'General case' 0 CA--C 1.474 -1.952 0 CA-C-O 121.351 0.596 . . . . 0.0 110.731 172.705 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -72.22 -12.04 60.99 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 114.563 -1.198 . . . . 0.0 111.837 -176.448 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -89.32 -26.68 20.98 Favored 'General case' 0 C--N 1.302 -1.5 0 CA-C-O 121.972 0.891 . . . . 0.0 108.858 -176.635 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.479 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 97.5 mmm -112.1 -8.6 14.01 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.19 -176.576 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm 63.45 28.75 15.48 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.846 1.258 . . . . 0.0 112.642 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.479 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 8.7 p90 -143.71 161.06 39.55 Favored 'General case' 0 C--N 1.286 -2.179 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.662 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.59 ' O ' ' HA ' ' A' ' 5' ' ' MET . 66.6 m -81.14 140.17 35.17 Favored 'General case' 0 C--N 1.285 -2.213 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.666 -179.005 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -131.52 178.53 6.66 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 105.499 -2.037 . . . . 0.0 105.499 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -68.56 -12.16 60.91 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 119.935 1.243 . . . . 0.0 113.801 -175.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 34.6 t70 . . . . . 0 N--CA 1.415 -2.194 0 CA-C-O 121.335 0.588 . . . . 0.0 109.76 -179.671 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 20.9 p . . . . . 0 N--CA 1.405 -2.709 0 CA-C-O 121.629 0.728 . . . . 0.0 110.835 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -86.06 129.86 34.71 Favored 'General case' 0 C--N 1.273 -2.728 0 CA-C-N 114.357 -1.292 . . . . 0.0 108.717 -178.608 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -86.55 -168.31 2.19 Favored 'General case' 0 N--CA 1.408 -2.544 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.062 178.431 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.461 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 12.8 ttt -69.56 140.08 53.8 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 120.828 0.347 . . . . 0.0 111.16 -172.218 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 74.48 -2.37 2.83 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.745 1.618 . . . . 0.0 112.253 -179.439 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.17 148.64 30.02 Favored Glycine 0 N--CA 1.422 -2.236 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 176.762 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -63.13 139.76 58.8 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 123.774 0.83 . . . . 0.0 112.636 -177.373 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.438 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 23.5 p -146.0 153.9 41.28 Favored 'General case' 0 C--N 1.287 -2.109 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.452 -178.329 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -112.47 -36.27 5.3 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 177.568 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -145.54 167.56 22.73 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 114.159 -1.382 . . . . 0.0 108.475 -179.367 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -67.72 -18.48 64.92 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.23 0.538 . . . . 0.0 111.509 -176.499 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -66.01 -27.26 67.99 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.853 -178.462 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -79.24 -27.2 42.41 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.56 -175.603 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.6 m -88.65 163.49 15.77 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.417 -178.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.472 ' HB2' HD13 ' A' ' 19' ' ' LEU . 31.4 m -69.37 172.03 7.74 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.113 175.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -66.18 -47.15 74.91 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.568 0.699 . . . . 0.0 112.027 -172.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 51.4 m80 -72.02 1.79 6.74 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.719 179.327 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.472 HD13 ' HB2' ' A' ' 16' ' ' CYS . 5.3 mp -117.65 178.47 4.38 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-O 121.093 0.473 . . . . 0.0 111.256 179.045 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -151.09 151.93 23.83 Favored Glycine 0 N--CA 1.423 -2.179 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 177.881 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 38.0 t -93.26 116.56 29.12 Favored 'General case' 0 C--N 1.27 -2.872 0 CA-C-N 117.014 0.407 . . . . 0.0 110.251 -175.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -77.33 110.52 12.13 Favored 'General case' 0 CA--C 1.461 -2.45 0 N-CA-C 106.565 -1.643 . . . . 0.0 106.565 172.417 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.523 ' H ' ' HD2' ' A' ' 23' ' ' ARG . 1.1 mpt_? -76.8 -13.25 60.03 Favored 'General case' 0 C--N 1.286 -2.18 0 O-C-N 123.884 0.74 . . . . 0.0 109.22 -173.881 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -90.74 -24.71 20.3 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 122.181 0.991 . . . . 0.0 109.21 -177.623 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.578 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 96.8 mmm -110.0 -7.06 15.0 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.229 -175.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.499 ' HD2' ' N ' ' A' ' 26' ' ' LYS . 3.4 mptp? 61.92 26.28 15.87 Favored 'General case' 0 CA--C 1.505 -0.769 0 C-N-CA 125.271 1.428 . . . . 0.0 111.769 177.09 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.578 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 23.1 p90 -140.42 158.88 43.34 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.788 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.438 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 59.5 m -81.69 131.7 35.27 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.111 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.461 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -124.14 -174.17 2.94 Favored 'General case' 0 C--N 1.288 -2.102 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 176.229 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -76.61 -1.83 29.55 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 120.248 1.386 . . . . 0.0 113.203 -176.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 . . . . . 0 N--CA 1.417 -2.107 0 N-CA-C 106.439 -1.689 . . . . 0.0 106.439 179.053 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.6 p . . . . . 0 CA--C 1.494 -1.188 0 CA-C-O 121.63 0.728 . . . . 0.0 111.319 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -93.47 132.8 37.4 Favored 'General case' 0 C--N 1.278 -2.528 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.679 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.517 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 53.6 m-85 -85.05 -170.79 3.3 Favored 'General case' 0 N--CA 1.398 -3.05 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.579 176.757 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.3 ttt -62.97 134.09 55.63 Favored 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 -178.258 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 81.65 2.44 1.47 Allowed 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 125.067 1.347 . . . . 0.0 112.139 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -86.45 146.6 20.96 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 174.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.454 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 28.4 t70 -65.96 142.77 57.75 Favored 'General case' 0 CA--C 1.493 -1.222 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -175.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 26.8 p -150.99 154.72 37.61 Favored 'General case' 0 C--N 1.291 -1.954 0 C-N-CA 120.103 -0.639 . . . . 0.0 111.202 -177.54 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -115.12 -36.6 4.34 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.0 pttm -138.55 175.58 9.44 Favored 'General case' 0 N--CA 1.427 -1.613 0 CA-C-N 115.222 -0.899 . . . . 0.0 108.612 177.752 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -72.04 -16.75 62.05 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 120.512 0.196 . . . . 0.0 111.42 -174.478 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -61.65 -36.99 82.38 Favored 'General case' 0 CA--C 1.502 -0.888 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 179.076 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -63.2 -32.48 73.88 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.604 -177.472 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.0 m -88.59 159.18 18.01 Favored 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.316 -177.467 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.492 ' HB2' HD12 ' A' ' 19' ' ' LEU . 58.5 m -66.83 176.88 1.85 Allowed 'General case' 0 C--N 1.303 -1.416 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.55 175.692 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.5 ' HA ' ' HE2' ' A' ' 17' ' ' LYS . 10.3 mmpt? -64.47 -52.6 57.1 Favored 'General case' 0 CA--C 1.502 -0.895 0 CA-C-O 121.192 0.52 . . . . 0.0 111.889 -171.845 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -72.9 9.95 1.02 Allowed 'General case' 0 C--N 1.297 -1.679 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.504 -178.392 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.517 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 64.8 mt -125.01 177.12 6.23 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 -175.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -151.26 166.57 30.6 Favored Glycine 0 N--CA 1.434 -1.488 0 N-CA-C 108.64 -1.784 . . . . 0.0 108.64 176.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -99.46 129.5 45.64 Favored 'General case' 0 C--N 1.288 -2.069 0 CA-C-N 118.125 0.962 . . . . 0.0 112.064 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.6 mmmt -96.53 107.53 19.96 Favored 'General case' 0 CA--C 1.473 -1.997 0 CA-C-O 121.255 0.55 . . . . 0.0 111.0 173.364 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -69.1 -15.3 63.4 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 114.208 -1.36 . . . . 0.0 113.169 -175.407 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -89.33 -27.59 20.41 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.897 0.856 . . . . 0.0 109.177 -177.311 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.417 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 74.7 mmm -109.54 -10.97 14.84 Favored 'General case' 0 N--CA 1.426 -1.666 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.838 -172.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.454 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 71.1 mmtt 63.61 30.22 15.01 Favored 'General case' 0 CA--C 1.5 -0.958 0 C-N-CA 124.75 1.22 . . . . 0.0 111.194 -178.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.417 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 4.9 p90 -145.35 159.43 43.07 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.301 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 72.0 m -76.68 134.7 39.18 Favored 'General case' 0 C--N 1.287 -2.125 0 CA-C-N 114.519 -1.219 . . . . 0.0 111.473 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -122.09 -167.59 1.57 Allowed 'General case' 0 C--N 1.296 -1.717 0 N-CA-C 105.731 -1.951 . . . . 0.0 105.731 177.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -81.66 -6.14 58.73 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 119.691 1.132 . . . . 0.0 112.723 -176.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.9 t70 . . . . . 0 N--CA 1.405 -2.693 0 N-CA-C 103.821 -2.659 . . . . 0.0 103.821 178.747 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 . . . . . 0 CA--C 1.496 -1.108 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.7 p -80.38 164.62 22.96 Favored 'General case' 0 N--CA 1.433 -1.307 0 CA-C-O 121.946 0.879 . . . . 0.0 112.659 -177.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.6 mpp_? -103.17 134.67 46.2 Favored 'General case' 0 C--N 1.285 -2.196 0 CA-C-N 114.107 -1.406 . . . . 0.0 109.83 177.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.437 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 89.7 m-85 -91.38 -162.03 0.88 Allowed 'General case' 0 N--CA 1.404 -2.742 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.422 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.477 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 6.8 ttt -65.8 136.72 56.57 Favored 'General case' 0 C--N 1.32 -0.688 0 O-C-N 122.295 -0.253 . . . . 0.0 110.91 -171.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 79.52 2.68 2.22 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.061 1.344 . . . . 0.0 111.997 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -87.44 144.88 19.32 Favored Glycine 0 N--CA 1.438 -1.203 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 174.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.506 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 19.3 t70 -61.93 148.07 44.81 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.244 0.618 . . . . 0.0 112.598 -176.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.409 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 30.5 p -152.4 146.63 25.47 Favored 'General case' 0 N--CA 1.423 -1.81 0 C-N-CA 120.097 -0.641 . . . . 0.0 111.786 -179.005 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -101.95 -44.27 5.54 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 106.726 -1.583 . . . . 0.0 106.726 172.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.57 ' HG2' ' OD1' ' A' ' 14' ' ' ASP . 4.4 ptpp? -134.52 177.47 7.75 Favored 'General case' 0 N--CA 1.409 -2.523 0 CA-C-N 113.752 -1.567 . . . . 0.0 107.549 -176.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -74.53 -19.76 60.23 Favored 'General case' 0 C--N 1.29 -2.014 0 CA-C-O 121.154 0.502 . . . . 0.0 110.959 -175.314 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.458 ' H ' ' HG3' ' A' ' 11' ' ' LYS . 9.8 tp10 -69.24 -23.52 63.88 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.849 -177.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.57 ' OD1' ' HG2' ' A' ' 11' ' ' LYS . 40.0 m-20 -74.78 -29.89 61.27 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-O 121.758 0.789 . . . . 0.0 109.157 -178.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.1 m -87.33 163.32 16.88 Favored 'General case' 0 N--CA 1.426 -1.658 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.226 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 m -69.97 169.25 13.65 Favored 'General case' 0 N--CA 1.419 -2.003 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 173.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -87.81 -0.19 56.62 Favored 'General case' 0 C--N 1.287 -2.152 0 CA-C-O 122.728 1.252 . . . . 0.0 111.384 -170.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 89.3 m-70 -95.08 2.05 55.11 Favored 'General case' 0 C--N 1.273 -2.748 0 CA-C-N 113.08 -1.873 . . . . 0.0 108.656 172.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.4 ' HB3' ' O ' ' A' ' 29' ' ' ALA . 5.0 mp -136.41 -177.05 4.55 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.464 -175.333 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.64 160.55 28.52 Favored Glycine 0 N--CA 1.425 -2.067 0 N-CA-C 108.818 -1.713 . . . . 0.0 108.818 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.6 t -92.48 127.89 38.14 Favored 'General case' 0 C--N 1.285 -2.221 0 CA-C-N 117.84 0.82 . . . . 0.0 111.429 -176.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm -96.68 112.58 24.27 Favored 'General case' 0 CA--C 1.468 -2.183 0 O-C-N 121.36 -0.838 . . . . 0.0 108.894 169.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -72.73 -8.72 56.79 Favored 'General case' 0 C--N 1.294 -1.832 0 CA-C-N 114.289 -1.323 . . . . 0.0 111.51 -176.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -88.91 -27.82 20.72 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-O 122.201 1.0 . . . . 0.0 108.378 -177.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.572 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 0.9 OUTLIER -110.03 -8.44 14.82 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 114.513 -1.222 . . . . 0.0 111.03 -176.022 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.506 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 3.7 mptp? 59.85 26.36 15.55 Favored 'General case' 0 CA--C 1.486 -1.499 0 C-N-CA 124.61 1.164 . . . . 0.0 110.847 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.572 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 2.5 p90 -141.27 156.62 45.86 Favored 'General case' 0 C--N 1.286 -2.164 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.521 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.437 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 59.3 m -72.29 133.53 45.07 Favored 'General case' 0 N--CA 1.411 -2.418 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.508 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.477 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -120.11 173.81 6.87 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 176.073 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -71.98 -0.06 10.59 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 119.59 1.086 . . . . 0.0 113.331 -175.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -162.32 158.96 24.88 Favored 'General case' 0 N--CA 1.407 -2.592 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 -178.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -108.99 -30.13 8.23 Favored 'General case' 0 C--N 1.274 -2.677 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.658 176.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.5 m -68.74 137.81 54.36 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.684 -177.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -78.69 111.44 14.79 Favored 'General case' 0 C--N 1.308 -1.239 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 177.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 10.0 t . . . . . 0 C--N 1.297 -1.69 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.666 -176.43 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 CA--C 1.498 -1.038 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 24.8 p -109.66 158.78 17.72 Favored 'General case' 0 N--CA 1.407 -2.592 0 CA-C-O 121.704 0.764 . . . . 0.0 110.58 175.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.7 mpp_? -94.04 133.88 37.04 Favored 'General case' 0 C--N 1.268 -2.977 0 CA-C-N 114.263 -1.335 . . . . 0.0 109.632 176.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.489 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 43.6 m-85 -85.07 -165.83 1.32 Allowed 'General case' 0 N--CA 1.409 -2.483 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 176.61 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 12.4 ttt -63.96 134.21 54.66 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 77.88 1.19 2.84 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.509 1.524 . . . . 0.0 111.66 -178.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -76.31 154.49 44.4 Favored Glycine 0 N--CA 1.44 -1.062 0 N-CA-C 109.172 -1.571 . . . . 0.0 109.172 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -74.81 143.53 43.93 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 117.099 0.449 . . . . 0.0 111.929 -174.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.462 ' O ' ' HE2' ' A' ' 26' ' ' LYS . 28.9 p -151.45 154.86 37.42 Favored 'General case' 0 N--CA 1.412 -2.331 0 C-N-CA 119.988 -0.685 . . . . 0.0 111.232 -177.523 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -112.83 -36.57 5.11 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 107.324 -1.361 . . . . 0.0 107.324 171.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -141.98 178.15 7.72 Favored 'General case' 0 N--CA 1.425 -1.709 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.835 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -71.4 -17.81 62.38 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 120.606 0.241 . . . . 0.0 111.311 -174.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -64.36 -26.47 68.49 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-O 121.492 0.663 . . . . 0.0 110.319 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -72.88 -29.49 63.22 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.124 -178.356 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.2 m -91.4 162.64 14.5 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.516 -176.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.418 ' HB2' HD12 ' A' ' 19' ' ' LEU . 60.8 m -71.35 177.83 3.72 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.575 175.869 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -57.65 -56.44 21.94 Favored 'General case' 0 CA--C 1.502 -0.885 0 C-N-CA 124.114 0.966 . . . . 0.0 112.293 -174.215 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 -77.13 19.88 0.3 Allowed 'General case' 0 C--N 1.293 -1.862 0 CA-C-N 114.801 -1.09 . . . . 0.0 112.882 -176.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.432 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 60.7 mt -132.51 167.45 19.96 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.248 0.547 . . . . 0.0 110.764 -176.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.37 148.92 20.92 Favored Glycine 0 N--CA 1.434 -1.476 0 N-CA-C 108.994 -1.642 . . . . 0.0 108.994 177.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.9 t -84.61 128.27 34.51 Favored 'General case' 0 C--N 1.285 -2.215 0 CA-C-N 117.236 0.518 . . . . 0.0 111.208 -175.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 35.0 mmtm -88.29 112.9 23.34 Favored 'General case' 0 CA--C 1.465 -2.318 0 O-C-N 121.934 -0.479 . . . . 0.0 109.796 172.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.2 mpt_? -73.95 -9.78 58.98 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.601 -1.181 . . . . 0.0 111.505 -178.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -89.34 -29.14 19.35 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 -178.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.468 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 95.0 mmm -112.44 -20.36 11.81 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 114.68 -1.145 . . . . 0.0 112.3 -171.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.462 ' HE2' ' O ' ' A' ' 9' ' ' CYS . 14.4 mmmm 69.69 36.39 2.14 Favored 'General case' 0 CA--C 1.503 -0.843 0 C-N-CA 125.458 1.503 . . . . 0.0 111.304 -178.257 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.468 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 3.4 p90 -144.25 160.17 41.43 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-N 114.365 -1.289 . . . . 0.0 111.696 178.6 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.489 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 70.2 m -79.92 130.04 34.97 Favored 'General case' 0 C--N 1.289 -2.045 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.832 -178.726 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.84 -174.48 2.83 Favored 'General case' 0 C--N 1.289 -2.034 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 177.179 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.423 ' HA ' HD23 ' A' ' 19' ' ' LEU . 99.5 m95 -75.45 -6.16 48.69 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -176.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -170.0 164.22 9.47 Favored 'General case' 0 N--CA 1.407 -2.611 0 N-CA-C 105.194 -2.15 . . . . 0.0 105.194 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -84.64 -18.14 36.39 Favored 'General case' 0 C--N 1.269 -2.891 0 CA-C-O 121.241 0.543 . . . . 0.0 109.619 179.195 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.4 m -91.2 156.4 17.87 Favored 'General case' 0 N--CA 1.432 -1.362 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -126.21 100.1 6.16 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 176.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 63.1 m . . . . . 0 C--N 1.3 -1.572 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.718 -179.012 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 . . . . . 0 CA--C 1.505 -0.77 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.7 p -96.07 -172.61 2.6 Favored 'General case' 0 N--CA 1.418 -2.029 0 CA-C-O 121.78 0.8 . . . . 0.0 109.5 -177.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -115.07 135.73 53.88 Favored 'General case' 0 N--CA 1.402 -2.842 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.618 171.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.455 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 64.4 m-85 -96.16 -159.04 0.7 Allowed 'General case' 0 N--CA 1.387 -3.619 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 175.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 11.1 ttt -67.47 135.57 53.29 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.386 -0.926 . . . . 0.0 109.661 -175.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 76.26 5.98 3.63 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.529 1.132 . . . . 0.0 111.059 -178.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.41 ' O ' ' HA ' ' A' ' 27' ' ' TYR . . . -87.25 149.7 22.2 Favored Glycine 0 N--CA 1.434 -1.493 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 175.364 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.423 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 7.2 t70 -71.22 141.84 50.62 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 123.682 0.793 . . . . 0.0 112.924 -173.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.444 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 20.5 p -149.95 150.34 31.7 Favored 'General case' 0 C--N 1.284 -2.279 0 C-N-CA 119.626 -0.829 . . . . 0.0 111.432 -177.608 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -113.76 -35.13 5.26 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 172.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.585 ' HG2' ' OD2' ' A' ' 14' ' ' ASP . 3.9 ptpp? -138.06 175.14 9.84 Favored 'General case' 0 N--CA 1.413 -2.281 0 CA-C-N 114.417 -1.265 . . . . 0.0 107.82 -176.323 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -75.34 -16.57 60.39 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-O 121.16 0.505 . . . . 0.0 111.443 -175.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.5 ' HB2' ' HG3' ' A' ' 11' ' ' LYS . 46.1 mt-10 -68.87 -25.99 64.9 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.818 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.585 ' OD2' ' HG2' ' A' ' 11' ' ' LYS . 45.0 m-20 -72.92 -26.79 61.53 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.109 -177.233 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 13.0 m -96.68 156.92 16.14 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 120.978 0.418 . . . . 0.0 110.088 -178.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.16 179.71 3.72 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 173.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -49.99 -61.46 2.13 Favored 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 127.15 2.18 . . . . 0.0 113.867 -172.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -76.25 15.57 0.56 Allowed 'General case' 0 C--N 1.29 -1.986 0 CA-C-N 114.854 -1.066 . . . . 0.0 112.746 -174.125 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.2 mp -135.54 176.76 8.38 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-O 120.925 0.393 . . . . 0.0 110.942 -177.543 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -150.38 161.06 28.83 Favored Glycine 0 N--CA 1.425 -2.088 0 N-CA-C 108.902 -1.679 . . . . 0.0 108.902 176.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.2 t -87.16 130.59 34.48 Favored 'General case' 0 C--N 1.297 -1.699 0 CA-C-N 117.554 0.677 . . . . 0.0 112.333 -176.4 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.574 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 74.4 mmtt -100.63 105.1 16.46 Favored 'General case' 0 CA--C 1.465 -2.312 0 CA-C-O 121.358 0.599 . . . . 0.0 109.43 170.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -72.92 -3.7 27.44 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 114.385 -1.28 . . . . 0.0 111.115 -176.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -89.77 -31.68 17.3 Favored 'General case' 0 CA--C 1.5 -0.972 0 CA-C-O 121.998 0.904 . . . . 0.0 108.694 -177.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.533 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 96.2 mmm -112.29 -7.97 13.97 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 114.537 -1.211 . . . . 0.0 111.867 -176.212 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.423 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 70.7 mmtt 65.35 30.01 11.23 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.723 1.209 . . . . 0.0 111.717 -179.053 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.533 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 7.0 p90 -144.42 159.79 42.14 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.27 178.776 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 55.9 m -81.15 131.02 35.28 Favored 'General case' 0 C--N 1.287 -2.139 0 CA-C-N 114.614 -1.176 . . . . 0.0 110.658 -178.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -116.33 -176.59 2.99 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 105.831 -1.915 . . . . 0.0 105.831 175.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -75.54 2.43 11.72 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 119.053 0.842 . . . . 0.0 113.041 -175.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.574 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 2.9 p30 -159.95 157.54 29.08 Favored 'General case' 0 N--CA 1.401 -2.919 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.427 ' CD2' HG22 ' A' ' 33' ' ' THR . 21.1 p90 -96.62 -29.73 13.67 Favored 'General case' 0 C--N 1.276 -2.611 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.252 171.538 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.427 HG22 ' CD2' ' A' ' 32' ' ' PHE . 11.0 t -171.38 166.08 7.01 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 106.118 -1.808 . . . . 0.0 106.118 176.061 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -73.94 107.31 6.08 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 177.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.9 p . . . . . 0 C--N 1.297 -1.715 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.361 -179.46 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 . . . . . 0 CA--C 1.503 -0.862 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.1 p -99.86 159.89 14.72 Favored 'General case' 0 N--CA 1.418 -2.074 0 C-N-CA 120.246 -0.581 . . . . 0.0 109.798 177.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.436 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 3.4 tpp180 -86.76 131.22 34.19 Favored 'General case' 0 C--N 1.276 -2.602 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 -178.324 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -90.25 -166.55 1.61 Allowed 'General case' 0 N--CA 1.415 -2.182 0 CA-C-O 120.818 0.342 . . . . 0.0 111.843 -178.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 16.0 ttt -64.9 140.31 58.85 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.755 -174.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 72.22 8.91 5.91 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.514 1.126 . . . . 0.0 111.577 -179.544 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.61 137.92 14.16 Favored Glycine 0 N--CA 1.419 -2.486 0 N-CA-C 109.681 -1.368 . . . . 0.0 109.681 175.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.554 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 18.5 t70 -56.76 143.99 34.6 Favored 'General case' 0 CA--C 1.486 -1.489 0 C-N-CA 124.449 1.1 . . . . 0.0 111.553 -178.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 26.5 p -149.43 151.91 34.8 Favored 'General case' 0 N--CA 1.42 -1.941 0 C-N-CA 119.518 -0.873 . . . . 0.0 111.957 -175.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -115.97 -33.91 4.92 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.292 -0.867 . . . . 0.0 108.71 176.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -138.73 164.04 30.59 Favored 'General case' 0 N--CA 1.42 -1.959 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 176.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -71.55 -16.5 62.32 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-O 121.317 0.58 . . . . 0.0 110.162 -177.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -67.52 -28.22 67.63 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 114.432 -1.258 . . . . 0.0 109.552 -177.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -69.08 -32.8 72.49 Favored 'General case' 0 N--CA 1.436 -1.133 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.911 -177.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.436 ' SG ' ' HB3' ' A' ' 3' ' ' ARG . 69.3 m -100.4 165.74 11.3 Favored 'General case' 0 N--CA 1.429 -1.512 0 CA-C-O 121.378 0.609 . . . . 0.0 112.582 -177.408 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.431 ' HB2' HD13 ' A' ' 19' ' ' LEU . 11.3 m -64.69 172.34 2.8 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.834 -178.578 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -79.01 -27.43 43.26 Favored 'General case' 0 CA--C 1.488 -1.432 0 CA-C-O 121.939 0.876 . . . . 0.0 111.647 -172.009 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 33.9 m170 -77.92 4.14 12.78 Favored 'General case' 0 C--N 1.28 -2.439 0 CA-C-N 114.299 -1.319 . . . . 0.0 110.62 177.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.431 HD13 ' HB2' ' A' ' 16' ' ' CYS . 5.5 mp -133.14 177.1 7.93 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-O 121.285 0.564 . . . . 0.0 111.304 -177.369 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.406 ' HA3' ' HB3' ' A' ' 32' ' ' PHE . . . -150.6 152.12 24.03 Favored Glycine 0 N--CA 1.421 -2.365 0 N-CA-C 109.774 -1.33 . . . . 0.0 109.774 176.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 32.5 t -88.96 118.68 28.86 Favored 'General case' 0 C--N 1.292 -1.915 0 C-N-CA 123.153 0.581 . . . . 0.0 111.042 -175.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 75.3 mmtt -87.97 115.61 25.56 Favored 'General case' 0 CA--C 1.466 -2.269 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 177.199 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.1 mmt180 -73.47 -15.3 61.33 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.326 -175.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.448 ' HG3' ' HG2' ' A' ' 25' ' ' MET . 64.5 pttt -90.68 -25.93 19.83 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.965 -176.483 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.574 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 89.4 mmm -107.01 -17.19 14.24 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 114.975 -1.012 . . . . 0.0 110.755 -173.39 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.554 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 32.2 mmmt 68.36 33.1 4.3 Favored 'General case' 0 CA--C 1.489 -1.398 0 C-N-CA 124.42 1.088 . . . . 0.0 111.118 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.574 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 7.8 p90 -153.61 166.36 33.03 Favored 'General case' 0 C--N 1.287 -2.127 0 CA-C-N 114.185 -1.371 . . . . 0.0 110.464 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.6 m -95.85 140.37 30.72 Favored 'General case' 0 C--N 1.276 -2.59 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.31 -172.41 2.35 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 177.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -76.71 9.24 2.93 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 119.883 1.219 . . . . 0.0 113.151 -176.046 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.423 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 4.7 p-10 -166.14 167.65 16.09 Favored 'General case' 0 N--CA 1.405 -2.677 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.406 ' HB3' ' HA3' ' A' ' 20' ' ' GLY . 33.8 p90 -108.84 -33.6 6.91 Favored 'General case' 0 C--N 1.277 -2.548 0 O-C-N 123.793 0.683 . . . . 0.0 112.078 177.352 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.2 t -132.5 147.84 52.37 Favored 'General case' 0 N--CA 1.432 -1.347 0 C-N-CA 119.476 -0.89 . . . . 0.0 110.786 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 50.5 p90 -74.9 155.3 37.62 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.907 -178.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.1 m . . . . . 0 C--N 1.304 -1.378 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 176.381 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 26.6 t70 . . . . . 0 CA--C 1.492 -1.281 0 CA-C-O 121.295 0.569 . . . . 0.0 109.918 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.7 p -100.52 163.7 12.24 Favored 'General case' 0 C--N 1.284 -2.274 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.164 -177.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.509 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 39.6 mmt180 -80.12 131.48 35.75 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-N 114.565 -1.198 . . . . 0.0 109.524 178.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.43 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 55.8 m-85 -90.91 -158.88 0.58 Allowed 'General case' 0 N--CA 1.397 -3.109 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 173.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.1 ttt -71.66 137.28 47.75 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 120.31 -0.556 . . . . 0.0 109.901 -173.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 77.61 2.36 3.01 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.137 1.375 . . . . 0.0 111.266 -178.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.38 142.9 26.56 Favored Glycine 0 N--CA 1.43 -1.713 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 174.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.509 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 12.7 t70 -69.32 144.54 53.5 Favored 'General case' 0 CA--C 1.492 -1.259 0 C-N-CA 123.339 0.656 . . . . 0.0 111.116 -176.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.415 ' O ' ' HE2' ' A' ' 26' ' ' LYS . 32.0 p -152.47 155.97 38.53 Favored 'General case' 0 C--N 1.29 -1.991 0 C-N-CA 119.65 -0.82 . . . . 0.0 111.883 -176.32 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -113.73 -36.93 4.71 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 171.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.4 pttm -135.68 167.52 20.98 Favored 'General case' 0 N--CA 1.426 -1.666 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.153 -178.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -67.46 -19.13 65.31 Favored 'General case' 0 CA--C 1.488 -1.411 0 CA-C-O 120.994 0.426 . . . . 0.0 111.49 -178.349 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -70.94 -23.7 62.29 Favored 'General case' 0 CA--C 1.497 -1.095 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.34 -177.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -77.16 -27.98 53.94 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.1 -178.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 20.8 m -89.68 158.95 17.35 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 59.1 m -65.23 169.9 5.18 Favored 'General case' 0 N--CA 1.421 -1.923 0 CA-C-O 121.448 0.642 . . . . 0.0 110.632 174.08 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -66.71 -47.91 70.88 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.647 -169.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 47.5 m80 -64.82 -3.9 3.84 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 114.872 -1.058 . . . . 0.0 113.196 179.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.7 mp -120.96 -178.77 3.83 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.289 0.566 . . . . 0.0 111.583 -177.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -148.18 153.16 25.1 Favored Glycine 0 N--CA 1.419 -2.471 0 N-CA-C 110.27 -1.132 . . . . 0.0 110.27 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.3 t -86.31 127.78 34.83 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-O 120.6 0.238 . . . . 0.0 110.481 -177.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.503 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 73.1 mmtt -92.51 113.57 25.88 Favored 'General case' 0 CA--C 1.46 -2.497 0 CA-C-O 121.24 0.543 . . . . 0.0 110.439 176.218 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -71.45 -12.78 61.57 Favored 'General case' 0 C--N 1.29 -1.979 0 CA-C-N 113.474 -1.694 . . . . 0.0 112.091 -175.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.3 mmmp? -90.38 -30.66 17.27 Favored 'General case' 0 C--N 1.297 -1.702 0 C-N-CA 119.457 -0.897 . . . . 0.0 109.633 -177.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.448 ' HB3' ' CD2' ' A' ' 27' ' ' TYR . 16.5 mmt -113.15 -13.84 12.97 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -174.635 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.415 ' HE2' ' O ' ' A' ' 9' ' ' CYS . 14.5 mmmm 66.81 36.67 4.42 Favored 'General case' 0 CA--C 1.498 -1.055 0 C-N-CA 124.444 1.098 . . . . 0.0 110.767 -179.027 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.448 ' CD2' ' HB3' ' A' ' 25' ' ' MET . 10.0 p90 -142.99 159.84 41.49 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.657 177.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.43 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 42.2 m -84.72 129.47 34.83 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.938 -176.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.16 -173.8 2.64 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -79.62 8.46 6.48 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 119.775 1.17 . . . . 0.0 113.1 -176.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.503 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 3.3 p-10 -168.18 169.5 10.91 Favored 'General case' 0 N--CA 1.409 -2.479 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -179.748 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -111.92 -32.8 6.48 Favored 'General case' 0 C--N 1.279 -2.481 0 O-C-N 123.539 0.524 . . . . 0.0 110.989 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 7.2 p -48.0 116.94 1.68 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.724 1.209 . . . . 0.0 113.933 -175.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -112.63 125.51 54.36 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.646 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.9 t . . . . . 0 C--N 1.298 -1.663 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.622 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 . . . . . 0 CA--C 1.511 -0.555 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 13.1 p -87.22 168.93 12.78 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-O 121.854 0.835 . . . . 0.0 112.397 -177.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 3' ' ' ARG . 0.4 OUTLIER -94.48 132.04 39.56 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.08 176.767 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.459 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 70.3 m-85 -92.09 -162.96 0.98 Allowed 'General case' 0 N--CA 1.398 -3.029 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 175.719 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.7 ttt -61.88 137.56 58.26 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 120.51 0.195 . . . . 0.0 110.57 -175.057 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 76.84 -5.09 2.24 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.926 1.291 . . . . 0.0 111.888 -179.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.92 146.39 36.58 Favored Glycine 0 N--CA 1.435 -1.394 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 176.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.467 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 16.2 t70 -73.23 145.37 46.26 Favored 'General case' 0 CA--C 1.485 -1.548 0 CA-C-O 120.947 0.404 . . . . 0.0 111.081 -176.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.7 p -153.73 152.75 31.12 Favored 'General case' 0 N--CA 1.41 -2.472 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.459 -178.352 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -113.34 -32.88 6.12 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 173.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -131.71 165.44 23.72 Favored 'General case' 0 N--CA 1.417 -2.097 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 176.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -70.03 -16.18 63.12 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 121.552 0.691 . . . . 0.0 110.469 -175.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -72.92 -23.75 60.74 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.974 -177.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -76.72 -16.24 59.56 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.154 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 33.9 m -99.14 156.56 16.89 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.805 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 36.4 m -64.45 173.82 1.95 Allowed 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.797 176.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -60.8 -51.91 67.31 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.63 1.172 . . . . 0.0 113.024 -171.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 41.3 m80 -70.82 2.37 4.33 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 114.202 -1.363 . . . . 0.0 113.237 -178.125 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.6 mp -122.52 173.17 7.85 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.564 0.697 . . . . 0.0 112.561 -177.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -138.97 156.92 24.61 Favored Glycine 0 N--CA 1.43 -1.766 0 N-CA-C 108.304 -1.919 . . . . 0.0 108.304 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.3 t -100.74 121.57 41.88 Favored 'General case' 0 C--N 1.286 -2.159 0 CA-C-N 117.774 0.787 . . . . 0.0 110.783 -175.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -75.31 110.66 9.85 Favored 'General case' 0 CA--C 1.461 -2.445 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 171.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.43 ' H ' ' HD2' ' A' ' 23' ' ' ARG . 2.3 mpt_? -77.36 -11.55 59.85 Favored 'General case' 0 C--N 1.291 -1.967 0 O-C-N 124.531 1.145 . . . . 0.0 109.578 -176.114 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -89.59 -27.69 20.05 Favored 'General case' 0 N--CA 1.433 -1.3 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.455 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 93.4 mmm -112.84 -6.82 13.8 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -172.318 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.467 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 4.9 mptp? 59.65 33.13 21.88 Favored 'General case' 0 CA--C 1.495 -1.17 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.455 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 17.3 p90 -144.66 153.3 41.6 Favored 'General case' 0 CA--C 1.486 -1.49 0 C-N-CA 118.881 -1.128 . . . . 0.0 112.946 177.131 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 39.7 m -80.04 131.42 35.78 Favored 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 113.966 -1.47 . . . . 0.0 110.046 -179.264 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -124.13 175.5 6.97 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 178.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -70.63 -4.66 24.45 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -175.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -175.81 159.65 2.28 Favored 'General case' 0 N--CA 1.418 -2.03 0 N-CA-C 103.59 -2.745 . . . . 0.0 103.59 175.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.2 p90 -100.02 -8.78 23.43 Favored 'General case' 0 C--N 1.279 -2.486 0 C-N-CA 120.114 -0.634 . . . . 0.0 112.672 -178.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.9 p -84.21 -94.49 0.07 Allowed 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -175.567 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -137.94 106.67 5.91 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 61.2 m . . . . . 0 C--N 1.298 -1.65 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.323 179.433 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 28.9 t70 . . . . . 0 CA--C 1.508 -0.67 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.9 p -116.36 166.33 12.18 Favored 'General case' 0 C--N 1.299 -1.611 0 CA-C-O 121.281 0.562 . . . . 0.0 111.25 -177.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 33.9 mmt180 -82.09 125.93 31.42 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 115.004 -0.998 . . . . 0.0 108.425 176.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.501 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 76.9 m-85 -88.39 -164.91 1.2 Allowed 'General case' 0 N--CA 1.387 -3.625 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.532 178.28 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.491 ' HA ' ' O ' ' A' ' 28' ' ' CYS . 16.3 ttt -63.97 134.03 54.3 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 120.817 0.342 . . . . 0.0 110.354 -173.455 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 78.79 -1.77 2.35 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 125.631 1.572 . . . . 0.0 111.717 -179.301 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.3 145.06 32.71 Favored Glycine 0 N--CA 1.439 -1.105 0 N-CA-C 110.201 -1.16 . . . . 0.0 110.201 176.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.415 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 13.5 t70 -67.7 144.9 55.24 Favored 'General case' 0 CA--C 1.495 -1.151 0 C-N-CA 123.117 0.567 . . . . 0.0 111.742 -177.268 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.1 p -149.36 161.3 42.33 Favored 'General case' 0 N--CA 1.419 -1.982 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.201 -177.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -118.25 -32.34 4.71 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 172.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.8 pttt -147.42 177.28 9.37 Favored 'General case' 0 N--CA 1.426 -1.663 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 178.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -71.84 -16.32 62.16 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -175.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.24 -30.64 71.68 Favored 'General case' 0 CA--C 1.488 -1.428 0 CA-C-O 121.317 0.58 . . . . 0.0 110.498 177.144 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -68.83 -32.27 71.84 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.893 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 17.7 m -94.99 155.26 16.8 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.109 -177.242 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.404 ' HB2' HD12 ' A' ' 19' ' ' LEU . 25.1 m -60.77 173.47 0.74 Allowed 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 123.885 0.874 . . . . 0.0 111.351 175.641 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -68.54 -39.4 81.13 Favored 'General case' 0 CA--C 1.5 -0.956 0 CA-C-O 121.884 0.85 . . . . 0.0 111.919 -171.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 20.2 m170 -86.87 9.25 19.81 Favored 'General case' 0 C--N 1.278 -2.527 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.206 -176.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.501 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 68.8 mt -126.71 162.83 24.88 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 -178.012 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -139.39 150.96 21.64 Favored Glycine 0 C--N 1.299 -1.51 0 N-CA-C 110.754 -0.939 . . . . 0.0 110.754 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -87.08 106.21 17.7 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -176.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -64.3 114.9 4.56 Favored 'General case' 0 CA--C 1.468 -2.193 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 175.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -65.62 -24.1 66.97 Favored 'General case' 0 C--N 1.308 -1.227 0 O-C-N 125.237 1.585 . . . . 0.0 110.475 -175.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -90.05 -21.47 22.31 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 119.597 -0.841 . . . . 0.0 110.695 -168.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -112.3 -29.98 7.35 Favored 'General case' 0 N--CA 1.419 -2.018 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.334 -176.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.447 ' HD3' ' HA ' ' A' ' 26' ' ' LYS . 32.5 mmtp 72.06 49.59 0.24 Allowed 'General case' 0 CA--C 1.494 -1.188 0 C-N-CA 125.227 1.411 . . . . 0.0 110.925 -171.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -145.04 160.05 41.99 Favored 'General case' 0 CA--C 1.486 -1.483 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.233 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.491 ' O ' ' HA ' ' A' ' 5' ' ' MET . 56.3 m -85.57 122.81 30.22 Favored 'General case' 0 C--N 1.282 -2.344 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.252 -177.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.49 -165.18 1.17 Allowed 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 106.317 -1.735 . . . . 0.0 106.317 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -75.84 -5.84 47.87 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -176.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -170.65 177.43 3.93 Favored 'General case' 0 N--CA 1.41 -2.432 0 N-CA-C 105.92 -1.881 . . . . 0.0 105.92 173.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 36.6 p90 -102.26 -3.31 27.48 Favored 'General case' 0 C--N 1.273 -2.721 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 -172.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.9 m -77.67 149.11 34.7 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.099 0.476 . . . . 0.0 110.764 -174.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -134.07 147.43 50.9 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 47.2 m . . . . . 0 C--N 1.294 -1.845 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.892 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 . . . . . 0 CA--C 1.506 -0.725 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.5 p -109.45 172.21 6.99 Favored 'General case' 0 N--CA 1.424 -1.767 0 CA-C-O 121.649 0.738 . . . . 0.0 111.758 -177.095 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.72 135.42 41.16 Favored 'General case' 0 C--N 1.283 -2.284 0 CA-C-N 114.388 -1.278 . . . . 0.0 109.476 176.328 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.481 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 87.7 m-85 -91.46 -162.75 0.95 Allowed 'General case' 0 N--CA 1.399 -2.992 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 176.417 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.422 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 10.5 ttt -64.44 135.35 56.01 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 -175.773 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 75.77 9.67 3.45 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.828 1.251 . . . . 0.0 111.938 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.34 144.22 17.36 Favored Glycine 0 N--CA 1.434 -1.44 0 N-CA-C 109.161 -1.575 . . . . 0.0 109.161 173.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -62.47 145.6 53.75 Favored 'General case' 0 CA--C 1.493 -1.217 0 C-N-CA 123.079 0.551 . . . . 0.0 112.138 -176.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 21.6 p -153.47 155.13 35.71 Favored 'General case' 0 N--CA 1.422 -1.85 0 C-N-CA 120.011 -0.676 . . . . 0.0 110.757 -179.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -121.44 -34.33 3.47 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 172.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.6 pttt -131.36 174.09 10.42 Favored 'General case' 0 N--CA 1.42 -1.974 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 176.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -74.03 -16.06 61.06 Favored 'General case' 0 C--N 1.297 -1.717 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 -174.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -71.19 -24.7 62.27 Favored 'General case' 0 CA--C 1.483 -1.632 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.732 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -69.54 -25.54 64.06 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.609 -178.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 25.7 m -96.58 155.61 16.69 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.709 -178.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.7 m -66.13 178.01 1.26 Allowed 'General case' 0 C--N 1.291 -1.977 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.421 176.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 36.3 mmtp -57.61 -55.64 32.26 Favored 'General case' 0 CA--C 1.505 -0.763 0 C-N-CA 124.304 1.041 . . . . 0.0 113.066 -171.15 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 39.5 m80 -72.8 1.47 8.51 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 115.204 -0.907 . . . . 0.0 113.342 -176.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.3 mp -124.7 166.95 15.25 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-O 121.682 0.753 . . . . 0.0 111.961 -175.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -135.46 161.88 24.77 Favored Glycine 0 N--CA 1.419 -2.467 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 178.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.4 t -88.23 122.1 31.38 Favored 'General case' 0 C--N 1.285 -2.22 0 CA-C-N 116.92 0.36 . . . . 0.0 110.851 -176.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -83.9 114.37 21.62 Favored 'General case' 0 CA--C 1.465 -2.316 0 C-N-CA 119.426 -0.91 . . . . 0.0 110.06 175.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.471 ' NH1' ' HB2' ' A' ' 32' ' ' PHE . 6.5 mpt_? -67.11 -24.17 65.91 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 113.804 -1.544 . . . . 0.0 110.222 -178.392 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -87.39 -26.38 23.35 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 115.263 -0.88 . . . . 0.0 109.569 -174.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.548 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 76.3 mmm -110.4 -15.66 13.88 Favored 'General case' 0 C--N 1.291 -1.96 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.007 -170.057 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm 62.56 33.35 15.96 Favored 'General case' 0 CA--C 1.496 -1.124 0 C-N-CA 124.856 1.263 . . . . 0.0 110.348 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.548 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 3.3 p90 -151.18 161.23 43.1 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.419 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.481 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 57.6 m -79.28 135.36 36.73 Favored 'General case' 0 C--N 1.278 -2.536 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.719 -177.565 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.422 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -130.46 -178.89 4.96 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 176.204 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -71.91 0.38 9.36 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -175.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -166.48 -178.24 4.36 Favored 'General case' 0 N--CA 1.416 -2.152 0 N-CA-C 105.034 -2.21 . . . . 0.0 105.034 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.471 ' HB2' ' NH1' ' A' ' 23' ' ' ARG . 43.0 p90 -132.66 -21.81 2.19 Favored 'General case' 0 C--N 1.275 -2.637 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -171.103 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 44.3 p -66.84 157.96 31.71 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -173.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -91.19 97.64 11.26 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 63.6 m . . . . . 0 C--N 1.297 -1.706 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.293 -179.6 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 CA--C 1.507 -0.685 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.2 p -136.19 169.02 18.31 Favored 'General case' 0 N--CA 1.411 -2.421 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -95.29 132.7 40.0 Favored 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.205 177.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.413 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 78.7 m-85 -92.11 -165.43 1.35 Allowed 'General case' 0 N--CA 1.409 -2.505 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.867 -177.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.2 ttt -61.61 136.06 57.87 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -176.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 78.58 -4.99 2.1 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.571 1.149 . . . . 0.0 111.743 -178.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.13 147.72 36.65 Favored Glycine 0 N--CA 1.44 -1.089 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 174.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -63.66 143.71 57.61 Favored 'General case' 0 CA--C 1.484 -1.563 0 C-N-CA 123.25 0.62 . . . . 0.0 112.243 -174.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.7 p -152.9 147.68 26.27 Favored 'General case' 0 C--N 1.279 -2.496 0 C-N-CA 118.544 -1.262 . . . . 0.0 111.192 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -125.79 -23.29 4.02 Favored 'General case' 0 N--CA 1.424 -1.733 0 CA-C-N 114.642 -1.163 . . . . 0.0 108.646 172.132 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -139.64 165.08 28.21 Favored 'General case' 0 N--CA 1.424 -1.752 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 176.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -71.69 -15.69 62.22 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.232 0.539 . . . . 0.0 110.634 -176.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -65.3 -28.15 69.12 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 114.838 -1.073 . . . . 0.0 110.931 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -73.06 -30.12 63.47 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.206 -176.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 12.2 m -95.77 155.58 16.69 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.773 -176.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 18.3 m -61.67 171.15 1.65 Allowed 'General case' 0 C--N 1.304 -1.372 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.673 174.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -72.05 -42.89 65.75 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-O 121.281 0.562 . . . . 0.0 110.933 -173.231 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 36.0 m80 -64.03 0.35 0.93 Allowed 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 114.855 -1.066 . . . . 0.0 112.788 175.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.6 mp -128.73 -175.98 3.7 Favored 'General case' 0 N--CA 1.421 -1.916 0 CA-C-O 121.078 0.466 . . . . 0.0 110.616 -178.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -152.28 161.29 29.34 Favored Glycine 0 N--CA 1.418 -2.556 0 N-CA-C 108.918 -1.673 . . . . 0.0 108.918 175.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.3 t -87.6 131.62 34.35 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-N 117.446 0.623 . . . . 0.0 111.136 -178.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -103.1 107.52 18.36 Favored 'General case' 0 CA--C 1.469 -2.148 0 CA-C-O 121.477 0.656 . . . . 0.0 110.259 172.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -74.75 -5.32 42.71 Favored 'General case' 0 C--N 1.293 -1.853 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.627 -177.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -89.03 -29.98 19.06 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.414 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 95.8 mmm -112.65 -9.98 13.69 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 114.791 -1.095 . . . . 0.0 112.589 -177.289 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp 65.15 28.71 12.15 Favored 'General case' 0 CA--C 1.504 -0.799 0 C-N-CA 124.901 1.28 . . . . 0.0 111.306 -178.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.414 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 1.3 p90 -145.56 162.44 37.45 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-N 114.849 -1.069 . . . . 0.0 111.747 179.357 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 52.3 m -77.24 135.21 38.45 Favored 'General case' 0 C--N 1.287 -2.14 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.589 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -124.67 -178.81 4.26 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 176.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -71.04 -3.92 22.24 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.471 1.285 . . . . 0.0 114.471 -175.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -163.13 162.05 25.44 Favored 'General case' 0 N--CA 1.41 -2.446 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 7.3 p90 -103.06 -0.53 30.59 Favored 'General case' 0 C--N 1.272 -2.793 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.372 -178.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 33.5 m -82.9 88.19 6.82 Favored 'General case' 0 N--CA 1.428 -1.562 0 CA-C-O 122.097 0.951 . . . . 0.0 110.728 -174.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -81.83 113.25 19.66 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 114.942 -1.026 . . . . 0.0 108.956 178.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 31.5 p . . . . . 0 C--N 1.291 -1.975 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.847 -179.631 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 . . . . . 0 CA--C 1.485 -1.547 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.4 p -127.37 169.4 13.63 Favored 'General case' 0 N--CA 1.413 -2.278 0 CA-C-O 121.385 0.612 . . . . 0.0 110.529 179.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.466 ' HB3' ' HA3' ' A' ' 7' ' ' GLY . 8.6 mpt_? -99.06 137.07 38.12 Favored 'General case' 0 C--N 1.285 -2.223 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.828 176.844 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.53 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 74.0 m-85 -86.98 -166.99 1.73 Allowed 'General case' 0 N--CA 1.399 -2.991 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.572 174.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 13.0 ttt -60.56 133.62 56.27 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 -175.094 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 74.99 5.59 4.31 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.618 1.167 . . . . 0.0 112.023 -178.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.466 ' HA3' ' HB3' ' A' ' 3' ' ' ARG . . . -80.03 160.84 44.98 Favored Glycine 0 N--CA 1.442 -0.932 0 N-CA-C 109.22 -1.552 . . . . 0.0 109.22 173.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.43 141.52 45.03 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -174.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.2 p -151.19 155.13 38.21 Favored 'General case' 0 N--CA 1.423 -1.775 0 C-N-CA 119.828 -0.749 . . . . 0.0 111.915 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -119.42 -39.23 2.91 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 124.725 1.21 . . . . 0.0 108.169 172.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.8 pttm -132.36 175.42 9.3 Favored 'General case' 0 N--CA 1.423 -1.785 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -74.84 -17.43 60.6 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 121.1 0.476 . . . . 0.0 110.294 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -69.68 -23.43 63.44 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.333 -177.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -76.81 -25.14 52.94 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 -177.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 39.5 m -91.73 159.66 15.73 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.758 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.511 ' HB2' HD12 ' A' ' 19' ' ' LEU . 69.9 m -67.09 178.66 1.36 Allowed 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.255 176.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -55.23 -61.29 2.43 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-O 121.855 0.836 . . . . 0.0 112.587 -172.552 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 63.8 m80 -78.93 22.06 0.4 Allowed 'General case' 0 C--N 1.281 -2.372 0 CA-C-N 113.93 -1.486 . . . . 0.0 112.362 -174.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.53 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 61.6 mt -131.49 157.77 42.64 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 120.893 0.378 . . . . 0.0 110.141 -178.164 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -135.12 152.28 20.75 Favored Glycine 0 N--CA 1.43 -1.761 0 N-CA-C 108.95 -1.66 . . . . 0.0 108.95 177.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.6 t -87.72 123.85 32.96 Favored 'General case' 0 C--N 1.287 -2.129 0 CA-C-N 117.293 0.546 . . . . 0.0 111.174 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 33.5 mmtm -87.16 108.9 19.12 Favored 'General case' 0 CA--C 1.468 -2.188 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.114 172.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? -69.45 -5.0 20.95 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 114.336 -1.302 . . . . 0.0 112.06 -177.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -87.82 -39.49 14.81 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 -176.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 93.1 mmm -113.17 -3.35 13.93 Favored 'General case' 0 N--CA 1.427 -1.582 0 CA-C-N 114.519 -1.219 . . . . 0.0 112.136 -175.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.462 ' HD3' ' HA ' ' A' ' 26' ' ' LYS . 32.6 mmtp 55.11 45.67 25.62 Favored 'General case' 0 C--O 1.248 1.007 0 C-N-CA 124.555 1.142 . . . . 0.0 113.454 -178.024 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -142.14 162.81 34.54 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.945 176.385 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 61.4 m -81.76 127.36 32.87 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 115.316 -0.857 . . . . 0.0 111.288 -177.671 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -118.91 -176.12 3.04 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 106.516 -1.661 . . . . 0.0 106.516 177.291 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -73.34 -9.95 59.24 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -176.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -171.61 151.43 2.94 Favored 'General case' 0 N--CA 1.425 -1.715 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 176.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -76.03 -58.18 3.43 Favored 'General case' 0 C--N 1.279 -2.472 0 C-N-CA 119.971 -0.691 . . . . 0.0 109.353 175.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.5 m -162.92 80.88 0.49 Allowed 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 177.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -95.39 113.43 25.09 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.134 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.9 m . . . . . 0 C--N 1.298 -1.671 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.185 179.785 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 . . . . . 0 CA--C 1.476 -1.871 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.9 p -71.18 150.79 45.01 Favored 'General case' 0 N--CA 1.418 -2.06 0 C-N-CA 119.191 -1.004 . . . . 0.0 111.08 178.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.418 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 28.5 mmt180 -95.07 143.4 26.56 Favored 'General case' 0 C--N 1.27 -2.86 0 CA-C-N 113.939 -1.482 . . . . 0.0 108.369 -177.379 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.433 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 65.6 m-85 -92.65 -165.71 1.4 Allowed 'General case' 0 N--CA 1.394 -3.23 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.574 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.9 ttt -64.32 138.14 58.28 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -175.515 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 74.1 6.53 4.76 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.576 1.15 . . . . 0.0 111.815 -179.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -85.96 146.95 21.54 Favored Glycine 0 N--CA 1.436 -1.333 0 N-CA-C 109.819 -1.313 . . . . 0.0 109.819 174.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.418 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 16.2 t70 -67.11 139.92 57.55 Favored 'General case' 0 CA--C 1.495 -1.172 0 C-N-CA 123.694 0.798 . . . . 0.0 112.498 -176.672 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.568 ' O ' ' HE2' ' A' ' 26' ' ' LYS . 31.3 p -157.63 157.53 33.8 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.409 -177.185 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -113.29 -37.42 4.71 Favored 'General case' 0 CA--C 1.507 -0.678 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 169.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.436 ' HE2' ' HB2' ' A' ' 13' ' ' GLU . 23.9 pttm -126.42 170.2 12.21 Favored 'General case' 0 N--CA 1.418 -2.034 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.01 -176.149 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -73.01 -19.26 61.24 Favored 'General case' 0 CA--C 1.486 -1.514 0 CA-C-O 121.122 0.487 . . . . 0.0 110.053 -176.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.436 ' HB2' ' HE2' ' A' ' 11' ' ' LYS . 47.2 mt-10 -72.44 -24.84 61.27 Favored 'General case' 0 CA--C 1.482 -1.66 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.996 -177.603 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -71.0 -29.2 65.09 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 -178.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 33.5 m -88.76 162.29 16.31 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.266 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 82.0 m -71.7 178.03 3.82 Favored 'General case' 0 N--CA 1.427 -1.62 0 CA-C-O 121.048 0.451 . . . . 0.0 111.48 176.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -54.84 -59.44 4.72 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.453 1.101 . . . . 0.0 113.926 -169.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 27.1 m170 -81.86 21.85 0.81 Allowed 'General case' 0 C--N 1.285 -2.229 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.076 -173.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.406 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 51.6 mt -125.02 167.92 14.06 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -178.73 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -140.87 146.2 17.35 Favored Glycine 0 N--CA 1.423 -2.207 0 N-CA-C 108.671 -1.772 . . . . 0.0 108.671 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 47.5 t -88.25 127.32 35.46 Favored 'General case' 0 C--N 1.283 -2.325 0 CA-C-O 121.333 0.587 . . . . 0.0 110.423 -176.142 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.437 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 56.4 mmtt -93.59 107.95 19.74 Favored 'General case' 0 N--CA 1.413 -2.302 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.0 175.641 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -72.48 -5.2 35.11 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.023 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -86.23 -37.52 18.54 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.509 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 95.6 mmm -112.86 -9.57 13.64 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.368 -174.314 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.568 ' HE2' ' O ' ' A' ' 9' ' ' CYS . 13.9 mmmm 66.4 35.04 5.91 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 124.738 1.215 . . . . 0.0 112.275 -179.488 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.509 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 14.2 p90 -147.18 160.46 42.43 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.879 178.771 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.433 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 57.1 m -79.78 130.71 35.55 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.308 -178.037 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.32 -175.53 3.02 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -79.4 1.97 23.41 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.321 0.964 . . . . 0.0 112.789 -178.2 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -176.27 151.13 0.98 Allowed 'General case' 0 N--CA 1.425 -1.69 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 -177.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.464 ' O ' ' HB ' ' A' ' 33' ' ' THR . 29.3 p90 -101.77 -1.92 31.29 Favored 'General case' 0 C--N 1.283 -2.299 0 O-C-N 123.69 0.619 . . . . 0.0 112.522 -177.06 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.464 ' HB ' ' O ' ' A' ' 32' ' ' PHE . 94.8 m 77.82 98.44 0.06 Allowed 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.817 0.847 . . . . 0.0 109.471 -172.111 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -81.68 100.22 9.34 Favored 'General case' 0 C--N 1.294 -1.819 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.414 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 46.7 m . . . . . 0 C--N 1.301 -1.522 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.503 179.35 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 . . . . . 0 CA--C 1.486 -1.517 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.4 p -81.09 163.9 22.83 Favored 'General case' 0 N--CA 1.419 -2.001 0 CA-C-O 121.633 0.73 . . . . 0.0 110.883 178.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.573 ' HB2' ' SG ' ' A' ' 28' ' ' CYS . 20.6 mmt180 -90.85 132.16 36.06 Favored 'General case' 0 C--N 1.28 -2.456 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 178.532 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.456 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 48.0 m-85 -84.93 -165.66 1.26 Allowed 'General case' 0 N--CA 1.397 -3.1 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 172.144 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.7 ttt -66.39 137.53 56.94 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -175.388 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 77.47 1.09 2.98 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.74 1.216 . . . . 0.0 111.436 -178.578 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.18 136.27 16.5 Favored Glycine 0 N--CA 1.429 -1.768 0 N-CA-C 108.877 -1.689 . . . . 0.0 108.877 174.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -60.0 140.49 56.74 Favored 'General case' 0 CA--C 1.492 -1.26 0 C-N-CA 123.266 0.627 . . . . 0.0 112.588 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.485 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 19.2 p -141.51 154.95 45.81 Favored 'General case' 0 N--CA 1.416 -2.174 0 C-N-CA 119.585 -0.846 . . . . 0.0 111.249 -176.152 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -118.14 -39.64 3.04 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 175.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.9 pttm -135.23 172.9 12.35 Favored 'General case' 0 N--CA 1.422 -1.872 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.099 -178.232 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -75.6 -16.13 60.26 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-O 121.022 0.439 . . . . 0.0 111.025 -176.373 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -70.37 -24.07 62.89 Favored 'General case' 0 CA--C 1.489 -1.4 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.486 -178.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -72.23 -31.55 65.93 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -178.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 17.3 m -89.28 155.08 19.61 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.504 -176.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.432 ' HB2' HD12 ' A' ' 19' ' ' LEU . 43.9 m -67.01 178.03 1.53 Allowed 'General case' 0 C--N 1.302 -1.466 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.562 177.457 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -63.07 -55.12 28.17 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -171.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -74.09 11.48 0.91 Allowed 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.945 -178.286 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.556 HD23 ' HA ' ' A' ' 30' ' ' TRP . 62.2 mt -128.21 -179.42 5.0 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 -177.336 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -161.5 165.36 35.52 Favored Glycine 0 N--CA 1.418 -2.554 0 N-CA-C 108.936 -1.666 . . . . 0.0 108.936 177.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.3 t -92.51 124.83 36.84 Favored 'General case' 0 C--N 1.289 -2.052 0 CA-C-O 121.343 0.592 . . . . 0.0 110.31 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.452 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 30.1 mmtp -99.86 112.29 24.56 Favored 'General case' 0 C--N 1.287 -2.124 0 CA-C-O 121.103 0.477 . . . . 0.0 110.374 173.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.9 mpt_? -73.11 -10.84 60.21 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 114.357 -1.292 . . . . 0.0 111.109 -177.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -85.26 -30.21 23.99 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -177.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 80.8 mmm -111.22 -10.69 14.27 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 114.407 -1.27 . . . . 0.0 110.856 -173.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.56 ' HD2' ' N ' ' A' ' 26' ' ' LYS . 9.6 mptt 62.1 26.1 15.68 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 125.816 1.646 . . . . 0.0 110.864 179.554 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -142.59 165.97 25.95 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.605 179.274 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.573 ' SG ' ' HB2' ' A' ' 3' ' ' ARG . 63.1 m -81.38 131.28 35.28 Favored 'General case' 0 N--CA 1.414 -2.253 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.37 -179.163 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.404 ' C ' ' H ' ' A' ' 31' ' ' ASP . . . -118.55 -175.82 2.96 Favored 'General case' 0 C--N 1.283 -2.308 0 N-CA-C 105.583 -2.006 . . . . 0.0 105.583 176.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.556 ' HA ' HD23 ' A' ' 19' ' ' LEU . 98.5 m95 -80.87 19.52 0.85 Allowed 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 119.303 0.956 . . . . 0.0 110.349 178.705 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.404 ' H ' ' C ' ' A' ' 29' ' ' ALA . 36.1 t70 -159.5 134.73 8.24 Favored 'General case' 0 N--CA 1.401 -2.878 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.387 -170.365 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 47.0 p90 -81.35 -174.19 4.78 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.735 177.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.9 m -94.73 106.8 18.8 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-O 121.537 0.684 . . . . 0.0 112.269 -178.047 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -116.21 98.77 6.79 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.363 -0.976 . . . . 0.0 108.363 176.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 50.2 m . . . . . 0 C--O 1.25 1.109 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 179.257 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 . . . . . 0 CA--C 1.496 -1.128 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.3 p -86.28 158.55 19.66 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 121.818 0.818 . . . . 0.0 111.796 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 39.5 mmt180 -86.92 133.95 33.56 Favored 'General case' 0 C--N 1.282 -2.332 0 CA-C-N 114.3 -1.318 . . . . 0.0 110.079 178.445 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.416 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 25.0 m-85 -84.71 -166.6 1.52 Allowed 'General case' 0 N--CA 1.399 -3.008 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.156 174.214 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.473 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 11.3 ttt -65.74 138.8 58.19 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 -176.221 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 77.03 2.6 3.27 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.205 1.402 . . . . 0.0 111.832 -179.02 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -82.62 146.69 24.75 Favored Glycine 0 N--CA 1.435 -1.427 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 175.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.417 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 14.5 t70 -64.3 145.14 56.5 Favored 'General case' 0 CA--C 1.492 -1.251 0 C-N-CA 123.106 0.562 . . . . 0.0 112.207 -178.328 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.423 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 31.0 p -152.59 149.24 28.26 Favored 'General case' 0 N--CA 1.417 -2.094 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.145 -178.112 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -113.21 -23.73 9.79 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 173.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.8 pttm -145.67 172.25 13.55 Favored 'General case' 0 N--CA 1.423 -1.816 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 179.45 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -74.2 -16.71 60.96 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 121.337 0.589 . . . . 0.0 110.143 -177.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -73.15 -22.36 60.53 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.393 -178.093 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -77.02 -24.98 52.08 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 -179.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.8 m -89.94 161.62 15.82 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 115.157 -0.928 . . . . 0.0 109.034 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.417 ' HB2' HD12 ' A' ' 19' ' ' LEU . 56.4 m -70.38 178.42 2.91 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.517 174.621 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -61.55 -51.01 70.36 Favored 'General case' 0 CA--C 1.498 -1.019 0 CA-C-O 121.542 0.687 . . . . 0.0 112.799 -171.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 38.4 m-70 -76.55 14.06 0.86 Allowed 'General case' 0 C--N 1.283 -2.298 0 CA-C-N 114.658 -1.155 . . . . 0.0 112.417 -176.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.417 HD12 ' HB2' ' A' ' 16' ' ' CYS . 46.7 mt -128.93 153.2 47.74 Favored 'General case' 0 N--CA 1.433 -1.318 0 CA-C-O 121.151 0.5 . . . . 0.0 110.207 -175.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -131.16 145.77 17.25 Favored Glycine 0 N--CA 1.426 -1.992 0 N-CA-C 108.814 -1.714 . . . . 0.0 108.814 177.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 39.0 t -84.81 111.88 20.02 Favored 'General case' 0 C--N 1.284 -2.248 0 CA-C-N 116.96 0.38 . . . . 0.0 111.231 -175.486 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.437 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 71.3 mmtt -72.53 113.34 9.45 Favored 'General case' 0 CA--C 1.482 -1.66 0 O-C-N 121.301 -0.874 . . . . 0.0 108.667 177.119 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.6 mmt180 -69.38 -12.74 61.91 Favored 'General case' 0 C--N 1.315 -0.897 0 O-C-N 124.49 1.119 . . . . 0.0 109.896 -178.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -89.59 -29.93 18.52 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-O 122.093 0.949 . . . . 0.0 109.378 -175.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.577 ' HB3' ' CD1' ' A' ' 27' ' ' TYR . 23.3 mmt -111.81 -16.28 13.2 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.268 -173.08 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 66.44 33.7 6.69 Favored 'General case' 0 CA--C 1.499 -1.015 0 C-N-CA 124.372 1.069 . . . . 0.0 110.119 -178.574 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.577 ' CD1' ' HB3' ' A' ' 25' ' ' MET . 4.0 p90 -143.45 158.29 43.76 Favored 'General case' 0 CA--C 1.489 -1.369 0 CA-C-N 114.511 -1.222 . . . . 0.0 112.55 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.468 ' O ' ' HA ' ' A' ' 5' ' ' MET . 77.0 m -78.86 123.84 27.63 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.963 -178.71 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.473 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -119.61 -172.39 2.32 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 177.601 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -78.55 1.15 23.44 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 119.155 0.889 . . . . 0.0 112.915 -176.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.437 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 19.5 t70 -179.73 148.78 0.34 Allowed 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 125.158 1.383 . . . . 0.0 107.914 177.706 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.1 p90 -83.04 -28.16 29.8 Favored 'General case' 0 C--N 1.287 -2.132 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 -175.65 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.6 m -56.97 136.62 56.17 Favored 'General case' 0 C--O 1.246 0.911 0 C-N-CA 123.759 0.824 . . . . 0.0 112.355 -173.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -98.53 177.09 5.44 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.692 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 C--N 1.302 -1.468 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 -179.467 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 . . . . . 0 CA--C 1.482 -1.647 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 6.2 p -92.63 168.78 11.0 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 174.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.45 ' HD2' ' HA3' ' A' ' 7' ' ' GLY . 16.4 tpp180 -92.26 124.98 36.73 Favored 'General case' 0 C--N 1.272 -2.761 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -88.39 -167.36 1.86 Allowed 'General case' 0 N--CA 1.412 -2.363 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.707 -177.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 13.3 ttt -64.23 139.16 58.74 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.704 -173.266 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 74.28 8.6 4.56 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.934 1.294 . . . . 0.0 111.674 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.45 ' HA3' ' HD2' ' A' ' 3' ' ' ARG . . . -95.06 145.07 17.56 Favored Glycine 0 N--CA 1.419 -2.498 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 175.296 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.485 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 20.9 t70 -64.78 143.66 57.78 Favored 'General case' 0 CA--C 1.493 -1.248 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -176.172 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 23.9 p -150.51 149.69 30.29 Favored 'General case' 0 N--CA 1.417 -2.11 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.872 -177.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -112.14 -35.52 5.62 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 175.584 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.9 pttp -134.34 162.33 32.5 Favored 'General case' 0 N--CA 1.42 -1.95 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.16 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -64.14 -18.68 64.68 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-O 121.04 0.447 . . . . 0.0 111.946 -178.144 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -71.48 -21.96 61.87 Favored 'General case' 0 CA--C 1.493 -1.245 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.953 -177.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -75.24 -30.8 60.64 Favored 'General case' 0 N--CA 1.42 -1.928 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.971 -178.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 20.7 m -90.22 155.46 18.99 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.042 -178.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.498 ' HB2' HD13 ' A' ' 19' ' ' LEU . 32.5 m -61.41 176.97 0.42 Allowed 'General case' 0 C--N 1.298 -1.651 0 C-N-CA 124.515 1.126 . . . . 0.0 112.942 176.213 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.1 mttp -66.36 -48.48 70.06 Favored 'General case' 0 CA--C 1.496 -1.098 0 CA-C-O 122.377 1.084 . . . . 0.0 109.902 -175.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -68.14 -1.39 5.91 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 113.597 -1.638 . . . . 0.0 112.708 -178.346 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.498 HD13 ' HB2' ' A' ' 16' ' ' CYS . 5.8 mp -130.51 176.5 8.11 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-O 121.251 0.548 . . . . 0.0 111.473 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.73 160.77 28.01 Favored Glycine 0 N--CA 1.419 -2.468 0 N-CA-C 108.506 -1.837 . . . . 0.0 108.506 177.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.4 t -93.7 120.58 34.15 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 117.351 0.576 . . . . 0.0 110.412 -177.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.415 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 73.8 mmtt -85.15 108.72 17.83 Favored 'General case' 0 CA--C 1.455 -2.687 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 173.795 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.538 ' H ' ' HD2' ' A' ' 23' ' ' ARG . 1.3 mpt_? -79.68 -8.08 58.99 Favored 'General case' 0 C--N 1.282 -2.328 0 CA-C-N 114.991 -1.004 . . . . 0.0 108.64 -174.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -90.01 -27.77 19.53 Favored 'General case' 0 CA--C 1.501 -0.918 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.128 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.589 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 90.5 mmm -109.64 -19.06 13.32 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.655 -172.76 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.485 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 71.8 mmtt 72.84 29.64 1.85 Allowed 'General case' 0 CA--C 1.497 -1.088 0 C-N-CA 125.555 1.542 . . . . 0.0 111.568 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.589 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 27.4 p90 -147.89 158.68 44.16 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.875 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.2 m -77.44 130.8 37.51 Favored 'General case' 0 C--N 1.291 -1.97 0 CA-C-N 114.676 -1.147 . . . . 0.0 110.51 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -122.73 -178.18 3.86 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 177.249 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -76.05 8.2 3.42 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.307 0.958 . . . . 0.0 113.072 -176.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.415 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 3.8 p30 -169.51 174.67 5.8 Favored 'General case' 0 N--CA 1.409 -2.501 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 -179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 10.3 p90 -118.45 -47.71 2.53 Favored 'General case' 0 C--N 1.277 -2.552 0 O-C-N 124.018 0.824 . . . . 0.0 111.453 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.3 p -118.77 4.48 11.55 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -177.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -78.59 -52.8 7.94 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.081 -177.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 34.3 p . . . . . 0 C--O 1.259 1.602 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.514 178.62 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 . . . . . 0 CA--C 1.501 -0.933 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.5 p -126.15 159.6 32.46 Favored 'General case' 0 N--CA 1.423 -1.782 0 CA-C-O 121.003 0.43 . . . . 0.0 110.361 177.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.453 ' HB3' ' HA3' ' A' ' 7' ' ' GLY . 9.0 mpt_? -83.83 131.47 34.88 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.882 178.36 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.486 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 79.1 m-85 -89.79 -163.06 0.95 Allowed 'General case' 0 N--CA 1.391 -3.377 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.2 ttt -66.56 134.0 51.48 Favored 'General case' 0 C--N 1.299 -1.587 0 C-N-CA 120.279 -0.568 . . . . 0.0 109.934 -173.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 76.57 6.48 3.43 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 124.955 1.302 . . . . 0.0 111.966 -178.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.453 ' HA3' ' HB3' ' A' ' 3' ' ' ARG . . . -79.02 156.37 41.84 Favored Glycine 0 N--CA 1.443 -0.839 0 N-CA-C 108.047 -2.021 . . . . 0.0 108.047 172.038 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -88.36 140.2 29.71 Favored 'General case' 0 CA--C 1.476 -1.875 0 CA-C-N 118.256 1.028 . . . . 0.0 110.733 -172.196 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.9 p -144.04 147.22 33.54 Favored 'General case' 0 C--N 1.272 -2.797 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.984 -175.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -110.34 -30.0 7.88 Favored 'General case' 0 C--N 1.293 -1.89 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 177.131 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.509 ' HD2' ' OE1' ' A' ' 13' ' ' GLU . 17.2 pttp -139.43 167.18 22.66 Favored 'General case' 0 N--CA 1.426 -1.649 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.268 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -70.73 -18.17 62.8 Favored 'General case' 0 CA--C 1.493 -1.212 0 CA-C-O 121.121 0.486 . . . . 0.0 110.911 -174.256 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.509 ' OE1' ' HD2' ' A' ' 11' ' ' LYS . 36.4 mt-10 -70.88 -19.13 62.65 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.119 -176.345 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -79.84 -24.73 41.11 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-N 115.065 -0.97 . . . . 0.0 109.314 -176.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 35.0 m -92.83 159.71 15.26 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.425 ' HB2' HD13 ' A' ' 19' ' ' LEU . 38.3 m -64.33 174.06 1.8 Allowed 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.536 177.245 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.6 mtpt -75.99 -33.4 59.72 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 121.655 0.741 . . . . 0.0 110.978 -171.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 36.3 m80 -81.8 6.57 15.15 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.208 178.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.425 HD13 ' HB2' ' A' ' 16' ' ' CYS . 5.2 mp -131.84 -180.0 5.73 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-O 121.066 0.46 . . . . 0.0 110.797 -178.69 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -148.03 163.04 28.86 Favored Glycine 0 N--CA 1.424 -2.115 0 N-CA-C 109.661 -1.376 . . . . 0.0 109.661 177.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.1 t -95.96 120.34 36.07 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 117.304 0.552 . . . . 0.0 109.714 -178.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.457 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 73.1 mmtt -81.62 107.28 14.24 Favored 'General case' 0 CA--C 1.453 -2.774 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 172.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.464 ' H ' ' HD2' ' A' ' 23' ' ' ARG . 2.1 mpt_? -75.56 -3.16 32.65 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.411 -173.469 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -90.44 -31.68 16.72 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-O 122.198 0.999 . . . . 0.0 109.081 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 87.9 mmm -111.86 -9.9 14.03 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.964 -175.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp 63.71 36.69 10.53 Favored 'General case' 0 CA--C 1.503 -0.843 0 C-N-CA 124.455 1.102 . . . . 0.0 111.852 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -143.07 159.04 43.01 Favored 'General case' 0 CA--C 1.486 -1.505 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.438 177.036 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.486 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 39.2 m -82.03 130.28 35.03 Favored 'General case' 0 C--N 1.284 -2.264 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.988 -176.662 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -121.31 -175.47 3.08 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 106.025 -1.843 . . . . 0.0 106.025 176.241 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -79.8 10.97 3.54 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 119.588 1.085 . . . . 0.0 113.115 -175.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -172.03 165.79 6.23 Favored 'General case' 0 N--CA 1.415 -2.18 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 178.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.8 p90 -111.25 -53.18 2.73 Favored 'General case' 0 C--N 1.277 -2.581 0 O-C-N 123.97 0.794 . . . . 0.0 110.033 175.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 88.6 m -149.15 106.71 3.65 Favored 'General case' 0 N--CA 1.428 -1.573 0 N-CA-C 106.765 -1.569 . . . . 0.0 106.765 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -75.22 102.6 5.06 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-O 121.156 0.503 . . . . 0.0 110.566 -177.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 38.9 m . . . . . 0 C--N 1.3 -1.563 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.011 175.264 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 . . . . . 0 CA--C 1.489 -1.375 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.6 p -96.54 160.44 14.4 Favored 'General case' 0 N--CA 1.413 -2.295 0 CA-C-O 122.031 0.92 . . . . 0.0 112.237 -177.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -91.15 136.82 32.82 Favored 'General case' 0 C--N 1.279 -2.498 0 CA-C-N 113.964 -1.471 . . . . 0.0 108.609 177.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.426 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 51.2 m-85 -85.19 -167.55 1.88 Allowed 'General case' 0 N--CA 1.401 -2.923 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.087 178.077 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 12.6 ttt -66.54 136.51 55.75 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 -175.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 76.46 9.58 3.06 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 124.99 1.316 . . . . 0.0 111.765 -178.44 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.417 ' O ' ' HA ' ' A' ' 27' ' ' TYR . . . -88.14 145.45 19.16 Favored Glycine 0 N--CA 1.44 -1.08 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 173.833 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.555 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 15.3 t70 -60.91 143.02 55.83 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.704 0.802 . . . . 0.0 112.258 -177.373 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 21.1 p -153.75 148.92 26.91 Favored 'General case' 0 C--N 1.311 -1.092 0 C-N-CA 119.226 -0.99 . . . . 0.0 113.374 -177.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -106.02 -38.53 6.28 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 173.031 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.579 ' HG2' ' OD1' ' A' ' 14' ' ' ASP . 5.0 ptpp? -137.37 177.21 8.04 Favored 'General case' 0 N--CA 1.414 -2.258 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -175.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -74.54 -18.12 60.64 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-O 121.163 0.506 . . . . 0.0 111.038 -175.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.485 ' H ' ' HG3' ' A' ' 11' ' ' LYS . 12.0 mm-40 -72.98 -21.58 60.82 Favored 'General case' 0 CA--C 1.495 -1.141 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.919 -178.65 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.579 ' OD1' ' HG2' ' A' ' 11' ' ' LYS . 31.0 m-20 -72.99 -27.61 61.9 Favored 'General case' 0 N--CA 1.431 -1.391 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.0 m -92.6 164.32 13.47 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.893 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.41 ' HB2' HD12 ' A' ' 19' ' ' LEU . 62.4 m -70.57 176.51 4.05 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.93 175.121 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -68.91 -49.9 54.16 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-O 121.542 0.687 . . . . 0.0 112.089 -170.133 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 55.9 m80 -76.94 15.67 0.65 Allowed 'General case' 0 C--N 1.287 -2.122 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.385 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.426 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 87.0 mt -122.08 174.68 6.79 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.88 144.09 11.56 Favored Glycine 0 C--N 1.306 -1.09 0 N-CA-C 110.221 -1.152 . . . . 0.0 110.221 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 39.2 t -90.23 123.02 33.68 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -174.122 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.529 ' HE2' ' O ' ' A' ' 32' ' ' PHE . 41.2 mmtt -90.13 110.8 21.8 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.786 -0.571 . . . . 0.0 110.106 168.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -76.26 -12.79 60.14 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.79 -177.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -87.88 -26.28 22.83 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 -178.63 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.549 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 91.9 mmm -108.0 -16.2 14.35 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 114.721 -1.127 . . . . 0.0 110.687 -173.529 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.555 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 32.2 mmmt 66.29 33.04 7.4 Favored 'General case' 0 CA--C 1.492 -1.28 0 C-N-CA 124.574 1.15 . . . . 0.0 112.31 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.549 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 11.4 p90 -150.05 159.26 44.54 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.925 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.7 m -82.33 130.85 35.19 Favored 'General case' 0 C--N 1.289 -2.057 0 CA-C-N 113.806 -1.543 . . . . 0.0 110.469 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -115.84 -172.27 2.13 Favored 'General case' 0 C--N 1.291 -1.939 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 175.81 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -76.52 -19.18 58.23 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.65 1.114 . . . . 0.0 111.056 178.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -175.74 144.2 0.63 Allowed 'General case' 0 C--N 1.282 -2.358 0 N-CA-C 103.873 -2.64 . . . . 0.0 103.873 177.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.529 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 35.5 p90 -79.51 -12.07 59.88 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-O 121.668 0.747 . . . . 0.0 109.344 177.786 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.3 m -85.96 90.11 7.99 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.736 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -89.57 -28.71 19.39 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.432 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 15.3 t . . . . . 0 C--N 1.309 -1.164 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 178.527 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 CA--C 1.487 -1.46 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.1 p -77.6 158.35 29.83 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 121.574 0.702 . . . . 0.0 110.392 175.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -92.29 140.73 29.3 Favored 'General case' 0 C--N 1.273 -2.721 0 CA-C-N 114.744 -1.117 . . . . 0.0 109.966 -178.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.49 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 60.2 m-85 -93.23 -165.9 1.42 Allowed 'General case' 0 N--CA 1.396 -3.16 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.919 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.514 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 10.7 ttt -62.81 135.04 57.13 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 -176.121 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 76.8 3.99 3.41 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 125.452 1.501 . . . . 0.0 111.753 -178.319 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.39 149.21 38.44 Favored Glycine 0 N--CA 1.439 -1.101 0 N-CA-C 108.428 -1.869 . . . . 0.0 108.428 171.629 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -76.63 146.34 38.27 Favored 'General case' 0 CA--C 1.483 -1.602 0 CA-C-N 117.258 0.529 . . . . 0.0 110.073 -174.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.3 p -146.02 150.7 36.48 Favored 'General case' 0 C--N 1.278 -2.505 0 C-N-CA 118.556 -1.258 . . . . 0.0 112.368 -176.494 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -108.16 -43.76 4.31 Favored 'General case' 0 N--CA 1.433 -1.319 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 173.375 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.547 ' HD2' ' OE1' ' A' ' 13' ' ' GLU . 46.1 pttt -131.2 169.91 15.29 Favored 'General case' 0 N--CA 1.419 -1.991 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.152 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -68.06 -18.76 64.77 Favored 'General case' 0 CA--C 1.491 -1.327 0 CA-C-O 121.093 0.473 . . . . 0.0 110.864 -179.335 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.547 ' OE1' ' HD2' ' A' ' 11' ' ' LYS . 1.2 mp0 -67.15 -24.7 65.92 Favored 'General case' 0 CA--C 1.492 -1.253 0 CA-C-N 115.084 -0.962 . . . . 0.0 111.027 -179.637 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -72.19 -26.62 62.13 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 121.419 0.628 . . . . 0.0 109.634 -178.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 18.4 m -93.49 159.19 15.35 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.793 -178.353 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.425 ' HB2' HD12 ' A' ' 19' ' ' LEU . 63.9 m -67.08 176.0 2.33 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.727 174.442 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -58.74 -57.12 14.43 Favored 'General case' 0 CA--C 1.504 -0.801 0 C-N-CA 123.909 0.884 . . . . 0.0 113.079 -171.336 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 28.9 m80 -79.08 15.01 1.23 Allowed 'General case' 0 C--N 1.283 -2.304 0 CA-C-N 114.928 -1.033 . . . . 0.0 112.017 -174.358 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.49 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 68.1 mt -123.6 169.05 11.84 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.8 154.19 25.7 Favored Glycine 0 N--CA 1.418 -2.557 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 178.687 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.4 t -89.24 108.93 19.89 Favored 'General case' 0 C--N 1.285 -2.223 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -177.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.415 ' HE2' ' HB3' ' A' ' 29' ' ' ALA . 72.8 mmtt -70.88 112.94 7.45 Favored 'General case' 0 CA--C 1.473 -2.013 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 176.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -74.45 -8.43 56.27 Favored 'General case' 0 C--N 1.292 -1.933 0 O-C-N 124.748 1.28 . . . . 0.0 110.119 -176.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -88.97 -36.35 15.91 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 -176.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.446 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 96.9 mmm -112.74 -12.85 13.3 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 114.43 -1.259 . . . . 0.0 112.931 -171.254 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp 66.95 38.08 3.7 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 125.006 1.322 . . . . 0.0 111.542 -179.267 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.446 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 8.0 p90 -145.53 161.45 39.74 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.375 -0.83 . . . . 0.0 112.114 178.131 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 59.2 m -81.3 128.6 33.99 Favored 'General case' 0 N--CA 1.419 -1.992 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.452 -176.688 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.514 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -124.67 -171.65 2.4 Favored 'General case' 0 C--N 1.284 -2.245 0 N-CA-C 106.292 -1.744 . . . . 0.0 106.292 175.519 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -75.31 3.01 9.75 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 118.767 0.712 . . . . 0.0 112.748 -178.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -173.72 171.31 3.82 Favored 'General case' 0 N--CA 1.416 -2.154 0 N-CA-C 106.65 -1.611 . . . . 0.0 106.65 175.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.468 ' O ' ' HB ' ' A' ' 33' ' ' THR . 26.6 p90 -101.18 5.9 42.86 Favored 'General case' 0 C--N 1.278 -2.502 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -176.265 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.468 ' HB ' ' O ' ' A' ' 32' ' ' PHE . 99.8 m 73.42 106.52 0.07 Allowed 'General case' 0 C--O 1.24 0.6 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -170.371 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -64.39 104.04 0.72 Allowed 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.926 0.869 . . . . 0.0 112.066 -173.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.3 m . . . . . 0 C--O 1.257 1.488 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 179.697 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 . . . . . 0 CA--C 1.496 -1.127 0 N-CA-C 107.537 -1.282 . . . . 0.0 107.537 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.4 p -91.84 169.34 10.77 Favored 'General case' 0 N--CA 1.423 -1.779 0 CA-C-O 121.306 0.574 . . . . 0.0 110.558 177.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.552 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 39.0 mmt180 -102.58 135.39 44.31 Favored 'General case' 0 C--N 1.291 -1.959 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.501 -179.599 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.539 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 87.5 m-85 -95.23 -161.77 0.89 Allowed 'General case' 0 N--CA 1.403 -2.777 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 174.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.59 ' HA ' ' O ' ' A' ' 28' ' ' CYS . 49.4 ttm -62.72 135.87 57.58 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.726 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 82.13 -8.82 1.24 Allowed 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 125.069 1.348 . . . . 0.0 112.115 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.426 ' HA3' ' HB3' ' A' ' 3' ' ' ARG . . . -76.8 139.65 23.91 Favored Glycine 0 N--CA 1.434 -1.44 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 176.178 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.552 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 17.2 t70 -69.54 141.12 53.9 Favored 'General case' 0 CA--C 1.487 -1.476 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -173.466 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.489 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 23.4 p -143.42 152.77 41.95 Favored 'General case' 0 N--CA 1.414 -2.235 0 C-N-CA 119.783 -0.767 . . . . 0.0 111.51 -176.242 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -113.59 -35.72 5.14 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 174.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 45.7 pttt -141.57 177.52 8.08 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 124.45 1.1 . . . . 0.0 108.36 179.058 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -73.63 -16.07 61.24 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 122.227 -0.296 . . . . 0.0 111.197 -175.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -67.87 -25.24 65.42 Favored 'General case' 0 CA--C 1.496 -1.134 0 CA-C-O 121.656 0.741 . . . . 0.0 110.497 179.394 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -68.7 -31.78 71.12 Favored 'General case' 0 N--CA 1.425 -1.677 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.121 -179.031 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.9 m -86.82 159.19 19.17 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.257 -176.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.9 m -66.14 178.47 1.14 Allowed 'General case' 0 C--N 1.307 -1.283 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.288 174.407 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -61.46 -52.31 65.05 Favored 'General case' 0 CA--C 1.485 -1.552 0 CA-C-O 121.701 0.762 . . . . 0.0 112.246 -171.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 30.3 m-70 -74.52 3.92 6.89 Favored 'General case' 0 C--N 1.28 -2.427 0 CA-C-N 114.204 -1.362 . . . . 0.0 113.35 -175.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.0 mp -123.93 167.94 13.46 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.571 0.701 . . . . 0.0 112.781 -177.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -135.5 159.96 24.31 Favored Glycine 0 N--CA 1.433 -1.558 0 N-CA-C 109.157 -1.577 . . . . 0.0 109.157 179.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 32.1 t -94.35 130.65 40.59 Favored 'General case' 0 C--N 1.285 -2.221 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -174.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.436 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 58.9 mmtt -96.95 107.21 19.69 Favored 'General case' 0 CA--C 1.474 -1.952 0 CA-C-O 121.351 0.596 . . . . 0.0 110.731 172.705 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -72.22 -12.04 60.99 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 114.563 -1.198 . . . . 0.0 111.837 -176.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -89.32 -26.68 20.98 Favored 'General case' 0 C--N 1.302 -1.5 0 CA-C-O 121.972 0.891 . . . . 0.0 108.858 -176.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.479 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 97.5 mmm -112.1 -8.6 14.01 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.19 -176.576 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm 63.45 28.75 15.48 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.846 1.258 . . . . 0.0 112.642 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.479 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 8.7 p90 -143.71 161.06 39.55 Favored 'General case' 0 C--N 1.286 -2.179 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.662 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.59 ' O ' ' HA ' ' A' ' 5' ' ' MET . 66.6 m -81.14 140.17 35.17 Favored 'General case' 0 C--N 1.285 -2.213 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.666 -179.005 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -131.52 178.53 6.66 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 105.499 -2.037 . . . . 0.0 105.499 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -68.56 -12.16 60.91 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 119.935 1.243 . . . . 0.0 113.801 -175.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -166.77 142.12 4.31 Favored 'General case' 0 N--CA 1.415 -2.194 0 CA-C-O 121.335 0.588 . . . . 0.0 109.76 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 33.6 p90 -75.79 -22.77 56.07 Favored 'General case' 0 C--N 1.28 -2.431 0 CA-C-N 114.928 -1.033 . . . . 0.0 112.554 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.6 m -95.54 -0.41 52.08 Favored 'General case' 0 CA--C 1.553 1.091 0 CA-C-O 121.781 0.801 . . . . 0.0 109.756 -178.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -55.39 139.26 43.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.226 178.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 15.4 t . . . . . 0 C--N 1.309 -1.159 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.285 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 24.5 t70 . . . . . 0 CA--C 1.494 -1.191 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 20.9 p -108.55 158.22 17.76 Favored 'General case' 0 N--CA 1.405 -2.709 0 CA-C-O 121.629 0.728 . . . . 0.0 110.835 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -86.06 129.86 34.71 Favored 'General case' 0 C--N 1.273 -2.728 0 CA-C-N 114.357 -1.292 . . . . 0.0 108.717 -178.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -86.55 -168.31 2.19 Favored 'General case' 0 N--CA 1.408 -2.544 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.062 178.431 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.461 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 12.8 ttt -69.56 140.08 53.8 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 120.828 0.347 . . . . 0.0 111.16 -172.218 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 74.48 -2.37 2.83 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.745 1.618 . . . . 0.0 112.253 -179.439 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.17 148.64 30.02 Favored Glycine 0 N--CA 1.422 -2.236 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 176.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -63.13 139.76 58.8 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 123.774 0.83 . . . . 0.0 112.636 -177.373 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.438 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 23.5 p -146.0 153.9 41.28 Favored 'General case' 0 C--N 1.287 -2.109 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.452 -178.329 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -112.47 -36.27 5.3 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 177.568 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -145.54 167.56 22.73 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 114.159 -1.382 . . . . 0.0 108.475 -179.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -67.72 -18.48 64.92 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.23 0.538 . . . . 0.0 111.509 -176.499 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -66.01 -27.26 67.99 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.853 -178.462 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -79.24 -27.2 42.41 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.56 -175.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.6 m -88.65 163.49 15.77 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.417 -178.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.472 ' HB2' HD13 ' A' ' 19' ' ' LEU . 31.4 m -69.37 172.03 7.74 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.113 175.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -66.18 -47.15 74.91 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.568 0.699 . . . . 0.0 112.027 -172.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 51.4 m80 -72.02 1.79 6.74 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.719 179.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.472 HD13 ' HB2' ' A' ' 16' ' ' CYS . 5.3 mp -117.65 178.47 4.38 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-O 121.093 0.473 . . . . 0.0 111.256 179.045 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -151.09 151.93 23.83 Favored Glycine 0 N--CA 1.423 -2.179 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 177.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 38.0 t -93.26 116.56 29.12 Favored 'General case' 0 C--N 1.27 -2.872 0 CA-C-N 117.014 0.407 . . . . 0.0 110.251 -175.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.534 ' HE3' ' O ' ' A' ' 33' ' ' THR . 39.9 mmtm -77.33 110.52 12.13 Favored 'General case' 0 CA--C 1.461 -2.45 0 N-CA-C 106.565 -1.643 . . . . 0.0 106.565 172.417 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.523 ' H ' ' HD2' ' A' ' 23' ' ' ARG . 1.1 mpt_? -76.8 -13.25 60.03 Favored 'General case' 0 C--N 1.286 -2.18 0 O-C-N 123.884 0.74 . . . . 0.0 109.22 -173.881 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -90.74 -24.71 20.3 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 122.181 0.991 . . . . 0.0 109.21 -177.623 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.578 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 96.8 mmm -110.0 -7.06 15.0 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.229 -175.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.499 ' HD2' ' N ' ' A' ' 26' ' ' LYS . 3.4 mptp? 61.92 26.28 15.87 Favored 'General case' 0 CA--C 1.505 -0.769 0 C-N-CA 125.271 1.428 . . . . 0.0 111.769 177.09 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.578 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 23.1 p90 -140.42 158.88 43.34 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.788 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.438 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 59.5 m -81.69 131.7 35.27 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.111 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.461 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -124.14 -174.17 2.94 Favored 'General case' 0 C--N 1.288 -2.102 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 176.229 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -76.61 -1.83 29.55 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 120.248 1.386 . . . . 0.0 113.203 -176.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -169.27 163.14 10.79 Favored 'General case' 0 N--CA 1.417 -2.107 0 N-CA-C 106.439 -1.689 . . . . 0.0 106.439 179.053 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -103.72 4.66 35.55 Favored 'General case' 0 C--N 1.268 -2.937 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -173.513 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.534 ' O ' ' HE3' ' A' ' 22' ' ' LYS . 25.8 m -84.99 132.31 34.36 Favored 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 120.269 -0.573 . . . . 0.0 110.28 -175.211 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -52.01 -54.26 32.06 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-O 121.436 0.636 . . . . 0.0 111.232 -177.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 25.4 m . . . . . 0 C--N 1.303 -1.441 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.167 179.865 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 . . . . . 0 C--O 1.237 0.401 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.6 p -90.54 164.26 14.29 Favored 'General case' 0 CA--C 1.494 -1.188 0 CA-C-O 121.63 0.728 . . . . 0.0 111.319 -179.617 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -93.47 132.8 37.4 Favored 'General case' 0 C--N 1.278 -2.528 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.679 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.517 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 53.6 m-85 -85.05 -170.79 3.3 Favored 'General case' 0 N--CA 1.398 -3.05 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.579 176.757 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.3 ttt -62.97 134.09 55.63 Favored 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 -178.258 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 81.65 2.44 1.47 Allowed 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 125.067 1.347 . . . . 0.0 112.139 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -86.45 146.6 20.96 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 174.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.454 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 28.4 t70 -65.96 142.77 57.75 Favored 'General case' 0 CA--C 1.493 -1.222 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -175.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 26.8 p -150.99 154.72 37.61 Favored 'General case' 0 C--N 1.291 -1.954 0 C-N-CA 120.103 -0.639 . . . . 0.0 111.202 -177.54 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -115.12 -36.6 4.34 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.0 pttm -138.55 175.58 9.44 Favored 'General case' 0 N--CA 1.427 -1.613 0 CA-C-N 115.222 -0.899 . . . . 0.0 108.612 177.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -72.04 -16.75 62.05 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 120.512 0.196 . . . . 0.0 111.42 -174.478 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -61.65 -36.99 82.38 Favored 'General case' 0 CA--C 1.502 -0.888 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 179.076 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -63.2 -32.48 73.88 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.604 -177.472 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.0 m -88.59 159.18 18.01 Favored 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.316 -177.467 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.492 ' HB2' HD12 ' A' ' 19' ' ' LEU . 58.5 m -66.83 176.88 1.85 Allowed 'General case' 0 C--N 1.303 -1.416 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.55 175.692 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.5 ' HA ' ' HE2' ' A' ' 17' ' ' LYS . 10.3 mmpt? -64.47 -52.6 57.1 Favored 'General case' 0 CA--C 1.502 -0.895 0 CA-C-O 121.192 0.52 . . . . 0.0 111.889 -171.845 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -72.9 9.95 1.02 Allowed 'General case' 0 C--N 1.297 -1.679 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.504 -178.392 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.517 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 64.8 mt -125.01 177.12 6.23 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 -175.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -151.26 166.57 30.6 Favored Glycine 0 N--CA 1.434 -1.488 0 N-CA-C 108.64 -1.784 . . . . 0.0 108.64 176.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -99.46 129.5 45.64 Favored 'General case' 0 C--N 1.288 -2.069 0 CA-C-N 118.125 0.962 . . . . 0.0 112.064 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.6 mmmt -96.53 107.53 19.96 Favored 'General case' 0 CA--C 1.473 -1.997 0 CA-C-O 121.255 0.55 . . . . 0.0 111.0 173.364 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -69.1 -15.3 63.4 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 114.208 -1.36 . . . . 0.0 113.169 -175.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -89.33 -27.59 20.41 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.897 0.856 . . . . 0.0 109.177 -177.311 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.417 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 74.7 mmm -109.54 -10.97 14.84 Favored 'General case' 0 N--CA 1.426 -1.666 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.838 -172.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.454 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 71.1 mmtt 63.61 30.22 15.01 Favored 'General case' 0 CA--C 1.5 -0.958 0 C-N-CA 124.75 1.22 . . . . 0.0 111.194 -178.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.417 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 4.9 p90 -145.35 159.43 43.07 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.301 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 72.0 m -76.68 134.7 39.18 Favored 'General case' 0 C--N 1.287 -2.125 0 CA-C-N 114.519 -1.219 . . . . 0.0 111.473 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -122.09 -167.59 1.57 Allowed 'General case' 0 C--N 1.296 -1.717 0 N-CA-C 105.731 -1.951 . . . . 0.0 105.731 177.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -81.66 -6.14 58.73 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 119.691 1.132 . . . . 0.0 112.723 -176.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -169.13 171.61 7.99 Favored 'General case' 0 N--CA 1.405 -2.693 0 N-CA-C 103.821 -2.659 . . . . 0.0 103.821 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 33.9 p90 -77.48 -13.7 59.86 Favored 'General case' 0 C--N 1.277 -2.574 0 CA-C-O 121.258 0.552 . . . . 0.0 110.825 179.577 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.6 m -95.37 115.26 27.19 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-N 115.337 -0.847 . . . . 0.0 108.856 178.144 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -156.6 121.97 4.73 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 179.205 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 39.9 m . . . . . 0 C--N 1.299 -1.626 0 CA-C-O 120.648 0.261 . . . . 0.0 110.932 -178.597 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.7 p . . . . . 0 N--CA 1.433 -1.307 0 CA-C-O 121.946 0.879 . . . . 0.0 112.659 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.6 mpp_? -103.17 134.67 46.2 Favored 'General case' 0 C--N 1.285 -2.196 0 CA-C-N 114.107 -1.406 . . . . 0.0 109.83 177.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.437 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 89.7 m-85 -91.38 -162.03 0.88 Allowed 'General case' 0 N--CA 1.404 -2.742 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.477 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 6.8 ttt -65.8 136.72 56.57 Favored 'General case' 0 C--N 1.32 -0.688 0 O-C-N 122.295 -0.253 . . . . 0.0 110.91 -171.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 79.52 2.68 2.22 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.061 1.344 . . . . 0.0 111.997 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -87.44 144.88 19.32 Favored Glycine 0 N--CA 1.438 -1.203 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 174.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.506 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 19.3 t70 -61.93 148.07 44.81 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.244 0.618 . . . . 0.0 112.598 -176.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.409 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 30.5 p -152.4 146.63 25.47 Favored 'General case' 0 N--CA 1.423 -1.81 0 C-N-CA 120.097 -0.641 . . . . 0.0 111.786 -179.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -101.95 -44.27 5.54 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 106.726 -1.583 . . . . 0.0 106.726 172.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.57 ' HG2' ' OD1' ' A' ' 14' ' ' ASP . 4.4 ptpp? -134.52 177.47 7.75 Favored 'General case' 0 N--CA 1.409 -2.523 0 CA-C-N 113.752 -1.567 . . . . 0.0 107.549 -176.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -74.53 -19.76 60.23 Favored 'General case' 0 C--N 1.29 -2.014 0 CA-C-O 121.154 0.502 . . . . 0.0 110.959 -175.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.458 ' H ' ' HG3' ' A' ' 11' ' ' LYS . 9.8 tp10 -69.24 -23.52 63.88 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.849 -177.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.57 ' OD1' ' HG2' ' A' ' 11' ' ' LYS . 40.0 m-20 -74.78 -29.89 61.27 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-O 121.758 0.789 . . . . 0.0 109.157 -178.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.1 m -87.33 163.32 16.88 Favored 'General case' 0 N--CA 1.426 -1.658 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.226 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 m -69.97 169.25 13.65 Favored 'General case' 0 N--CA 1.419 -2.003 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 173.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -87.81 -0.19 56.62 Favored 'General case' 0 C--N 1.287 -2.152 0 CA-C-O 122.728 1.252 . . . . 0.0 111.384 -170.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 89.3 m-70 -95.08 2.05 55.11 Favored 'General case' 0 C--N 1.273 -2.748 0 CA-C-N 113.08 -1.873 . . . . 0.0 108.656 172.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.4 ' HB3' ' O ' ' A' ' 29' ' ' ALA . 5.0 mp -136.41 -177.05 4.55 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.464 -175.333 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.64 160.55 28.52 Favored Glycine 0 N--CA 1.425 -2.067 0 N-CA-C 108.818 -1.713 . . . . 0.0 108.818 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.6 t -92.48 127.89 38.14 Favored 'General case' 0 C--N 1.285 -2.221 0 CA-C-N 117.84 0.82 . . . . 0.0 111.429 -176.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm -96.68 112.58 24.27 Favored 'General case' 0 CA--C 1.468 -2.183 0 O-C-N 121.36 -0.838 . . . . 0.0 108.894 169.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -72.73 -8.72 56.79 Favored 'General case' 0 C--N 1.294 -1.832 0 CA-C-N 114.289 -1.323 . . . . 0.0 111.51 -176.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -88.91 -27.82 20.72 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-O 122.201 1.0 . . . . 0.0 108.378 -177.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.572 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 0.9 OUTLIER -110.03 -8.44 14.82 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 114.513 -1.222 . . . . 0.0 111.03 -176.022 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.506 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 3.7 mptp? 59.85 26.36 15.55 Favored 'General case' 0 CA--C 1.486 -1.499 0 C-N-CA 124.61 1.164 . . . . 0.0 110.847 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.572 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 2.5 p90 -141.27 156.62 45.86 Favored 'General case' 0 C--N 1.286 -2.164 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.521 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.437 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 59.3 m -72.29 133.53 45.07 Favored 'General case' 0 N--CA 1.411 -2.418 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.508 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.477 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -120.11 173.81 6.87 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 176.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -71.98 -0.06 10.59 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 119.59 1.086 . . . . 0.0 113.331 -175.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.1 p30 . . . . . 0 N--CA 1.407 -2.592 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 -178.604 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 24.8 p . . . . . 0 N--CA 1.407 -2.592 0 CA-C-O 121.704 0.764 . . . . 0.0 110.58 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.7 mpp_? -94.04 133.88 37.04 Favored 'General case' 0 C--N 1.268 -2.977 0 CA-C-N 114.263 -1.335 . . . . 0.0 109.632 176.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.489 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 43.6 m-85 -85.07 -165.83 1.32 Allowed 'General case' 0 N--CA 1.409 -2.483 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 176.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 12.4 ttt -63.96 134.21 54.66 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 77.88 1.19 2.84 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.509 1.524 . . . . 0.0 111.66 -178.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -76.31 154.49 44.4 Favored Glycine 0 N--CA 1.44 -1.062 0 N-CA-C 109.172 -1.571 . . . . 0.0 109.172 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -74.81 143.53 43.93 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 117.099 0.449 . . . . 0.0 111.929 -174.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.462 ' O ' ' HE2' ' A' ' 26' ' ' LYS . 28.9 p -151.45 154.86 37.42 Favored 'General case' 0 N--CA 1.412 -2.331 0 C-N-CA 119.988 -0.685 . . . . 0.0 111.232 -177.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -112.83 -36.57 5.11 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 107.324 -1.361 . . . . 0.0 107.324 171.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -141.98 178.15 7.72 Favored 'General case' 0 N--CA 1.425 -1.709 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.835 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -71.4 -17.81 62.38 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 120.606 0.241 . . . . 0.0 111.311 -174.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -64.36 -26.47 68.49 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-O 121.492 0.663 . . . . 0.0 110.319 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -72.88 -29.49 63.22 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.124 -178.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.2 m -91.4 162.64 14.5 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.516 -176.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.418 ' HB2' HD12 ' A' ' 19' ' ' LEU . 60.8 m -71.35 177.83 3.72 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.575 175.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -57.65 -56.44 21.94 Favored 'General case' 0 CA--C 1.502 -0.885 0 C-N-CA 124.114 0.966 . . . . 0.0 112.293 -174.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 -77.13 19.88 0.3 Allowed 'General case' 0 C--N 1.293 -1.862 0 CA-C-N 114.801 -1.09 . . . . 0.0 112.882 -176.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.432 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 60.7 mt -132.51 167.45 19.96 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.248 0.547 . . . . 0.0 110.764 -176.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.37 148.92 20.92 Favored Glycine 0 N--CA 1.434 -1.476 0 N-CA-C 108.994 -1.642 . . . . 0.0 108.994 177.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.9 t -84.61 128.27 34.51 Favored 'General case' 0 C--N 1.285 -2.215 0 CA-C-N 117.236 0.518 . . . . 0.0 111.208 -175.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 35.0 mmtm -88.29 112.9 23.34 Favored 'General case' 0 CA--C 1.465 -2.318 0 O-C-N 121.934 -0.479 . . . . 0.0 109.796 172.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.2 mpt_? -73.95 -9.78 58.98 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.601 -1.181 . . . . 0.0 111.505 -178.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -89.34 -29.14 19.35 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 -178.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.468 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 95.0 mmm -112.44 -20.36 11.81 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 114.68 -1.145 . . . . 0.0 112.3 -171.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.462 ' HE2' ' O ' ' A' ' 9' ' ' CYS . 14.4 mmmm 69.69 36.39 2.14 Favored 'General case' 0 CA--C 1.503 -0.843 0 C-N-CA 125.458 1.503 . . . . 0.0 111.304 -178.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.468 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 3.4 p90 -144.25 160.17 41.43 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-N 114.365 -1.289 . . . . 0.0 111.696 178.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.489 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 70.2 m -79.92 130.04 34.97 Favored 'General case' 0 C--N 1.289 -2.045 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.832 -178.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.84 -174.48 2.83 Favored 'General case' 0 C--N 1.289 -2.034 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 177.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.423 ' HA ' HD23 ' A' ' 19' ' ' LEU . 99.5 m95 -75.45 -6.16 48.69 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -176.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 N--CA 1.407 -2.611 0 N-CA-C 105.194 -2.15 . . . . 0.0 105.194 -179.987 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.7 p . . . . . 0 N--CA 1.418 -2.029 0 CA-C-O 121.78 0.8 . . . . 0.0 109.5 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -115.07 135.73 53.88 Favored 'General case' 0 N--CA 1.402 -2.842 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.618 171.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.455 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 64.4 m-85 -96.16 -159.04 0.7 Allowed 'General case' 0 N--CA 1.387 -3.619 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 175.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 11.1 ttt -67.47 135.57 53.29 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.386 -0.926 . . . . 0.0 109.661 -175.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 76.26 5.98 3.63 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.529 1.132 . . . . 0.0 111.059 -178.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . 0.41 ' O ' ' HA ' ' A' ' 27' ' ' TYR . . . -87.25 149.7 22.2 Favored Glycine 0 N--CA 1.434 -1.493 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 175.364 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.423 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 7.2 t70 -71.22 141.84 50.62 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 123.682 0.793 . . . . 0.0 112.924 -173.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.444 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 20.5 p -149.95 150.34 31.7 Favored 'General case' 0 C--N 1.284 -2.279 0 C-N-CA 119.626 -0.829 . . . . 0.0 111.432 -177.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -113.76 -35.13 5.26 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 172.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.585 ' HG2' ' OD2' ' A' ' 14' ' ' ASP . 3.9 ptpp? -138.06 175.14 9.84 Favored 'General case' 0 N--CA 1.413 -2.281 0 CA-C-N 114.417 -1.265 . . . . 0.0 107.82 -176.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -75.34 -16.57 60.39 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-O 121.16 0.505 . . . . 0.0 111.443 -175.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.5 ' HB2' ' HG3' ' A' ' 11' ' ' LYS . 46.1 mt-10 -68.87 -25.99 64.9 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.818 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.585 ' OD2' ' HG2' ' A' ' 11' ' ' LYS . 45.0 m-20 -72.92 -26.79 61.53 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.109 -177.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 13.0 m -96.68 156.92 16.14 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 120.978 0.418 . . . . 0.0 110.088 -178.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.16 179.71 3.72 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 173.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -49.99 -61.46 2.13 Favored 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 127.15 2.18 . . . . 0.0 113.867 -172.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -76.25 15.57 0.56 Allowed 'General case' 0 C--N 1.29 -1.986 0 CA-C-N 114.854 -1.066 . . . . 0.0 112.746 -174.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.2 mp -135.54 176.76 8.38 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-O 120.925 0.393 . . . . 0.0 110.942 -177.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -150.38 161.06 28.83 Favored Glycine 0 N--CA 1.425 -2.088 0 N-CA-C 108.902 -1.679 . . . . 0.0 108.902 176.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.2 t -87.16 130.59 34.48 Favored 'General case' 0 C--N 1.297 -1.699 0 CA-C-N 117.554 0.677 . . . . 0.0 112.333 -176.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.574 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 74.4 mmtt -100.63 105.1 16.46 Favored 'General case' 0 CA--C 1.465 -2.312 0 CA-C-O 121.358 0.599 . . . . 0.0 109.43 170.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -72.92 -3.7 27.44 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 114.385 -1.28 . . . . 0.0 111.115 -176.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -89.77 -31.68 17.3 Favored 'General case' 0 CA--C 1.5 -0.972 0 CA-C-O 121.998 0.904 . . . . 0.0 108.694 -177.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.533 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 96.2 mmm -112.29 -7.97 13.97 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 114.537 -1.211 . . . . 0.0 111.867 -176.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.423 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 70.7 mmtt 65.35 30.01 11.23 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.723 1.209 . . . . 0.0 111.717 -179.053 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.533 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 7.0 p90 -144.42 159.79 42.14 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.27 178.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 55.9 m -81.15 131.02 35.28 Favored 'General case' 0 C--N 1.287 -2.139 0 CA-C-N 114.614 -1.176 . . . . 0.0 110.658 -178.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -116.33 -176.59 2.99 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 105.831 -1.915 . . . . 0.0 105.831 175.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -75.54 2.43 11.72 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 119.053 0.842 . . . . 0.0 113.041 -175.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.574 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 2.9 p30 . . . . . 0 N--CA 1.401 -2.919 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.1 p . . . . . 0 N--CA 1.418 -2.074 0 CA-C-O 121.114 0.483 . . . . 0.0 109.798 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . 0.436 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 3.4 tpp180 -86.76 131.22 34.19 Favored 'General case' 0 C--N 1.276 -2.602 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 -178.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -90.25 -166.55 1.61 Allowed 'General case' 0 N--CA 1.415 -2.182 0 CA-C-O 120.818 0.342 . . . . 0.0 111.843 -178.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 16.0 ttt -64.9 140.31 58.85 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.755 -174.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 72.22 8.91 5.91 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.514 1.126 . . . . 0.0 111.577 -179.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.61 137.92 14.16 Favored Glycine 0 N--CA 1.419 -2.486 0 N-CA-C 109.681 -1.368 . . . . 0.0 109.681 175.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.554 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 18.5 t70 -56.76 143.99 34.6 Favored 'General case' 0 CA--C 1.486 -1.489 0 C-N-CA 124.449 1.1 . . . . 0.0 111.553 -178.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 26.5 p -149.43 151.91 34.8 Favored 'General case' 0 N--CA 1.42 -1.941 0 C-N-CA 119.518 -0.873 . . . . 0.0 111.957 -175.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -115.97 -33.91 4.92 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.292 -0.867 . . . . 0.0 108.71 176.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -138.73 164.04 30.59 Favored 'General case' 0 N--CA 1.42 -1.959 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 176.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -71.55 -16.5 62.32 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-O 121.317 0.58 . . . . 0.0 110.162 -177.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -67.52 -28.22 67.63 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 114.432 -1.258 . . . . 0.0 109.552 -177.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -69.08 -32.8 72.49 Favored 'General case' 0 N--CA 1.436 -1.133 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.911 -177.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.436 ' SG ' ' HB3' ' A' ' 3' ' ' ARG . 69.3 m -100.4 165.74 11.3 Favored 'General case' 0 N--CA 1.429 -1.512 0 CA-C-O 121.378 0.609 . . . . 0.0 112.582 -177.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.431 ' HB2' HD13 ' A' ' 19' ' ' LEU . 11.3 m -64.69 172.34 2.8 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.834 -178.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -79.01 -27.43 43.26 Favored 'General case' 0 CA--C 1.488 -1.432 0 CA-C-O 121.939 0.876 . . . . 0.0 111.647 -172.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 33.9 m170 -77.92 4.14 12.78 Favored 'General case' 0 C--N 1.28 -2.439 0 CA-C-N 114.299 -1.319 . . . . 0.0 110.62 177.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.431 HD13 ' HB2' ' A' ' 16' ' ' CYS . 5.5 mp -133.14 177.1 7.93 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-O 121.285 0.564 . . . . 0.0 111.304 -177.369 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -150.6 152.12 24.03 Favored Glycine 0 N--CA 1.421 -2.365 0 N-CA-C 109.774 -1.33 . . . . 0.0 109.774 176.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 32.5 t -88.96 118.68 28.86 Favored 'General case' 0 C--N 1.292 -1.915 0 C-N-CA 123.153 0.581 . . . . 0.0 111.042 -175.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 75.3 mmtt -87.97 115.61 25.56 Favored 'General case' 0 CA--C 1.466 -2.269 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 177.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.1 mmt180 -73.47 -15.3 61.33 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.326 -175.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.448 ' HG3' ' HG2' ' A' ' 25' ' ' MET . 64.5 pttt -90.68 -25.93 19.83 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.965 -176.483 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.574 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 89.4 mmm -107.01 -17.19 14.24 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 114.975 -1.012 . . . . 0.0 110.755 -173.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.554 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 32.2 mmmt 68.36 33.1 4.3 Favored 'General case' 0 CA--C 1.489 -1.398 0 C-N-CA 124.42 1.088 . . . . 0.0 111.118 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.574 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 7.8 p90 -153.61 166.36 33.03 Favored 'General case' 0 C--N 1.287 -2.127 0 CA-C-N 114.185 -1.371 . . . . 0.0 110.464 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.6 m -95.85 140.37 30.72 Favored 'General case' 0 C--N 1.276 -2.59 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.31 -172.41 2.35 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 177.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -76.71 9.24 2.93 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 119.883 1.219 . . . . 0.0 113.151 -176.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.423 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 4.7 p-10 . . . . . 0 N--CA 1.405 -2.677 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.7 p . . . . . 0 N--CA 1.426 -1.635 0 CA-C-O 121.263 0.554 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . 0.509 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 39.6 mmt180 -80.12 131.48 35.75 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-N 114.565 -1.198 . . . . 0.0 109.524 178.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.43 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 55.8 m-85 -90.91 -158.88 0.58 Allowed 'General case' 0 N--CA 1.397 -3.109 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 173.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.1 ttt -71.66 137.28 47.75 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 120.31 -0.556 . . . . 0.0 109.901 -173.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 77.61 2.36 3.01 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.137 1.375 . . . . 0.0 111.266 -178.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.38 142.9 26.56 Favored Glycine 0 N--CA 1.43 -1.713 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 174.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.509 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 12.7 t70 -69.32 144.54 53.5 Favored 'General case' 0 CA--C 1.492 -1.259 0 C-N-CA 123.339 0.656 . . . . 0.0 111.116 -176.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.415 ' O ' ' HE2' ' A' ' 26' ' ' LYS . 32.0 p -152.47 155.97 38.53 Favored 'General case' 0 C--N 1.29 -1.991 0 C-N-CA 119.65 -0.82 . . . . 0.0 111.883 -176.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -113.73 -36.93 4.71 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 171.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.4 pttm -135.68 167.52 20.98 Favored 'General case' 0 N--CA 1.426 -1.666 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.153 -178.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -67.46 -19.13 65.31 Favored 'General case' 0 CA--C 1.488 -1.411 0 CA-C-O 120.994 0.426 . . . . 0.0 111.49 -178.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -70.94 -23.7 62.29 Favored 'General case' 0 CA--C 1.497 -1.095 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.34 -177.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -77.16 -27.98 53.94 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.1 -178.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 20.8 m -89.68 158.95 17.35 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 59.1 m -65.23 169.9 5.18 Favored 'General case' 0 N--CA 1.421 -1.923 0 CA-C-O 121.448 0.642 . . . . 0.0 110.632 174.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -66.71 -47.91 70.88 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.647 -169.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 47.5 m80 -64.82 -3.9 3.84 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 114.872 -1.058 . . . . 0.0 113.196 179.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.7 mp -120.96 -178.77 3.83 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.289 0.566 . . . . 0.0 111.583 -177.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -148.18 153.16 25.1 Favored Glycine 0 N--CA 1.419 -2.471 0 N-CA-C 110.27 -1.132 . . . . 0.0 110.27 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.3 t -86.31 127.78 34.83 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-O 120.6 0.238 . . . . 0.0 110.481 -177.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.503 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 73.1 mmtt -92.51 113.57 25.88 Favored 'General case' 0 CA--C 1.46 -2.497 0 CA-C-O 121.24 0.543 . . . . 0.0 110.439 176.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -71.45 -12.78 61.57 Favored 'General case' 0 C--N 1.29 -1.979 0 CA-C-N 113.474 -1.694 . . . . 0.0 112.091 -175.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.3 mmmp? -90.38 -30.66 17.27 Favored 'General case' 0 C--N 1.297 -1.702 0 C-N-CA 119.457 -0.897 . . . . 0.0 109.633 -177.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.448 ' HB3' ' CD2' ' A' ' 27' ' ' TYR . 16.5 mmt -113.15 -13.84 12.97 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -174.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.415 ' HE2' ' O ' ' A' ' 9' ' ' CYS . 14.5 mmmm 66.81 36.67 4.42 Favored 'General case' 0 CA--C 1.498 -1.055 0 C-N-CA 124.444 1.098 . . . . 0.0 110.767 -179.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.448 ' CD2' ' HB3' ' A' ' 25' ' ' MET . 10.0 p90 -142.99 159.84 41.49 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.657 177.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.43 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 42.2 m -84.72 129.47 34.83 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.938 -176.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.16 -173.8 2.64 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -79.62 8.46 6.48 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 119.775 1.17 . . . . 0.0 113.1 -176.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.503 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 3.3 p-10 . . . . . 0 N--CA 1.409 -2.479 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 13.1 p . . . . . 0 N--CA 1.439 -0.992 0 CA-C-O 121.854 0.835 . . . . 0.0 112.397 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 3' ' ' ARG . 0.4 OUTLIER -94.48 132.04 39.56 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.08 176.767 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.459 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 70.3 m-85 -92.09 -162.96 0.98 Allowed 'General case' 0 N--CA 1.398 -3.029 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 175.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.7 ttt -61.88 137.56 58.26 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 120.51 0.195 . . . . 0.0 110.57 -175.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 76.84 -5.09 2.24 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.926 1.291 . . . . 0.0 111.888 -179.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.92 146.39 36.58 Favored Glycine 0 N--CA 1.435 -1.394 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 176.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.467 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 16.2 t70 -73.23 145.37 46.26 Favored 'General case' 0 CA--C 1.485 -1.548 0 CA-C-O 120.947 0.404 . . . . 0.0 111.081 -176.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.7 p -153.73 152.75 31.12 Favored 'General case' 0 N--CA 1.41 -2.472 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.459 -178.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -113.34 -32.88 6.12 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 173.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -131.71 165.44 23.72 Favored 'General case' 0 N--CA 1.417 -2.097 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 176.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -70.03 -16.18 63.12 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 121.552 0.691 . . . . 0.0 110.469 -175.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -72.92 -23.75 60.74 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.974 -177.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -76.72 -16.24 59.56 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.154 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 33.9 m -99.14 156.56 16.89 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.805 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 36.4 m -64.45 173.82 1.95 Allowed 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.797 176.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -60.8 -51.91 67.31 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.63 1.172 . . . . 0.0 113.024 -171.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 41.3 m80 -70.82 2.37 4.33 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 114.202 -1.363 . . . . 0.0 113.237 -178.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.6 mp -122.52 173.17 7.85 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.564 0.697 . . . . 0.0 112.561 -177.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -138.97 156.92 24.61 Favored Glycine 0 N--CA 1.43 -1.766 0 N-CA-C 108.304 -1.919 . . . . 0.0 108.304 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.3 t -100.74 121.57 41.88 Favored 'General case' 0 C--N 1.286 -2.159 0 CA-C-N 117.774 0.787 . . . . 0.0 110.783 -175.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -75.31 110.66 9.85 Favored 'General case' 0 CA--C 1.461 -2.445 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 171.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.43 ' H ' ' HD2' ' A' ' 23' ' ' ARG . 2.3 mpt_? -77.36 -11.55 59.85 Favored 'General case' 0 C--N 1.291 -1.967 0 O-C-N 124.531 1.145 . . . . 0.0 109.578 -176.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -89.59 -27.69 20.05 Favored 'General case' 0 N--CA 1.433 -1.3 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.455 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 93.4 mmm -112.84 -6.82 13.8 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -172.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.467 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 4.9 mptp? 59.65 33.13 21.88 Favored 'General case' 0 CA--C 1.495 -1.17 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.455 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 17.3 p90 -144.66 153.3 41.6 Favored 'General case' 0 CA--C 1.486 -1.49 0 C-N-CA 118.881 -1.128 . . . . 0.0 112.946 177.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 39.7 m -80.04 131.42 35.78 Favored 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 113.966 -1.47 . . . . 0.0 110.046 -179.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -124.13 175.5 6.97 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 178.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -70.63 -4.66 24.45 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -175.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 . . . . . 0 N--CA 1.418 -2.03 0 N-CA-C 103.59 -2.745 . . . . 0.0 103.59 175.517 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.9 p . . . . . 0 N--CA 1.429 -1.479 0 CA-C-O 121.281 0.562 . . . . 0.0 111.25 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 33.9 mmt180 -82.09 125.93 31.42 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 115.004 -0.998 . . . . 0.0 108.425 176.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.501 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 76.9 m-85 -88.39 -164.91 1.2 Allowed 'General case' 0 N--CA 1.387 -3.625 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.532 178.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.491 ' HA ' ' O ' ' A' ' 28' ' ' CYS . 16.3 ttt -63.97 134.03 54.3 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 120.817 0.342 . . . . 0.0 110.354 -173.455 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 78.79 -1.77 2.35 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 125.631 1.572 . . . . 0.0 111.717 -179.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.3 145.06 32.71 Favored Glycine 0 N--CA 1.439 -1.105 0 N-CA-C 110.201 -1.16 . . . . 0.0 110.201 176.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.415 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 13.5 t70 -67.7 144.9 55.24 Favored 'General case' 0 CA--C 1.495 -1.151 0 C-N-CA 123.117 0.567 . . . . 0.0 111.742 -177.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.1 p -149.36 161.3 42.33 Favored 'General case' 0 N--CA 1.419 -1.982 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.201 -177.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -118.25 -32.34 4.71 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 172.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.8 pttt -147.42 177.28 9.37 Favored 'General case' 0 N--CA 1.426 -1.663 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 178.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -71.84 -16.32 62.16 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -175.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.24 -30.64 71.68 Favored 'General case' 0 CA--C 1.488 -1.428 0 CA-C-O 121.317 0.58 . . . . 0.0 110.498 177.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -68.83 -32.27 71.84 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.893 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 17.7 m -94.99 155.26 16.8 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.109 -177.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.404 ' HB2' HD12 ' A' ' 19' ' ' LEU . 25.1 m -60.77 173.47 0.74 Allowed 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 123.885 0.874 . . . . 0.0 111.351 175.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -68.54 -39.4 81.13 Favored 'General case' 0 CA--C 1.5 -0.956 0 CA-C-O 121.884 0.85 . . . . 0.0 111.919 -171.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 20.2 m170 -86.87 9.25 19.81 Favored 'General case' 0 C--N 1.278 -2.527 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.206 -176.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.501 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 68.8 mt -126.71 162.83 24.88 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 -178.012 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -139.39 150.96 21.64 Favored Glycine 0 C--N 1.299 -1.51 0 N-CA-C 110.754 -0.939 . . . . 0.0 110.754 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -87.08 106.21 17.7 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -176.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -64.3 114.9 4.56 Favored 'General case' 0 CA--C 1.468 -2.193 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 175.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -65.62 -24.1 66.97 Favored 'General case' 0 C--N 1.308 -1.227 0 O-C-N 125.237 1.585 . . . . 0.0 110.475 -175.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -90.05 -21.47 22.31 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 119.597 -0.841 . . . . 0.0 110.695 -168.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -112.3 -29.98 7.35 Favored 'General case' 0 N--CA 1.419 -2.018 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.334 -176.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.447 ' HD3' ' HA ' ' A' ' 26' ' ' LYS . 32.5 mmtp 72.06 49.59 0.24 Allowed 'General case' 0 CA--C 1.494 -1.188 0 C-N-CA 125.227 1.411 . . . . 0.0 110.925 -171.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -145.04 160.05 41.99 Favored 'General case' 0 CA--C 1.486 -1.483 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.233 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.491 ' O ' ' HA ' ' A' ' 5' ' ' MET . 56.3 m -85.57 122.81 30.22 Favored 'General case' 0 C--N 1.282 -2.344 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.252 -177.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.49 -165.18 1.17 Allowed 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 106.317 -1.735 . . . . 0.0 106.317 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -75.84 -5.84 47.87 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -176.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 . . . . . 0 N--CA 1.41 -2.432 0 N-CA-C 105.92 -1.881 . . . . 0.0 105.92 173.94 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.5 p . . . . . 0 N--CA 1.424 -1.767 0 CA-C-O 121.649 0.738 . . . . 0.0 111.758 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.72 135.42 41.16 Favored 'General case' 0 C--N 1.283 -2.284 0 CA-C-N 114.388 -1.278 . . . . 0.0 109.476 176.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.481 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 87.7 m-85 -91.46 -162.75 0.95 Allowed 'General case' 0 N--CA 1.399 -2.992 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 176.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.422 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 10.5 ttt -64.44 135.35 56.01 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 -175.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 75.77 9.67 3.45 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.828 1.251 . . . . 0.0 111.938 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.34 144.22 17.36 Favored Glycine 0 N--CA 1.434 -1.44 0 N-CA-C 109.161 -1.575 . . . . 0.0 109.161 173.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -62.47 145.6 53.75 Favored 'General case' 0 CA--C 1.493 -1.217 0 C-N-CA 123.079 0.551 . . . . 0.0 112.138 -176.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 21.6 p -153.47 155.13 35.71 Favored 'General case' 0 N--CA 1.422 -1.85 0 C-N-CA 120.011 -0.676 . . . . 0.0 110.757 -179.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -121.44 -34.33 3.47 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 172.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.6 pttt -131.36 174.09 10.42 Favored 'General case' 0 N--CA 1.42 -1.974 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 176.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -74.03 -16.06 61.06 Favored 'General case' 0 C--N 1.297 -1.717 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 -174.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -71.19 -24.7 62.27 Favored 'General case' 0 CA--C 1.483 -1.632 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.732 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -69.54 -25.54 64.06 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.609 -178.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 25.7 m -96.58 155.61 16.69 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.709 -178.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.7 m -66.13 178.01 1.26 Allowed 'General case' 0 C--N 1.291 -1.977 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.421 176.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 36.3 mmtp -57.61 -55.64 32.26 Favored 'General case' 0 CA--C 1.505 -0.763 0 C-N-CA 124.304 1.041 . . . . 0.0 113.066 -171.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 39.5 m80 -72.8 1.47 8.51 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 115.204 -0.907 . . . . 0.0 113.342 -176.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.3 mp -124.7 166.95 15.25 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-O 121.682 0.753 . . . . 0.0 111.961 -175.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -135.46 161.88 24.77 Favored Glycine 0 N--CA 1.419 -2.467 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 178.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.4 t -88.23 122.1 31.38 Favored 'General case' 0 C--N 1.285 -2.22 0 CA-C-N 116.92 0.36 . . . . 0.0 110.851 -176.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -83.9 114.37 21.62 Favored 'General case' 0 CA--C 1.465 -2.316 0 C-N-CA 119.426 -0.91 . . . . 0.0 110.06 175.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -67.11 -24.17 65.91 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 113.804 -1.544 . . . . 0.0 110.222 -178.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -87.39 -26.38 23.35 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 115.263 -0.88 . . . . 0.0 109.569 -174.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.548 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 76.3 mmm -110.4 -15.66 13.88 Favored 'General case' 0 C--N 1.291 -1.96 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.007 -170.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm 62.56 33.35 15.96 Favored 'General case' 0 CA--C 1.496 -1.124 0 C-N-CA 124.856 1.263 . . . . 0.0 110.348 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.548 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 3.3 p90 -151.18 161.23 43.1 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.419 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.481 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 57.6 m -79.28 135.36 36.73 Favored 'General case' 0 C--N 1.278 -2.536 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.719 -177.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.422 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -130.46 -178.89 4.96 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 176.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -71.91 0.38 9.36 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -175.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.3 t70 . . . . . 0 N--CA 1.416 -2.152 0 N-CA-C 105.034 -2.21 . . . . 0.0 105.034 179.422 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.2 p . . . . . 0 N--CA 1.411 -2.421 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -95.29 132.7 40.0 Favored 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.205 177.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.413 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 78.7 m-85 -92.11 -165.43 1.35 Allowed 'General case' 0 N--CA 1.409 -2.505 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.867 -177.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.2 ttt -61.61 136.06 57.87 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -176.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 78.58 -4.99 2.1 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.571 1.149 . . . . 0.0 111.743 -178.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.13 147.72 36.65 Favored Glycine 0 N--CA 1.44 -1.089 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 174.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -63.66 143.71 57.61 Favored 'General case' 0 CA--C 1.484 -1.563 0 C-N-CA 123.25 0.62 . . . . 0.0 112.243 -174.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.7 p -152.9 147.68 26.27 Favored 'General case' 0 C--N 1.279 -2.496 0 C-N-CA 118.544 -1.262 . . . . 0.0 111.192 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -125.79 -23.29 4.02 Favored 'General case' 0 N--CA 1.424 -1.733 0 CA-C-N 114.642 -1.163 . . . . 0.0 108.646 172.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -139.64 165.08 28.21 Favored 'General case' 0 N--CA 1.424 -1.752 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 176.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -71.69 -15.69 62.22 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.232 0.539 . . . . 0.0 110.634 -176.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -65.3 -28.15 69.12 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 114.838 -1.073 . . . . 0.0 110.931 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -73.06 -30.12 63.47 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.206 -176.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 12.2 m -95.77 155.58 16.69 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.773 -176.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 18.3 m -61.67 171.15 1.65 Allowed 'General case' 0 C--N 1.304 -1.372 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.673 174.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -72.05 -42.89 65.75 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-O 121.281 0.562 . . . . 0.0 110.933 -173.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 36.0 m80 -64.03 0.35 0.93 Allowed 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 114.855 -1.066 . . . . 0.0 112.788 175.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.6 mp -128.73 -175.98 3.7 Favored 'General case' 0 N--CA 1.421 -1.916 0 CA-C-O 121.078 0.466 . . . . 0.0 110.616 -178.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -152.28 161.29 29.34 Favored Glycine 0 N--CA 1.418 -2.556 0 N-CA-C 108.918 -1.673 . . . . 0.0 108.918 175.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.3 t -87.6 131.62 34.35 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-N 117.446 0.623 . . . . 0.0 111.136 -178.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -103.1 107.52 18.36 Favored 'General case' 0 CA--C 1.469 -2.148 0 CA-C-O 121.477 0.656 . . . . 0.0 110.259 172.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -74.75 -5.32 42.71 Favored 'General case' 0 C--N 1.293 -1.853 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.627 -177.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -89.03 -29.98 19.06 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.414 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 95.8 mmm -112.65 -9.98 13.69 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 114.791 -1.095 . . . . 0.0 112.589 -177.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp 65.15 28.71 12.15 Favored 'General case' 0 CA--C 1.504 -0.799 0 C-N-CA 124.901 1.28 . . . . 0.0 111.306 -178.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.414 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 1.3 p90 -145.56 162.44 37.45 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-N 114.849 -1.069 . . . . 0.0 111.747 179.357 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 52.3 m -77.24 135.21 38.45 Favored 'General case' 0 C--N 1.287 -2.14 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.589 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -124.67 -178.81 4.26 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 176.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -71.04 -3.92 22.24 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.471 1.285 . . . . 0.0 114.471 -175.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 . . . . . 0 N--CA 1.41 -2.446 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 178.028 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.4 p . . . . . 0 N--CA 1.413 -2.278 0 CA-C-O 121.385 0.612 . . . . 0.0 110.529 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . 0.466 ' HB3' ' HA3' ' A' ' 7' ' ' GLY . 8.6 mpt_? -99.06 137.07 38.12 Favored 'General case' 0 C--N 1.285 -2.223 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.828 176.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.53 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 74.0 m-85 -86.98 -166.99 1.73 Allowed 'General case' 0 N--CA 1.399 -2.991 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.572 174.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 13.0 ttt -60.56 133.62 56.27 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 -175.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 74.99 5.59 4.31 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.618 1.167 . . . . 0.0 112.023 -178.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . 0.466 ' HA3' ' HB3' ' A' ' 3' ' ' ARG . . . -80.03 160.84 44.98 Favored Glycine 0 N--CA 1.442 -0.932 0 N-CA-C 109.22 -1.552 . . . . 0.0 109.22 173.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.43 141.52 45.03 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -174.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.2 p -151.19 155.13 38.21 Favored 'General case' 0 N--CA 1.423 -1.775 0 C-N-CA 119.828 -0.749 . . . . 0.0 111.915 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -119.42 -39.23 2.91 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 124.725 1.21 . . . . 0.0 108.169 172.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.8 pttm -132.36 175.42 9.3 Favored 'General case' 0 N--CA 1.423 -1.785 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -74.84 -17.43 60.6 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 121.1 0.476 . . . . 0.0 110.294 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -69.68 -23.43 63.44 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.333 -177.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -76.81 -25.14 52.94 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 -177.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 39.5 m -91.73 159.66 15.73 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.758 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.511 ' HB2' HD12 ' A' ' 19' ' ' LEU . 69.9 m -67.09 178.66 1.36 Allowed 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.255 176.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -55.23 -61.29 2.43 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-O 121.855 0.836 . . . . 0.0 112.587 -172.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 63.8 m80 -78.93 22.06 0.4 Allowed 'General case' 0 C--N 1.281 -2.372 0 CA-C-N 113.93 -1.486 . . . . 0.0 112.362 -174.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.53 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 61.6 mt -131.49 157.77 42.64 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 120.893 0.378 . . . . 0.0 110.141 -178.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -135.12 152.28 20.75 Favored Glycine 0 N--CA 1.43 -1.761 0 N-CA-C 108.95 -1.66 . . . . 0.0 108.95 177.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.6 t -87.72 123.85 32.96 Favored 'General case' 0 C--N 1.287 -2.129 0 CA-C-N 117.293 0.546 . . . . 0.0 111.174 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 33.5 mmtm -87.16 108.9 19.12 Favored 'General case' 0 CA--C 1.468 -2.188 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.114 172.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? -69.45 -5.0 20.95 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 114.336 -1.302 . . . . 0.0 112.06 -177.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -87.82 -39.49 14.81 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 -176.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 93.1 mmm -113.17 -3.35 13.93 Favored 'General case' 0 N--CA 1.427 -1.582 0 CA-C-N 114.519 -1.219 . . . . 0.0 112.136 -175.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.462 ' HD3' ' HA ' ' A' ' 26' ' ' LYS . 32.6 mmtp 55.11 45.67 25.62 Favored 'General case' 0 C--O 1.248 1.007 0 C-N-CA 124.555 1.142 . . . . 0.0 113.454 -178.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -142.14 162.81 34.54 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.945 176.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 61.4 m -81.76 127.36 32.87 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 115.316 -0.857 . . . . 0.0 111.288 -177.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -118.91 -176.12 3.04 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 106.516 -1.661 . . . . 0.0 106.516 177.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -73.34 -9.95 59.24 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -176.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 . . . . . 0 N--CA 1.425 -1.715 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 176.756 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.9 p . . . . . 0 N--CA 1.418 -2.06 0 CA-C-O 121.937 0.875 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . 0.418 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 28.5 mmt180 -95.07 143.4 26.56 Favored 'General case' 0 C--N 1.27 -2.86 0 CA-C-N 113.939 -1.482 . . . . 0.0 108.369 -177.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.433 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 65.6 m-85 -92.65 -165.71 1.4 Allowed 'General case' 0 N--CA 1.394 -3.23 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.574 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.9 ttt -64.32 138.14 58.28 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -175.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 74.1 6.53 4.76 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.576 1.15 . . . . 0.0 111.815 -179.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -85.96 146.95 21.54 Favored Glycine 0 N--CA 1.436 -1.333 0 N-CA-C 109.819 -1.313 . . . . 0.0 109.819 174.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.418 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 16.2 t70 -67.11 139.92 57.55 Favored 'General case' 0 CA--C 1.495 -1.172 0 C-N-CA 123.694 0.798 . . . . 0.0 112.498 -176.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.568 ' O ' ' HE2' ' A' ' 26' ' ' LYS . 31.3 p -157.63 157.53 33.8 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.409 -177.185 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -113.29 -37.42 4.71 Favored 'General case' 0 CA--C 1.507 -0.678 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 169.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.436 ' HE2' ' HB2' ' A' ' 13' ' ' GLU . 23.9 pttm -126.42 170.2 12.21 Favored 'General case' 0 N--CA 1.418 -2.034 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.01 -176.149 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -73.01 -19.26 61.24 Favored 'General case' 0 CA--C 1.486 -1.514 0 CA-C-O 121.122 0.487 . . . . 0.0 110.053 -176.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.436 ' HB2' ' HE2' ' A' ' 11' ' ' LYS . 47.2 mt-10 -72.44 -24.84 61.27 Favored 'General case' 0 CA--C 1.482 -1.66 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.996 -177.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -71.0 -29.2 65.09 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 -178.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 33.5 m -88.76 162.29 16.31 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.266 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 82.0 m -71.7 178.03 3.82 Favored 'General case' 0 N--CA 1.427 -1.62 0 CA-C-O 121.048 0.451 . . . . 0.0 111.48 176.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -54.84 -59.44 4.72 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.453 1.101 . . . . 0.0 113.926 -169.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 27.1 m170 -81.86 21.85 0.81 Allowed 'General case' 0 C--N 1.285 -2.229 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.076 -173.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.406 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 51.6 mt -125.02 167.92 14.06 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -178.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -140.87 146.2 17.35 Favored Glycine 0 N--CA 1.423 -2.207 0 N-CA-C 108.671 -1.772 . . . . 0.0 108.671 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 47.5 t -88.25 127.32 35.46 Favored 'General case' 0 C--N 1.283 -2.325 0 CA-C-O 121.333 0.587 . . . . 0.0 110.423 -176.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.437 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 56.4 mmtt -93.59 107.95 19.74 Favored 'General case' 0 N--CA 1.413 -2.302 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.0 175.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -72.48 -5.2 35.11 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.023 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -86.23 -37.52 18.54 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.509 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 95.6 mmm -112.86 -9.57 13.64 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.368 -174.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.568 ' HE2' ' O ' ' A' ' 9' ' ' CYS . 13.9 mmmm 66.4 35.04 5.91 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 124.738 1.215 . . . . 0.0 112.275 -179.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.509 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 14.2 p90 -147.18 160.46 42.43 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.879 178.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.433 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 57.1 m -79.78 130.71 35.55 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.308 -178.037 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.32 -175.53 3.02 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -79.4 1.97 23.41 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.321 0.964 . . . . 0.0 112.789 -178.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.0 t70 . . . . . 0 N--CA 1.425 -1.69 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 -177.73 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.4 p . . . . . 0 N--CA 1.419 -2.001 0 CA-C-O 121.633 0.73 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . 0.573 ' HB2' ' SG ' ' A' ' 28' ' ' CYS . 20.6 mmt180 -90.85 132.16 36.06 Favored 'General case' 0 C--N 1.28 -2.456 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 178.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.456 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 48.0 m-85 -84.93 -165.66 1.26 Allowed 'General case' 0 N--CA 1.397 -3.1 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 172.144 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.7 ttt -66.39 137.53 56.94 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -175.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 77.47 1.09 2.98 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.74 1.216 . . . . 0.0 111.436 -178.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.18 136.27 16.5 Favored Glycine 0 N--CA 1.429 -1.768 0 N-CA-C 108.877 -1.689 . . . . 0.0 108.877 174.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -60.0 140.49 56.74 Favored 'General case' 0 CA--C 1.492 -1.26 0 C-N-CA 123.266 0.627 . . . . 0.0 112.588 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.485 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 19.2 p -141.51 154.95 45.81 Favored 'General case' 0 N--CA 1.416 -2.174 0 C-N-CA 119.585 -0.846 . . . . 0.0 111.249 -176.152 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -118.14 -39.64 3.04 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 175.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.9 pttm -135.23 172.9 12.35 Favored 'General case' 0 N--CA 1.422 -1.872 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.099 -178.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -75.6 -16.13 60.26 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-O 121.022 0.439 . . . . 0.0 111.025 -176.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -70.37 -24.07 62.89 Favored 'General case' 0 CA--C 1.489 -1.4 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.486 -178.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -72.23 -31.55 65.93 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -178.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 17.3 m -89.28 155.08 19.61 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.504 -176.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.432 ' HB2' HD12 ' A' ' 19' ' ' LEU . 43.9 m -67.01 178.03 1.53 Allowed 'General case' 0 C--N 1.302 -1.466 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.562 177.457 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -63.07 -55.12 28.17 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -171.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -74.09 11.48 0.91 Allowed 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.945 -178.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.556 HD23 ' HA ' ' A' ' 30' ' ' TRP . 62.2 mt -128.21 -179.42 5.0 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 -177.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -161.5 165.36 35.52 Favored Glycine 0 N--CA 1.418 -2.554 0 N-CA-C 108.936 -1.666 . . . . 0.0 108.936 177.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.3 t -92.51 124.83 36.84 Favored 'General case' 0 C--N 1.289 -2.052 0 CA-C-O 121.343 0.592 . . . . 0.0 110.31 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.452 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 30.1 mmtp -99.86 112.29 24.56 Favored 'General case' 0 C--N 1.287 -2.124 0 CA-C-O 121.103 0.477 . . . . 0.0 110.374 173.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.9 mpt_? -73.11 -10.84 60.21 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 114.357 -1.292 . . . . 0.0 111.109 -177.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -85.26 -30.21 23.99 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -177.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 80.8 mmm -111.22 -10.69 14.27 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 114.407 -1.27 . . . . 0.0 110.856 -173.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.56 ' HD2' ' N ' ' A' ' 26' ' ' LYS . 9.6 mptt 62.1 26.1 15.68 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 125.816 1.646 . . . . 0.0 110.864 179.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -142.59 165.97 25.95 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.605 179.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.573 ' SG ' ' HB2' ' A' ' 3' ' ' ARG . 63.1 m -81.38 131.28 35.28 Favored 'General case' 0 N--CA 1.414 -2.253 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.37 -179.163 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.404 ' C ' ' H ' ' A' ' 31' ' ' ASP . . . -118.55 -175.82 2.96 Favored 'General case' 0 C--N 1.283 -2.308 0 N-CA-C 105.583 -2.006 . . . . 0.0 105.583 176.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.556 ' HA ' HD23 ' A' ' 19' ' ' LEU . 98.5 m95 -80.87 19.52 0.85 Allowed 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 119.303 0.956 . . . . 0.0 110.349 178.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.404 ' H ' ' C ' ' A' ' 29' ' ' ALA . 36.1 t70 . . . . . 0 N--CA 1.401 -2.878 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.387 -170.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.3 p . . . . . 0 N--CA 1.43 -1.46 0 CA-C-O 121.818 0.818 . . . . 0.0 111.796 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 39.5 mmt180 -86.92 133.95 33.56 Favored 'General case' 0 C--N 1.282 -2.332 0 CA-C-N 114.3 -1.318 . . . . 0.0 110.079 178.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.416 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 25.0 m-85 -84.71 -166.6 1.52 Allowed 'General case' 0 N--CA 1.399 -3.008 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.156 174.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.473 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 11.3 ttt -65.74 138.8 58.19 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 -176.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 77.03 2.6 3.27 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.205 1.402 . . . . 0.0 111.832 -179.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -82.62 146.69 24.75 Favored Glycine 0 N--CA 1.435 -1.427 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 175.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.417 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 14.5 t70 -64.3 145.14 56.5 Favored 'General case' 0 CA--C 1.492 -1.251 0 C-N-CA 123.106 0.562 . . . . 0.0 112.207 -178.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.423 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 31.0 p -152.59 149.24 28.26 Favored 'General case' 0 N--CA 1.417 -2.094 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.145 -178.112 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -113.21 -23.73 9.79 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 173.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.8 pttm -145.67 172.25 13.55 Favored 'General case' 0 N--CA 1.423 -1.816 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 179.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -74.2 -16.71 60.96 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 121.337 0.589 . . . . 0.0 110.143 -177.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -73.15 -22.36 60.53 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.393 -178.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -77.02 -24.98 52.08 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 -179.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.8 m -89.94 161.62 15.82 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 115.157 -0.928 . . . . 0.0 109.034 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.417 ' HB2' HD12 ' A' ' 19' ' ' LEU . 56.4 m -70.38 178.42 2.91 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.517 174.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -61.55 -51.01 70.36 Favored 'General case' 0 CA--C 1.498 -1.019 0 CA-C-O 121.542 0.687 . . . . 0.0 112.799 -171.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 38.4 m-70 -76.55 14.06 0.86 Allowed 'General case' 0 C--N 1.283 -2.298 0 CA-C-N 114.658 -1.155 . . . . 0.0 112.417 -176.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.417 HD12 ' HB2' ' A' ' 16' ' ' CYS . 46.7 mt -128.93 153.2 47.74 Favored 'General case' 0 N--CA 1.433 -1.318 0 CA-C-O 121.151 0.5 . . . . 0.0 110.207 -175.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -131.16 145.77 17.25 Favored Glycine 0 N--CA 1.426 -1.992 0 N-CA-C 108.814 -1.714 . . . . 0.0 108.814 177.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 39.0 t -84.81 111.88 20.02 Favored 'General case' 0 C--N 1.284 -2.248 0 CA-C-N 116.96 0.38 . . . . 0.0 111.231 -175.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.437 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 71.3 mmtt -72.53 113.34 9.45 Favored 'General case' 0 CA--C 1.482 -1.66 0 O-C-N 121.301 -0.874 . . . . 0.0 108.667 177.119 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.6 mmt180 -69.38 -12.74 61.91 Favored 'General case' 0 C--N 1.315 -0.897 0 O-C-N 124.49 1.119 . . . . 0.0 109.896 -178.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -89.59 -29.93 18.52 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-O 122.093 0.949 . . . . 0.0 109.378 -175.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.577 ' HB3' ' CD1' ' A' ' 27' ' ' TYR . 23.3 mmt -111.81 -16.28 13.2 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.268 -173.08 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 66.44 33.7 6.69 Favored 'General case' 0 CA--C 1.499 -1.015 0 C-N-CA 124.372 1.069 . . . . 0.0 110.119 -178.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.577 ' CD1' ' HB3' ' A' ' 25' ' ' MET . 4.0 p90 -143.45 158.29 43.76 Favored 'General case' 0 CA--C 1.489 -1.369 0 CA-C-N 114.511 -1.222 . . . . 0.0 112.55 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.468 ' O ' ' HA ' ' A' ' 5' ' ' MET . 77.0 m -78.86 123.84 27.63 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.963 -178.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.473 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -119.61 -172.39 2.32 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 177.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -78.55 1.15 23.44 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 119.155 0.889 . . . . 0.0 112.915 -176.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.437 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 19.5 t70 . . . . . 0 N--CA 1.434 -1.269 0 C-N-CA 125.158 1.383 . . . . 0.0 107.914 177.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 6.2 p . . . . . 0 N--CA 1.424 -1.769 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . 0.45 ' HD2' ' HA3' ' A' ' 7' ' ' GLY . 16.4 tpp180 -92.26 124.98 36.73 Favored 'General case' 0 C--N 1.272 -2.761 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -88.39 -167.36 1.86 Allowed 'General case' 0 N--CA 1.412 -2.363 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.707 -177.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 13.3 ttt -64.23 139.16 58.74 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.704 -173.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 74.28 8.6 4.56 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.934 1.294 . . . . 0.0 111.674 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . 0.45 ' HA3' ' HD2' ' A' ' 3' ' ' ARG . . . -95.06 145.07 17.56 Favored Glycine 0 N--CA 1.419 -2.498 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 175.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.485 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 20.9 t70 -64.78 143.66 57.78 Favored 'General case' 0 CA--C 1.493 -1.248 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -176.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 23.9 p -150.51 149.69 30.29 Favored 'General case' 0 N--CA 1.417 -2.11 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.872 -177.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -112.14 -35.52 5.62 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 175.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.9 pttp -134.34 162.33 32.5 Favored 'General case' 0 N--CA 1.42 -1.95 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.16 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -64.14 -18.68 64.68 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-O 121.04 0.447 . . . . 0.0 111.946 -178.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -71.48 -21.96 61.87 Favored 'General case' 0 CA--C 1.493 -1.245 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.953 -177.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -75.24 -30.8 60.64 Favored 'General case' 0 N--CA 1.42 -1.928 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.971 -178.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 20.7 m -90.22 155.46 18.99 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.042 -178.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.498 ' HB2' HD13 ' A' ' 19' ' ' LEU . 32.5 m -61.41 176.97 0.42 Allowed 'General case' 0 C--N 1.298 -1.651 0 C-N-CA 124.515 1.126 . . . . 0.0 112.942 176.213 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.1 mttp -66.36 -48.48 70.06 Favored 'General case' 0 CA--C 1.496 -1.098 0 CA-C-O 122.377 1.084 . . . . 0.0 109.902 -175.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -68.14 -1.39 5.91 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 113.597 -1.638 . . . . 0.0 112.708 -178.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.498 HD13 ' HB2' ' A' ' 16' ' ' CYS . 5.8 mp -130.51 176.5 8.11 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-O 121.251 0.548 . . . . 0.0 111.473 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.73 160.77 28.01 Favored Glycine 0 N--CA 1.419 -2.468 0 N-CA-C 108.506 -1.837 . . . . 0.0 108.506 177.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.4 t -93.7 120.58 34.15 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 117.351 0.576 . . . . 0.0 110.412 -177.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.415 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 73.8 mmtt -85.15 108.72 17.83 Favored 'General case' 0 CA--C 1.455 -2.687 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 173.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.538 ' H ' ' HD2' ' A' ' 23' ' ' ARG . 1.3 mpt_? -79.68 -8.08 58.99 Favored 'General case' 0 C--N 1.282 -2.328 0 CA-C-N 114.991 -1.004 . . . . 0.0 108.64 -174.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -90.01 -27.77 19.53 Favored 'General case' 0 CA--C 1.501 -0.918 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.128 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.589 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 90.5 mmm -109.64 -19.06 13.32 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.655 -172.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.485 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 71.8 mmtt 72.84 29.64 1.85 Allowed 'General case' 0 CA--C 1.497 -1.088 0 C-N-CA 125.555 1.542 . . . . 0.0 111.568 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.589 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 27.4 p90 -147.89 158.68 44.16 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.875 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.2 m -77.44 130.8 37.51 Favored 'General case' 0 C--N 1.291 -1.97 0 CA-C-N 114.676 -1.147 . . . . 0.0 110.51 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -122.73 -178.18 3.86 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 177.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -76.05 8.2 3.42 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.307 0.958 . . . . 0.0 113.072 -176.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.415 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 3.8 p30 . . . . . 0 N--CA 1.409 -2.501 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.5 p . . . . . 0 N--CA 1.423 -1.782 0 CA-C-O 121.003 0.43 . . . . 0.0 110.361 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . 0.453 ' HB3' ' HA3' ' A' ' 7' ' ' GLY . 9.0 mpt_? -83.83 131.47 34.88 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.882 178.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.486 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 79.1 m-85 -89.79 -163.06 0.95 Allowed 'General case' 0 N--CA 1.391 -3.377 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.2 ttt -66.56 134.0 51.48 Favored 'General case' 0 C--N 1.299 -1.587 0 C-N-CA 120.279 -0.568 . . . . 0.0 109.934 -173.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 76.57 6.48 3.43 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 124.955 1.302 . . . . 0.0 111.966 -178.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . 0.453 ' HA3' ' HB3' ' A' ' 3' ' ' ARG . . . -79.02 156.37 41.84 Favored Glycine 0 N--CA 1.443 -0.839 0 N-CA-C 108.047 -2.021 . . . . 0.0 108.047 172.038 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -88.36 140.2 29.71 Favored 'General case' 0 CA--C 1.476 -1.875 0 CA-C-N 118.256 1.028 . . . . 0.0 110.733 -172.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.9 p -144.04 147.22 33.54 Favored 'General case' 0 C--N 1.272 -2.797 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.984 -175.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -110.34 -30.0 7.88 Favored 'General case' 0 C--N 1.293 -1.89 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 177.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.509 ' HD2' ' OE1' ' A' ' 13' ' ' GLU . 17.2 pttp -139.43 167.18 22.66 Favored 'General case' 0 N--CA 1.426 -1.649 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -70.73 -18.17 62.8 Favored 'General case' 0 CA--C 1.493 -1.212 0 CA-C-O 121.121 0.486 . . . . 0.0 110.911 -174.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.509 ' OE1' ' HD2' ' A' ' 11' ' ' LYS . 36.4 mt-10 -70.88 -19.13 62.65 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.119 -176.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -79.84 -24.73 41.11 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-N 115.065 -0.97 . . . . 0.0 109.314 -176.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 35.0 m -92.83 159.71 15.26 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.425 ' HB2' HD13 ' A' ' 19' ' ' LEU . 38.3 m -64.33 174.06 1.8 Allowed 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.536 177.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.6 mtpt -75.99 -33.4 59.72 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 121.655 0.741 . . . . 0.0 110.978 -171.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 36.3 m80 -81.8 6.57 15.15 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.208 178.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.425 HD13 ' HB2' ' A' ' 16' ' ' CYS . 5.2 mp -131.84 -180.0 5.73 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-O 121.066 0.46 . . . . 0.0 110.797 -178.69 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -148.03 163.04 28.86 Favored Glycine 0 N--CA 1.424 -2.115 0 N-CA-C 109.661 -1.376 . . . . 0.0 109.661 177.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.1 t -95.96 120.34 36.07 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 117.304 0.552 . . . . 0.0 109.714 -178.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.457 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 73.1 mmtt -81.62 107.28 14.24 Favored 'General case' 0 CA--C 1.453 -2.774 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 172.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.464 ' H ' ' HD2' ' A' ' 23' ' ' ARG . 2.1 mpt_? -75.56 -3.16 32.65 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.411 -173.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -90.44 -31.68 16.72 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-O 122.198 0.999 . . . . 0.0 109.081 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 87.9 mmm -111.86 -9.9 14.03 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.964 -175.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp 63.71 36.69 10.53 Favored 'General case' 0 CA--C 1.503 -0.843 0 C-N-CA 124.455 1.102 . . . . 0.0 111.852 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -143.07 159.04 43.01 Favored 'General case' 0 CA--C 1.486 -1.505 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.438 177.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.486 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 39.2 m -82.03 130.28 35.03 Favored 'General case' 0 C--N 1.284 -2.264 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.988 -176.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -121.31 -175.47 3.08 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 106.025 -1.843 . . . . 0.0 106.025 176.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -79.8 10.97 3.54 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 119.588 1.085 . . . . 0.0 113.115 -175.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 N--CA 1.415 -2.18 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 178.725 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.6 p . . . . . 0 N--CA 1.413 -2.295 0 CA-C-O 122.031 0.92 . . . . 0.0 112.237 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -91.15 136.82 32.82 Favored 'General case' 0 C--N 1.279 -2.498 0 CA-C-N 113.964 -1.471 . . . . 0.0 108.609 177.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.426 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 51.2 m-85 -85.19 -167.55 1.88 Allowed 'General case' 0 N--CA 1.401 -2.923 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.087 178.077 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 12.6 ttt -66.54 136.51 55.75 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 -175.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 76.46 9.58 3.06 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 124.99 1.316 . . . . 0.0 111.765 -178.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . 0.417 ' O ' ' HA ' ' A' ' 27' ' ' TYR . . . -88.14 145.45 19.16 Favored Glycine 0 N--CA 1.44 -1.08 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 173.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.555 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 15.3 t70 -60.91 143.02 55.83 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.704 0.802 . . . . 0.0 112.258 -177.373 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 21.1 p -153.75 148.92 26.91 Favored 'General case' 0 C--N 1.311 -1.092 0 C-N-CA 119.226 -0.99 . . . . 0.0 113.374 -177.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -106.02 -38.53 6.28 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 173.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.579 ' HG2' ' OD1' ' A' ' 14' ' ' ASP . 5.0 ptpp? -137.37 177.21 8.04 Favored 'General case' 0 N--CA 1.414 -2.258 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -175.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -74.54 -18.12 60.64 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-O 121.163 0.506 . . . . 0.0 111.038 -175.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.485 ' H ' ' HG3' ' A' ' 11' ' ' LYS . 12.0 mm-40 -72.98 -21.58 60.82 Favored 'General case' 0 CA--C 1.495 -1.141 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.919 -178.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.579 ' OD1' ' HG2' ' A' ' 11' ' ' LYS . 31.0 m-20 -72.99 -27.61 61.9 Favored 'General case' 0 N--CA 1.431 -1.391 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.0 m -92.6 164.32 13.47 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.893 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.41 ' HB2' HD12 ' A' ' 19' ' ' LEU . 62.4 m -70.57 176.51 4.05 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.93 175.121 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -68.91 -49.9 54.16 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-O 121.542 0.687 . . . . 0.0 112.089 -170.133 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 55.9 m80 -76.94 15.67 0.65 Allowed 'General case' 0 C--N 1.287 -2.122 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.385 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.426 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 87.0 mt -122.08 174.68 6.79 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.88 144.09 11.56 Favored Glycine 0 C--N 1.306 -1.09 0 N-CA-C 110.221 -1.152 . . . . 0.0 110.221 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 39.2 t -90.23 123.02 33.68 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -174.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 41.2 mmtt -90.13 110.8 21.8 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.786 -0.571 . . . . 0.0 110.106 168.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -76.26 -12.79 60.14 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.79 -177.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -87.88 -26.28 22.83 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 -178.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.549 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 91.9 mmm -108.0 -16.2 14.35 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 114.721 -1.127 . . . . 0.0 110.687 -173.529 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.555 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 32.2 mmmt 66.29 33.04 7.4 Favored 'General case' 0 CA--C 1.492 -1.28 0 C-N-CA 124.574 1.15 . . . . 0.0 112.31 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.549 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 11.4 p90 -150.05 159.26 44.54 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.925 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.7 m -82.33 130.85 35.19 Favored 'General case' 0 C--N 1.289 -2.057 0 CA-C-N 113.806 -1.543 . . . . 0.0 110.469 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -115.84 -172.27 2.13 Favored 'General case' 0 C--N 1.291 -1.939 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 175.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -76.52 -19.18 58.23 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.65 1.114 . . . . 0.0 111.056 178.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 46.2 t0 . . . . . 0 C--N 1.282 -2.358 0 N-CA-C 103.873 -2.64 . . . . 0.0 103.873 177.881 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.1 p . . . . . 0 N--CA 1.431 -1.419 0 CA-C-O 121.574 0.702 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -92.29 140.73 29.3 Favored 'General case' 0 C--N 1.273 -2.721 0 CA-C-N 114.744 -1.117 . . . . 0.0 109.966 -178.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.49 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 60.2 m-85 -93.23 -165.9 1.42 Allowed 'General case' 0 N--CA 1.396 -3.16 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.919 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.514 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 10.7 ttt -62.81 135.04 57.13 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 -176.121 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 76.8 3.99 3.41 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 125.452 1.501 . . . . 0.0 111.753 -178.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.39 149.21 38.44 Favored Glycine 0 N--CA 1.439 -1.101 0 N-CA-C 108.428 -1.869 . . . . 0.0 108.428 171.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -76.63 146.34 38.27 Favored 'General case' 0 CA--C 1.483 -1.602 0 CA-C-N 117.258 0.529 . . . . 0.0 110.073 -174.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.3 p -146.02 150.7 36.48 Favored 'General case' 0 C--N 1.278 -2.505 0 C-N-CA 118.556 -1.258 . . . . 0.0 112.368 -176.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -108.16 -43.76 4.31 Favored 'General case' 0 N--CA 1.433 -1.319 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 173.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.547 ' HD2' ' OE1' ' A' ' 13' ' ' GLU . 46.1 pttt -131.2 169.91 15.29 Favored 'General case' 0 N--CA 1.419 -1.991 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.152 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -68.06 -18.76 64.77 Favored 'General case' 0 CA--C 1.491 -1.327 0 CA-C-O 121.093 0.473 . . . . 0.0 110.864 -179.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.547 ' OE1' ' HD2' ' A' ' 11' ' ' LYS . 1.2 mp0 -67.15 -24.7 65.92 Favored 'General case' 0 CA--C 1.492 -1.253 0 CA-C-N 115.084 -0.962 . . . . 0.0 111.027 -179.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -72.19 -26.62 62.13 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 121.419 0.628 . . . . 0.0 109.634 -178.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 18.4 m -93.49 159.19 15.35 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.793 -178.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.425 ' HB2' HD12 ' A' ' 19' ' ' LEU . 63.9 m -67.08 176.0 2.33 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.727 174.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -58.74 -57.12 14.43 Favored 'General case' 0 CA--C 1.504 -0.801 0 C-N-CA 123.909 0.884 . . . . 0.0 113.079 -171.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 28.9 m80 -79.08 15.01 1.23 Allowed 'General case' 0 C--N 1.283 -2.304 0 CA-C-N 114.928 -1.033 . . . . 0.0 112.017 -174.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.49 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 68.1 mt -123.6 169.05 11.84 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.8 154.19 25.7 Favored Glycine 0 N--CA 1.418 -2.557 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 178.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.4 t -89.24 108.93 19.89 Favored 'General case' 0 C--N 1.285 -2.223 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -177.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.415 ' HE2' ' HB3' ' A' ' 29' ' ' ALA . 72.8 mmtt -70.88 112.94 7.45 Favored 'General case' 0 CA--C 1.473 -2.013 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 176.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -74.45 -8.43 56.27 Favored 'General case' 0 C--N 1.292 -1.933 0 O-C-N 124.748 1.28 . . . . 0.0 110.119 -176.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -88.97 -36.35 15.91 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 -176.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.446 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 96.9 mmm -112.74 -12.85 13.3 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 114.43 -1.259 . . . . 0.0 112.931 -171.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp 66.95 38.08 3.7 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 125.006 1.322 . . . . 0.0 111.542 -179.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.446 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 8.0 p90 -145.53 161.45 39.74 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.375 -0.83 . . . . 0.0 112.114 178.131 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 59.2 m -81.3 128.6 33.99 Favored 'General case' 0 N--CA 1.419 -1.992 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.452 -176.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.514 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -124.67 -171.65 2.4 Favored 'General case' 0 C--N 1.284 -2.245 0 N-CA-C 106.292 -1.744 . . . . 0.0 106.292 175.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -75.31 3.01 9.75 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 118.767 0.712 . . . . 0.0 112.748 -178.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.3 p30 . . . . . 0 N--CA 1.416 -2.154 0 N-CA-C 106.65 -1.611 . . . . 0.0 106.65 175.752 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.4 p . . . . . 0 N--CA 1.423 -1.779 0 CA-C-O 121.306 0.574 . . . . 0.0 110.558 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . 0.552 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 39.0 mmt180 -102.58 135.39 44.31 Favored 'General case' 0 C--N 1.291 -1.959 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.501 -179.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.539 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 87.5 m-85 -95.23 -161.77 0.89 Allowed 'General case' 0 N--CA 1.403 -2.777 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 174.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.59 ' HA ' ' O ' ' A' ' 28' ' ' CYS . 49.4 ttm -62.72 135.87 57.58 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 82.13 -8.82 1.24 Allowed 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 125.069 1.348 . . . . 0.0 112.115 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . 0.426 ' HA3' ' HB3' ' A' ' 3' ' ' ARG . . . -76.8 139.65 23.91 Favored Glycine 0 N--CA 1.434 -1.44 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 176.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.552 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 17.2 t70 -69.54 141.12 53.9 Favored 'General case' 0 CA--C 1.487 -1.476 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -173.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.489 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 23.4 p -143.42 152.77 41.95 Favored 'General case' 0 N--CA 1.414 -2.235 0 C-N-CA 119.783 -0.767 . . . . 0.0 111.51 -176.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -113.59 -35.72 5.14 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 174.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 45.7 pttt -141.57 177.52 8.08 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 124.45 1.1 . . . . 0.0 108.36 179.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -73.63 -16.07 61.24 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 122.227 -0.296 . . . . 0.0 111.197 -175.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -67.87 -25.24 65.42 Favored 'General case' 0 CA--C 1.496 -1.134 0 CA-C-O 121.656 0.741 . . . . 0.0 110.497 179.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -68.7 -31.78 71.12 Favored 'General case' 0 N--CA 1.425 -1.677 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.121 -179.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.9 m -86.82 159.19 19.17 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.257 -176.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.9 m -66.14 178.47 1.14 Allowed 'General case' 0 C--N 1.307 -1.283 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.288 174.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -61.46 -52.31 65.05 Favored 'General case' 0 CA--C 1.485 -1.552 0 CA-C-O 121.701 0.762 . . . . 0.0 112.246 -171.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 30.3 m-70 -74.52 3.92 6.89 Favored 'General case' 0 C--N 1.28 -2.427 0 CA-C-N 114.204 -1.362 . . . . 0.0 113.35 -175.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.0 mp -123.93 167.94 13.46 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.571 0.701 . . . . 0.0 112.781 -177.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -135.5 159.96 24.31 Favored Glycine 0 N--CA 1.433 -1.558 0 N-CA-C 109.157 -1.577 . . . . 0.0 109.157 179.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 32.1 t -94.35 130.65 40.59 Favored 'General case' 0 C--N 1.285 -2.221 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -174.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.436 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 58.9 mmtt -96.95 107.21 19.69 Favored 'General case' 0 CA--C 1.474 -1.952 0 CA-C-O 121.351 0.596 . . . . 0.0 110.731 172.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -72.22 -12.04 60.99 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 114.563 -1.198 . . . . 0.0 111.837 -176.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -89.32 -26.68 20.98 Favored 'General case' 0 C--N 1.302 -1.5 0 CA-C-O 121.972 0.891 . . . . 0.0 108.858 -176.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.479 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 97.5 mmm -112.1 -8.6 14.01 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.19 -176.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm 63.45 28.75 15.48 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.846 1.258 . . . . 0.0 112.642 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.479 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 8.7 p90 -143.71 161.06 39.55 Favored 'General case' 0 C--N 1.286 -2.179 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.662 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.59 ' O ' ' HA ' ' A' ' 5' ' ' MET . 66.6 m -81.14 140.17 35.17 Favored 'General case' 0 C--N 1.285 -2.213 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.666 -179.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -131.52 178.53 6.66 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 105.499 -2.037 . . . . 0.0 105.499 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -68.56 -12.16 60.91 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 119.935 1.243 . . . . 0.0 113.801 -175.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 34.6 t70 . . . . . 0 N--CA 1.415 -2.194 0 CA-C-O 121.335 0.588 . . . . 0.0 109.76 -179.671 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 20.9 p . . . . . 0 N--CA 1.405 -2.709 0 CA-C-O 121.629 0.728 . . . . 0.0 110.835 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -86.06 129.86 34.71 Favored 'General case' 0 C--N 1.273 -2.728 0 CA-C-N 114.357 -1.292 . . . . 0.0 108.717 -178.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -86.55 -168.31 2.19 Favored 'General case' 0 N--CA 1.408 -2.544 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.062 178.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.461 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 12.8 ttt -69.56 140.08 53.8 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 120.828 0.347 . . . . 0.0 111.16 -172.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 74.48 -2.37 2.83 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.745 1.618 . . . . 0.0 112.253 -179.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.17 148.64 30.02 Favored Glycine 0 N--CA 1.422 -2.236 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 176.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -63.13 139.76 58.8 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 123.774 0.83 . . . . 0.0 112.636 -177.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.438 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 23.5 p -146.0 153.9 41.28 Favored 'General case' 0 C--N 1.287 -2.109 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.452 -178.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -112.47 -36.27 5.3 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 177.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -145.54 167.56 22.73 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 114.159 -1.382 . . . . 0.0 108.475 -179.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -67.72 -18.48 64.92 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.23 0.538 . . . . 0.0 111.509 -176.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -66.01 -27.26 67.99 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.853 -178.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -79.24 -27.2 42.41 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.56 -175.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.6 m -88.65 163.49 15.77 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.417 -178.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.472 ' HB2' HD13 ' A' ' 19' ' ' LEU . 31.4 m -69.37 172.03 7.74 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.113 175.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -66.18 -47.15 74.91 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.568 0.699 . . . . 0.0 112.027 -172.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 51.4 m80 -72.02 1.79 6.74 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.719 179.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.472 HD13 ' HB2' ' A' ' 16' ' ' CYS . 5.3 mp -117.65 178.47 4.38 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-O 121.093 0.473 . . . . 0.0 111.256 179.045 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -151.09 151.93 23.83 Favored Glycine 0 N--CA 1.423 -2.179 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 177.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 38.0 t -93.26 116.56 29.12 Favored 'General case' 0 C--N 1.27 -2.872 0 CA-C-N 117.014 0.407 . . . . 0.0 110.251 -175.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -77.33 110.52 12.13 Favored 'General case' 0 CA--C 1.461 -2.45 0 N-CA-C 106.565 -1.643 . . . . 0.0 106.565 172.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.523 ' H ' ' HD2' ' A' ' 23' ' ' ARG . 1.1 mpt_? -76.8 -13.25 60.03 Favored 'General case' 0 C--N 1.286 -2.18 0 O-C-N 123.884 0.74 . . . . 0.0 109.22 -173.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -90.74 -24.71 20.3 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 122.181 0.991 . . . . 0.0 109.21 -177.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.578 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 96.8 mmm -110.0 -7.06 15.0 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.229 -175.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.499 ' HD2' ' N ' ' A' ' 26' ' ' LYS . 3.4 mptp? 61.92 26.28 15.87 Favored 'General case' 0 CA--C 1.505 -0.769 0 C-N-CA 125.271 1.428 . . . . 0.0 111.769 177.09 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.578 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 23.1 p90 -140.42 158.88 43.34 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.788 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.438 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 59.5 m -81.69 131.7 35.27 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.111 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.461 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -124.14 -174.17 2.94 Favored 'General case' 0 C--N 1.288 -2.102 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 176.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -76.61 -1.83 29.55 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 120.248 1.386 . . . . 0.0 113.203 -176.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 . . . . . 0 N--CA 1.417 -2.107 0 N-CA-C 106.439 -1.689 . . . . 0.0 106.439 179.053 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.6 p . . . . . 0 CA--C 1.494 -1.188 0 CA-C-O 121.63 0.728 . . . . 0.0 111.319 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -93.47 132.8 37.4 Favored 'General case' 0 C--N 1.278 -2.528 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.679 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.517 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 53.6 m-85 -85.05 -170.79 3.3 Favored 'General case' 0 N--CA 1.398 -3.05 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.579 176.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.3 ttt -62.97 134.09 55.63 Favored 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 -178.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 81.65 2.44 1.47 Allowed 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 125.067 1.347 . . . . 0.0 112.139 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -86.45 146.6 20.96 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 174.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.454 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 28.4 t70 -65.96 142.77 57.75 Favored 'General case' 0 CA--C 1.493 -1.222 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -175.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 26.8 p -150.99 154.72 37.61 Favored 'General case' 0 C--N 1.291 -1.954 0 C-N-CA 120.103 -0.639 . . . . 0.0 111.202 -177.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -115.12 -36.6 4.34 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.0 pttm -138.55 175.58 9.44 Favored 'General case' 0 N--CA 1.427 -1.613 0 CA-C-N 115.222 -0.899 . . . . 0.0 108.612 177.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -72.04 -16.75 62.05 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 120.512 0.196 . . . . 0.0 111.42 -174.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -61.65 -36.99 82.38 Favored 'General case' 0 CA--C 1.502 -0.888 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 179.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -63.2 -32.48 73.88 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.604 -177.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.0 m -88.59 159.18 18.01 Favored 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.316 -177.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.492 ' HB2' HD12 ' A' ' 19' ' ' LEU . 58.5 m -66.83 176.88 1.85 Allowed 'General case' 0 C--N 1.303 -1.416 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.55 175.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.5 ' HA ' ' HE2' ' A' ' 17' ' ' LYS . 10.3 mmpt? -64.47 -52.6 57.1 Favored 'General case' 0 CA--C 1.502 -0.895 0 CA-C-O 121.192 0.52 . . . . 0.0 111.889 -171.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -72.9 9.95 1.02 Allowed 'General case' 0 C--N 1.297 -1.679 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.504 -178.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.517 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 64.8 mt -125.01 177.12 6.23 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 -175.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -151.26 166.57 30.6 Favored Glycine 0 N--CA 1.434 -1.488 0 N-CA-C 108.64 -1.784 . . . . 0.0 108.64 176.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -99.46 129.5 45.64 Favored 'General case' 0 C--N 1.288 -2.069 0 CA-C-N 118.125 0.962 . . . . 0.0 112.064 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.6 mmmt -96.53 107.53 19.96 Favored 'General case' 0 CA--C 1.473 -1.997 0 CA-C-O 121.255 0.55 . . . . 0.0 111.0 173.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -69.1 -15.3 63.4 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 114.208 -1.36 . . . . 0.0 113.169 -175.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -89.33 -27.59 20.41 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.897 0.856 . . . . 0.0 109.177 -177.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.417 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 74.7 mmm -109.54 -10.97 14.84 Favored 'General case' 0 N--CA 1.426 -1.666 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.838 -172.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.454 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 71.1 mmtt 63.61 30.22 15.01 Favored 'General case' 0 CA--C 1.5 -0.958 0 C-N-CA 124.75 1.22 . . . . 0.0 111.194 -178.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.417 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 4.9 p90 -145.35 159.43 43.07 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.301 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 72.0 m -76.68 134.7 39.18 Favored 'General case' 0 C--N 1.287 -2.125 0 CA-C-N 114.519 -1.219 . . . . 0.0 111.473 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -122.09 -167.59 1.57 Allowed 'General case' 0 C--N 1.296 -1.717 0 N-CA-C 105.731 -1.951 . . . . 0.0 105.731 177.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -81.66 -6.14 58.73 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 119.691 1.132 . . . . 0.0 112.723 -176.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.9 t70 . . . . . 0 N--CA 1.405 -2.693 0 N-CA-C 103.821 -2.659 . . . . 0.0 103.821 178.747 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 . . . . . 0 CA--C 1.496 -1.108 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 26.7 p -80.38 164.62 22.96 Favored 'General case' 0 N--CA 1.433 -1.307 0 CA-C-O 121.946 0.879 . . . . 0.0 112.659 -177.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.6 mpp_? -103.17 134.67 46.2 Favored 'General case' 0 C--N 1.285 -2.196 0 CA-C-N 114.107 -1.406 . . . . 0.0 109.83 177.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.437 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 89.7 m-85 -91.38 -162.03 0.88 Allowed 'General case' 0 N--CA 1.404 -2.742 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.477 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 6.8 ttt -65.8 136.72 56.57 Favored 'General case' 0 C--N 1.32 -0.688 0 O-C-N 122.295 -0.253 . . . . 0.0 110.91 -171.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 79.52 2.68 2.22 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.061 1.344 . . . . 0.0 111.997 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -87.44 144.88 19.32 Favored Glycine 0 N--CA 1.438 -1.203 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 174.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.506 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 19.3 t70 -61.93 148.07 44.81 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.244 0.618 . . . . 0.0 112.598 -176.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.409 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 30.5 p -152.4 146.63 25.47 Favored 'General case' 0 N--CA 1.423 -1.81 0 C-N-CA 120.097 -0.641 . . . . 0.0 111.786 -179.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -101.95 -44.27 5.54 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 106.726 -1.583 . . . . 0.0 106.726 172.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.57 ' HG2' ' OD1' ' A' ' 14' ' ' ASP . 4.4 ptpp? -134.52 177.47 7.75 Favored 'General case' 0 N--CA 1.409 -2.523 0 CA-C-N 113.752 -1.567 . . . . 0.0 107.549 -176.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -74.53 -19.76 60.23 Favored 'General case' 0 C--N 1.29 -2.014 0 CA-C-O 121.154 0.502 . . . . 0.0 110.959 -175.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.458 ' H ' ' HG3' ' A' ' 11' ' ' LYS . 9.8 tp10 -69.24 -23.52 63.88 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.849 -177.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.57 ' OD1' ' HG2' ' A' ' 11' ' ' LYS . 40.0 m-20 -74.78 -29.89 61.27 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-O 121.758 0.789 . . . . 0.0 109.157 -178.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.1 m -87.33 163.32 16.88 Favored 'General case' 0 N--CA 1.426 -1.658 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.226 178.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 m -69.97 169.25 13.65 Favored 'General case' 0 N--CA 1.419 -2.003 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 173.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -87.81 -0.19 56.62 Favored 'General case' 0 C--N 1.287 -2.152 0 CA-C-O 122.728 1.252 . . . . 0.0 111.384 -170.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 89.3 m-70 -95.08 2.05 55.11 Favored 'General case' 0 C--N 1.273 -2.748 0 CA-C-N 113.08 -1.873 . . . . 0.0 108.656 172.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.4 ' HB3' ' O ' ' A' ' 29' ' ' ALA . 5.0 mp -136.41 -177.05 4.55 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.464 -175.333 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.64 160.55 28.52 Favored Glycine 0 N--CA 1.425 -2.067 0 N-CA-C 108.818 -1.713 . . . . 0.0 108.818 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.6 t -92.48 127.89 38.14 Favored 'General case' 0 C--N 1.285 -2.221 0 CA-C-N 117.84 0.82 . . . . 0.0 111.429 -176.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 35.4 mmtm -96.68 112.58 24.27 Favored 'General case' 0 CA--C 1.468 -2.183 0 O-C-N 121.36 -0.838 . . . . 0.0 108.894 169.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -72.73 -8.72 56.79 Favored 'General case' 0 C--N 1.294 -1.832 0 CA-C-N 114.289 -1.323 . . . . 0.0 111.51 -176.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -88.91 -27.82 20.72 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-O 122.201 1.0 . . . . 0.0 108.378 -177.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.572 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 0.9 OUTLIER -110.03 -8.44 14.82 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 114.513 -1.222 . . . . 0.0 111.03 -176.022 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.506 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 3.7 mptp? 59.85 26.36 15.55 Favored 'General case' 0 CA--C 1.486 -1.499 0 C-N-CA 124.61 1.164 . . . . 0.0 110.847 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.572 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 2.5 p90 -141.27 156.62 45.86 Favored 'General case' 0 C--N 1.286 -2.164 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.521 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.437 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 59.3 m -72.29 133.53 45.07 Favored 'General case' 0 N--CA 1.411 -2.418 0 CA-C-N 113.922 -1.49 . . . . 0.0 110.508 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.477 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -120.11 173.81 6.87 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 105.446 -2.057 . . . . 0.0 105.446 176.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -71.98 -0.06 10.59 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 119.59 1.086 . . . . 0.0 113.331 -175.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -162.32 158.96 24.88 Favored 'General case' 0 N--CA 1.407 -2.592 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 -178.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -108.99 -30.13 8.23 Favored 'General case' 0 C--N 1.274 -2.677 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.658 176.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.5 m -68.74 137.81 54.36 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.684 -177.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -78.69 111.44 14.79 Favored 'General case' 0 C--N 1.308 -1.239 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 177.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 10.0 t . . . . . 0 C--N 1.297 -1.69 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.666 -176.43 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 CA--C 1.498 -1.038 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 24.8 p -109.66 158.78 17.72 Favored 'General case' 0 N--CA 1.407 -2.592 0 CA-C-O 121.704 0.764 . . . . 0.0 110.58 175.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.7 mpp_? -94.04 133.88 37.04 Favored 'General case' 0 C--N 1.268 -2.977 0 CA-C-N 114.263 -1.335 . . . . 0.0 109.632 176.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.489 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 43.6 m-85 -85.07 -165.83 1.32 Allowed 'General case' 0 N--CA 1.409 -2.483 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 176.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 12.4 ttt -63.96 134.21 54.66 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -176.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 77.88 1.19 2.84 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.509 1.524 . . . . 0.0 111.66 -178.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -76.31 154.49 44.4 Favored Glycine 0 N--CA 1.44 -1.062 0 N-CA-C 109.172 -1.571 . . . . 0.0 109.172 174.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -74.81 143.53 43.93 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 117.099 0.449 . . . . 0.0 111.929 -174.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.462 ' O ' ' HE2' ' A' ' 26' ' ' LYS . 28.9 p -151.45 154.86 37.42 Favored 'General case' 0 N--CA 1.412 -2.331 0 C-N-CA 119.988 -0.685 . . . . 0.0 111.232 -177.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -112.83 -36.57 5.11 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 107.324 -1.361 . . . . 0.0 107.324 171.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.9 ptpt -141.98 178.15 7.72 Favored 'General case' 0 N--CA 1.425 -1.709 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.835 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -71.4 -17.81 62.38 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 120.606 0.241 . . . . 0.0 111.311 -174.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -64.36 -26.47 68.49 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-O 121.492 0.663 . . . . 0.0 110.319 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -72.88 -29.49 63.22 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 114.755 -1.111 . . . . 0.0 110.124 -178.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.2 m -91.4 162.64 14.5 Favored 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.516 -176.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.418 ' HB2' HD12 ' A' ' 19' ' ' LEU . 60.8 m -71.35 177.83 3.72 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.575 175.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -57.65 -56.44 21.94 Favored 'General case' 0 CA--C 1.502 -0.885 0 C-N-CA 124.114 0.966 . . . . 0.0 112.293 -174.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 -77.13 19.88 0.3 Allowed 'General case' 0 C--N 1.293 -1.862 0 CA-C-N 114.801 -1.09 . . . . 0.0 112.882 -176.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.432 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 60.7 mt -132.51 167.45 19.96 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.248 0.547 . . . . 0.0 110.764 -176.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.37 148.92 20.92 Favored Glycine 0 N--CA 1.434 -1.476 0 N-CA-C 108.994 -1.642 . . . . 0.0 108.994 177.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.9 t -84.61 128.27 34.51 Favored 'General case' 0 C--N 1.285 -2.215 0 CA-C-N 117.236 0.518 . . . . 0.0 111.208 -175.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 35.0 mmtm -88.29 112.9 23.34 Favored 'General case' 0 CA--C 1.465 -2.318 0 O-C-N 121.934 -0.479 . . . . 0.0 109.796 172.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.2 mpt_? -73.95 -9.78 58.98 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 114.601 -1.181 . . . . 0.0 111.505 -178.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -89.34 -29.14 19.35 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 -178.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.468 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 95.0 mmm -112.44 -20.36 11.81 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 114.68 -1.145 . . . . 0.0 112.3 -171.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.462 ' HE2' ' O ' ' A' ' 9' ' ' CYS . 14.4 mmmm 69.69 36.39 2.14 Favored 'General case' 0 CA--C 1.503 -0.843 0 C-N-CA 125.458 1.503 . . . . 0.0 111.304 -178.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.468 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 3.4 p90 -144.25 160.17 41.43 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-N 114.365 -1.289 . . . . 0.0 111.696 178.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.489 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 70.2 m -79.92 130.04 34.97 Favored 'General case' 0 C--N 1.289 -2.045 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.832 -178.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.84 -174.48 2.83 Favored 'General case' 0 C--N 1.289 -2.034 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 177.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.423 ' HA ' HD23 ' A' ' 19' ' ' LEU . 99.5 m95 -75.45 -6.16 48.69 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -176.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -170.0 164.22 9.47 Favored 'General case' 0 N--CA 1.407 -2.611 0 N-CA-C 105.194 -2.15 . . . . 0.0 105.194 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 50.2 p90 -84.64 -18.14 36.39 Favored 'General case' 0 C--N 1.269 -2.891 0 CA-C-O 121.241 0.543 . . . . 0.0 109.619 179.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.4 m -91.2 156.4 17.87 Favored 'General case' 0 N--CA 1.432 -1.362 0 N-CA-C 108.65 -0.871 . . . . 0.0 108.65 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -126.21 100.1 6.16 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 176.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 63.1 m . . . . . 0 C--N 1.3 -1.572 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.718 -179.012 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 . . . . . 0 CA--C 1.505 -0.77 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.7 p -96.07 -172.61 2.6 Favored 'General case' 0 N--CA 1.418 -2.029 0 CA-C-O 121.78 0.8 . . . . 0.0 109.5 -177.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -115.07 135.73 53.88 Favored 'General case' 0 N--CA 1.402 -2.842 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.618 171.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.455 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 64.4 m-85 -96.16 -159.04 0.7 Allowed 'General case' 0 N--CA 1.387 -3.619 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 175.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 11.1 ttt -67.47 135.57 53.29 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 119.386 -0.926 . . . . 0.0 109.661 -175.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 76.26 5.98 3.63 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.529 1.132 . . . . 0.0 111.059 -178.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.41 ' O ' ' HA ' ' A' ' 27' ' ' TYR . . . -87.25 149.7 22.2 Favored Glycine 0 N--CA 1.434 -1.493 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 175.364 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.423 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 7.2 t70 -71.22 141.84 50.62 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 123.682 0.793 . . . . 0.0 112.924 -173.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.444 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 20.5 p -149.95 150.34 31.7 Favored 'General case' 0 C--N 1.284 -2.279 0 C-N-CA 119.626 -0.829 . . . . 0.0 111.432 -177.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -113.76 -35.13 5.26 Favored 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 172.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.585 ' HG2' ' OD2' ' A' ' 14' ' ' ASP . 3.9 ptpp? -138.06 175.14 9.84 Favored 'General case' 0 N--CA 1.413 -2.281 0 CA-C-N 114.417 -1.265 . . . . 0.0 107.82 -176.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -75.34 -16.57 60.39 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-O 121.16 0.505 . . . . 0.0 111.443 -175.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.5 ' HB2' ' HG3' ' A' ' 11' ' ' LYS . 46.1 mt-10 -68.87 -25.99 64.9 Favored 'General case' 0 CA--C 1.502 -0.878 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.818 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.585 ' OD2' ' HG2' ' A' ' 11' ' ' LYS . 45.0 m-20 -72.92 -26.79 61.53 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.109 -177.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 13.0 m -96.68 156.92 16.14 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 120.978 0.418 . . . . 0.0 110.088 -178.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.16 179.71 3.72 Favored 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 173.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -49.99 -61.46 2.13 Favored 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 127.15 2.18 . . . . 0.0 113.867 -172.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -76.25 15.57 0.56 Allowed 'General case' 0 C--N 1.29 -1.986 0 CA-C-N 114.854 -1.066 . . . . 0.0 112.746 -174.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.2 mp -135.54 176.76 8.38 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-O 120.925 0.393 . . . . 0.0 110.942 -177.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -150.38 161.06 28.83 Favored Glycine 0 N--CA 1.425 -2.088 0 N-CA-C 108.902 -1.679 . . . . 0.0 108.902 176.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.2 t -87.16 130.59 34.48 Favored 'General case' 0 C--N 1.297 -1.699 0 CA-C-N 117.554 0.677 . . . . 0.0 112.333 -176.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.574 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 74.4 mmtt -100.63 105.1 16.46 Favored 'General case' 0 CA--C 1.465 -2.312 0 CA-C-O 121.358 0.599 . . . . 0.0 109.43 170.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -72.92 -3.7 27.44 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 114.385 -1.28 . . . . 0.0 111.115 -176.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -89.77 -31.68 17.3 Favored 'General case' 0 CA--C 1.5 -0.972 0 CA-C-O 121.998 0.904 . . . . 0.0 108.694 -177.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.533 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 96.2 mmm -112.29 -7.97 13.97 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 114.537 -1.211 . . . . 0.0 111.867 -176.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.423 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 70.7 mmtt 65.35 30.01 11.23 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.723 1.209 . . . . 0.0 111.717 -179.053 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.533 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 7.0 p90 -144.42 159.79 42.14 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.27 178.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 55.9 m -81.15 131.02 35.28 Favored 'General case' 0 C--N 1.287 -2.139 0 CA-C-N 114.614 -1.176 . . . . 0.0 110.658 -178.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -116.33 -176.59 2.99 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 105.831 -1.915 . . . . 0.0 105.831 175.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -75.54 2.43 11.72 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 119.053 0.842 . . . . 0.0 113.041 -175.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.574 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 2.9 p30 -159.95 157.54 29.08 Favored 'General case' 0 N--CA 1.401 -2.919 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.427 ' CD2' HG22 ' A' ' 33' ' ' THR . 21.1 p90 -96.62 -29.73 13.67 Favored 'General case' 0 C--N 1.276 -2.611 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.252 171.538 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.427 HG22 ' CD2' ' A' ' 32' ' ' PHE . 11.0 t -171.38 166.08 7.01 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 106.118 -1.808 . . . . 0.0 106.118 176.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -73.94 107.31 6.08 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 177.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.9 p . . . . . 0 C--N 1.297 -1.715 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.361 -179.46 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 . . . . . 0 CA--C 1.503 -0.862 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.1 p -99.86 159.89 14.72 Favored 'General case' 0 N--CA 1.418 -2.074 0 C-N-CA 120.246 -0.581 . . . . 0.0 109.798 177.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.436 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 3.4 tpp180 -86.76 131.22 34.19 Favored 'General case' 0 C--N 1.276 -2.602 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 -178.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -90.25 -166.55 1.61 Allowed 'General case' 0 N--CA 1.415 -2.182 0 CA-C-O 120.818 0.342 . . . . 0.0 111.843 -178.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 16.0 ttt -64.9 140.31 58.85 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.755 -174.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 72.22 8.91 5.91 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.514 1.126 . . . . 0.0 111.577 -179.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.61 137.92 14.16 Favored Glycine 0 N--CA 1.419 -2.486 0 N-CA-C 109.681 -1.368 . . . . 0.0 109.681 175.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.554 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 18.5 t70 -56.76 143.99 34.6 Favored 'General case' 0 CA--C 1.486 -1.489 0 C-N-CA 124.449 1.1 . . . . 0.0 111.553 -178.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 26.5 p -149.43 151.91 34.8 Favored 'General case' 0 N--CA 1.42 -1.941 0 C-N-CA 119.518 -0.873 . . . . 0.0 111.957 -175.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -115.97 -33.91 4.92 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.292 -0.867 . . . . 0.0 108.71 176.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 42.0 pttt -138.73 164.04 30.59 Favored 'General case' 0 N--CA 1.42 -1.959 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 176.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -71.55 -16.5 62.32 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-O 121.317 0.58 . . . . 0.0 110.162 -177.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -67.52 -28.22 67.63 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-N 114.432 -1.258 . . . . 0.0 109.552 -177.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -69.08 -32.8 72.49 Favored 'General case' 0 N--CA 1.436 -1.133 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.911 -177.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.436 ' SG ' ' HB3' ' A' ' 3' ' ' ARG . 69.3 m -100.4 165.74 11.3 Favored 'General case' 0 N--CA 1.429 -1.512 0 CA-C-O 121.378 0.609 . . . . 0.0 112.582 -177.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.431 ' HB2' HD13 ' A' ' 19' ' ' LEU . 11.3 m -64.69 172.34 2.8 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.834 -178.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -79.01 -27.43 43.26 Favored 'General case' 0 CA--C 1.488 -1.432 0 CA-C-O 121.939 0.876 . . . . 0.0 111.647 -172.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 33.9 m170 -77.92 4.14 12.78 Favored 'General case' 0 C--N 1.28 -2.439 0 CA-C-N 114.299 -1.319 . . . . 0.0 110.62 177.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.431 HD13 ' HB2' ' A' ' 16' ' ' CYS . 5.5 mp -133.14 177.1 7.93 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-O 121.285 0.564 . . . . 0.0 111.304 -177.369 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.406 ' HA3' ' HB3' ' A' ' 32' ' ' PHE . . . -150.6 152.12 24.03 Favored Glycine 0 N--CA 1.421 -2.365 0 N-CA-C 109.774 -1.33 . . . . 0.0 109.774 176.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 32.5 t -88.96 118.68 28.86 Favored 'General case' 0 C--N 1.292 -1.915 0 C-N-CA 123.153 0.581 . . . . 0.0 111.042 -175.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 75.3 mmtt -87.97 115.61 25.56 Favored 'General case' 0 CA--C 1.466 -2.269 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 177.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.1 mmt180 -73.47 -15.3 61.33 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.326 -175.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.448 ' HG3' ' HG2' ' A' ' 25' ' ' MET . 64.5 pttt -90.68 -25.93 19.83 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 119.165 -1.014 . . . . 0.0 109.965 -176.483 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.574 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 89.4 mmm -107.01 -17.19 14.24 Favored 'General case' 0 N--CA 1.434 -1.235 0 CA-C-N 114.975 -1.012 . . . . 0.0 110.755 -173.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.554 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 32.2 mmmt 68.36 33.1 4.3 Favored 'General case' 0 CA--C 1.489 -1.398 0 C-N-CA 124.42 1.088 . . . . 0.0 111.118 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.574 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 7.8 p90 -153.61 166.36 33.03 Favored 'General case' 0 C--N 1.287 -2.127 0 CA-C-N 114.185 -1.371 . . . . 0.0 110.464 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 71.6 m -95.85 140.37 30.72 Favored 'General case' 0 C--N 1.276 -2.59 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.31 -172.41 2.35 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 177.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -76.71 9.24 2.93 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 119.883 1.219 . . . . 0.0 113.151 -176.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.423 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 4.7 p-10 -166.14 167.65 16.09 Favored 'General case' 0 N--CA 1.405 -2.677 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.406 ' HB3' ' HA3' ' A' ' 20' ' ' GLY . 33.8 p90 -108.84 -33.6 6.91 Favored 'General case' 0 C--N 1.277 -2.548 0 O-C-N 123.793 0.683 . . . . 0.0 112.078 177.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.2 t -132.5 147.84 52.37 Favored 'General case' 0 N--CA 1.432 -1.347 0 C-N-CA 119.476 -0.89 . . . . 0.0 110.786 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 50.5 p90 -74.9 155.3 37.62 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.907 -178.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.1 m . . . . . 0 C--N 1.304 -1.378 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 176.381 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 26.6 t70 . . . . . 0 CA--C 1.492 -1.281 0 CA-C-O 121.295 0.569 . . . . 0.0 109.918 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.7 p -100.52 163.7 12.24 Favored 'General case' 0 C--N 1.284 -2.274 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.164 -177.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.509 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 39.6 mmt180 -80.12 131.48 35.75 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-N 114.565 -1.198 . . . . 0.0 109.524 178.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.43 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 55.8 m-85 -90.91 -158.88 0.58 Allowed 'General case' 0 N--CA 1.397 -3.109 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 173.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.1 ttt -71.66 137.28 47.75 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 120.31 -0.556 . . . . 0.0 109.901 -173.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 77.61 2.36 3.01 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.137 1.375 . . . . 0.0 111.266 -178.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.38 142.9 26.56 Favored Glycine 0 N--CA 1.43 -1.713 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 174.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.509 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 12.7 t70 -69.32 144.54 53.5 Favored 'General case' 0 CA--C 1.492 -1.259 0 C-N-CA 123.339 0.656 . . . . 0.0 111.116 -176.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.415 ' O ' ' HE2' ' A' ' 26' ' ' LYS . 32.0 p -152.47 155.97 38.53 Favored 'General case' 0 C--N 1.29 -1.991 0 C-N-CA 119.65 -0.82 . . . . 0.0 111.883 -176.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -113.73 -36.93 4.71 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 171.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 22.4 pttm -135.68 167.52 20.98 Favored 'General case' 0 N--CA 1.426 -1.666 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.153 -178.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -67.46 -19.13 65.31 Favored 'General case' 0 CA--C 1.488 -1.411 0 CA-C-O 120.994 0.426 . . . . 0.0 111.49 -178.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -70.94 -23.7 62.29 Favored 'General case' 0 CA--C 1.497 -1.095 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.34 -177.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -77.16 -27.98 53.94 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.1 -178.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 20.8 m -89.68 158.95 17.35 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 59.1 m -65.23 169.9 5.18 Favored 'General case' 0 N--CA 1.421 -1.923 0 CA-C-O 121.448 0.642 . . . . 0.0 110.632 174.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -66.71 -47.91 70.88 Favored 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.647 -169.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 47.5 m80 -64.82 -3.9 3.84 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 114.872 -1.058 . . . . 0.0 113.196 179.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.7 mp -120.96 -178.77 3.83 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.289 0.566 . . . . 0.0 111.583 -177.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -148.18 153.16 25.1 Favored Glycine 0 N--CA 1.419 -2.471 0 N-CA-C 110.27 -1.132 . . . . 0.0 110.27 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 52.3 t -86.31 127.78 34.83 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-O 120.6 0.238 . . . . 0.0 110.481 -177.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.503 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 73.1 mmtt -92.51 113.57 25.88 Favored 'General case' 0 CA--C 1.46 -2.497 0 CA-C-O 121.24 0.543 . . . . 0.0 110.439 176.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -71.45 -12.78 61.57 Favored 'General case' 0 C--N 1.29 -1.979 0 CA-C-N 113.474 -1.694 . . . . 0.0 112.091 -175.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.3 mmmp? -90.38 -30.66 17.27 Favored 'General case' 0 C--N 1.297 -1.702 0 C-N-CA 119.457 -0.897 . . . . 0.0 109.633 -177.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.448 ' HB3' ' CD2' ' A' ' 27' ' ' TYR . 16.5 mmt -113.15 -13.84 12.97 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -174.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.415 ' HE2' ' O ' ' A' ' 9' ' ' CYS . 14.5 mmmm 66.81 36.67 4.42 Favored 'General case' 0 CA--C 1.498 -1.055 0 C-N-CA 124.444 1.098 . . . . 0.0 110.767 -179.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.448 ' CD2' ' HB3' ' A' ' 25' ' ' MET . 10.0 p90 -142.99 159.84 41.49 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 115.004 -0.998 . . . . 0.0 111.657 177.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.43 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 42.2 m -84.72 129.47 34.83 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.938 -176.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.16 -173.8 2.64 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -79.62 8.46 6.48 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 119.775 1.17 . . . . 0.0 113.1 -176.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.503 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 3.3 p-10 -168.18 169.5 10.91 Favored 'General case' 0 N--CA 1.409 -2.479 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 -179.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -111.92 -32.8 6.48 Favored 'General case' 0 C--N 1.279 -2.481 0 O-C-N 123.539 0.524 . . . . 0.0 110.989 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 7.2 p -48.0 116.94 1.68 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.724 1.209 . . . . 0.0 113.933 -175.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -112.63 125.51 54.36 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.646 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 5.9 t . . . . . 0 C--N 1.298 -1.663 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.622 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 . . . . . 0 CA--C 1.511 -0.555 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 13.1 p -87.22 168.93 12.78 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-O 121.854 0.835 . . . . 0.0 112.397 -177.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 3' ' ' ARG . 0.4 OUTLIER -94.48 132.04 39.56 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 114.689 -1.141 . . . . 0.0 110.08 176.767 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.459 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 70.3 m-85 -92.09 -162.96 0.98 Allowed 'General case' 0 N--CA 1.398 -3.029 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 175.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.7 ttt -61.88 137.56 58.26 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-O 120.51 0.195 . . . . 0.0 110.57 -175.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 76.84 -5.09 2.24 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.926 1.291 . . . . 0.0 111.888 -179.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.92 146.39 36.58 Favored Glycine 0 N--CA 1.435 -1.394 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 176.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.467 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 16.2 t70 -73.23 145.37 46.26 Favored 'General case' 0 CA--C 1.485 -1.548 0 CA-C-O 120.947 0.404 . . . . 0.0 111.081 -176.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.7 p -153.73 152.75 31.12 Favored 'General case' 0 N--CA 1.41 -2.472 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.459 -178.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -113.34 -32.88 6.12 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 173.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -131.71 165.44 23.72 Favored 'General case' 0 N--CA 1.417 -2.097 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 176.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -70.03 -16.18 63.12 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 121.552 0.691 . . . . 0.0 110.469 -175.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -72.92 -23.75 60.74 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-N 114.602 -1.181 . . . . 0.0 109.974 -177.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -76.72 -16.24 59.56 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.154 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 33.9 m -99.14 156.56 16.89 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.805 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 36.4 m -64.45 173.82 1.95 Allowed 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.797 176.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -60.8 -51.91 67.31 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.63 1.172 . . . . 0.0 113.024 -171.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 41.3 m80 -70.82 2.37 4.33 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 114.202 -1.363 . . . . 0.0 113.237 -178.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.6 mp -122.52 173.17 7.85 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.564 0.697 . . . . 0.0 112.561 -177.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -138.97 156.92 24.61 Favored Glycine 0 N--CA 1.43 -1.766 0 N-CA-C 108.304 -1.919 . . . . 0.0 108.304 177.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.3 t -100.74 121.57 41.88 Favored 'General case' 0 C--N 1.286 -2.159 0 CA-C-N 117.774 0.787 . . . . 0.0 110.783 -175.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -75.31 110.66 9.85 Favored 'General case' 0 CA--C 1.461 -2.445 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 171.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.43 ' H ' ' HD2' ' A' ' 23' ' ' ARG . 2.3 mpt_? -77.36 -11.55 59.85 Favored 'General case' 0 C--N 1.291 -1.967 0 O-C-N 124.531 1.145 . . . . 0.0 109.578 -176.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -89.59 -27.69 20.05 Favored 'General case' 0 N--CA 1.433 -1.3 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.455 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 93.4 mmm -112.84 -6.82 13.8 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 114.226 1.195 . . . . 0.0 114.226 -172.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.467 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 4.9 mptp? 59.65 33.13 21.88 Favored 'General case' 0 CA--C 1.495 -1.17 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -178.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.455 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 17.3 p90 -144.66 153.3 41.6 Favored 'General case' 0 CA--C 1.486 -1.49 0 C-N-CA 118.881 -1.128 . . . . 0.0 112.946 177.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 39.7 m -80.04 131.42 35.78 Favored 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 113.966 -1.47 . . . . 0.0 110.046 -179.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -124.13 175.5 6.97 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 178.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -70.63 -4.66 24.45 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -175.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -175.81 159.65 2.28 Favored 'General case' 0 N--CA 1.418 -2.03 0 N-CA-C 103.59 -2.745 . . . . 0.0 103.59 175.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.2 p90 -100.02 -8.78 23.43 Favored 'General case' 0 C--N 1.279 -2.486 0 C-N-CA 120.114 -0.634 . . . . 0.0 112.672 -178.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.9 p -84.21 -94.49 0.07 Allowed 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -175.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -137.94 106.67 5.91 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 61.2 m . . . . . 0 C--N 1.298 -1.65 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.323 179.433 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 28.9 t70 . . . . . 0 CA--C 1.508 -0.67 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.9 p -116.36 166.33 12.18 Favored 'General case' 0 C--N 1.299 -1.611 0 CA-C-O 121.281 0.562 . . . . 0.0 111.25 -177.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 33.9 mmt180 -82.09 125.93 31.42 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 115.004 -0.998 . . . . 0.0 108.425 176.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.501 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 76.9 m-85 -88.39 -164.91 1.2 Allowed 'General case' 0 N--CA 1.387 -3.625 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.532 178.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.491 ' HA ' ' O ' ' A' ' 28' ' ' CYS . 16.3 ttt -63.97 134.03 54.3 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 120.817 0.342 . . . . 0.0 110.354 -173.455 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 78.79 -1.77 2.35 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 125.631 1.572 . . . . 0.0 111.717 -179.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.3 145.06 32.71 Favored Glycine 0 N--CA 1.439 -1.105 0 N-CA-C 110.201 -1.16 . . . . 0.0 110.201 176.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.415 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 13.5 t70 -67.7 144.9 55.24 Favored 'General case' 0 CA--C 1.495 -1.151 0 C-N-CA 123.117 0.567 . . . . 0.0 111.742 -177.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.1 p -149.36 161.3 42.33 Favored 'General case' 0 N--CA 1.419 -1.982 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.201 -177.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -118.25 -32.34 4.71 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 172.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.8 pttt -147.42 177.28 9.37 Favored 'General case' 0 N--CA 1.426 -1.663 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 178.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -71.84 -16.32 62.16 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -175.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.24 -30.64 71.68 Favored 'General case' 0 CA--C 1.488 -1.428 0 CA-C-O 121.317 0.58 . . . . 0.0 110.498 177.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -68.83 -32.27 71.84 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.893 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 17.7 m -94.99 155.26 16.8 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.109 -177.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.404 ' HB2' HD12 ' A' ' 19' ' ' LEU . 25.1 m -60.77 173.47 0.74 Allowed 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 123.885 0.874 . . . . 0.0 111.351 175.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -68.54 -39.4 81.13 Favored 'General case' 0 CA--C 1.5 -0.956 0 CA-C-O 121.884 0.85 . . . . 0.0 111.919 -171.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 20.2 m170 -86.87 9.25 19.81 Favored 'General case' 0 C--N 1.278 -2.527 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.206 -176.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.501 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 68.8 mt -126.71 162.83 24.88 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 -178.012 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -139.39 150.96 21.64 Favored Glycine 0 C--N 1.299 -1.51 0 N-CA-C 110.754 -0.939 . . . . 0.0 110.754 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -87.08 106.21 17.7 Favored 'General case' 0 C--N 1.294 -1.825 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -176.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -64.3 114.9 4.56 Favored 'General case' 0 CA--C 1.468 -2.193 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 175.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -65.62 -24.1 66.97 Favored 'General case' 0 C--N 1.308 -1.227 0 O-C-N 125.237 1.585 . . . . 0.0 110.475 -175.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -90.05 -21.47 22.31 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 119.597 -0.841 . . . . 0.0 110.695 -168.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -112.3 -29.98 7.35 Favored 'General case' 0 N--CA 1.419 -2.018 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.334 -176.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.447 ' HD3' ' HA ' ' A' ' 26' ' ' LYS . 32.5 mmtp 72.06 49.59 0.24 Allowed 'General case' 0 CA--C 1.494 -1.188 0 C-N-CA 125.227 1.411 . . . . 0.0 110.925 -171.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -145.04 160.05 41.99 Favored 'General case' 0 CA--C 1.486 -1.483 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.233 175.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.491 ' O ' ' HA ' ' A' ' 5' ' ' MET . 56.3 m -85.57 122.81 30.22 Favored 'General case' 0 C--N 1.282 -2.344 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.252 -177.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.49 -165.18 1.17 Allowed 'General case' 0 C--N 1.288 -2.076 0 N-CA-C 106.317 -1.735 . . . . 0.0 106.317 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -75.84 -5.84 47.87 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -176.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -170.65 177.43 3.93 Favored 'General case' 0 N--CA 1.41 -2.432 0 N-CA-C 105.92 -1.881 . . . . 0.0 105.92 173.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 36.6 p90 -102.26 -3.31 27.48 Favored 'General case' 0 C--N 1.273 -2.721 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 -172.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.9 m -77.67 149.11 34.7 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.099 0.476 . . . . 0.0 110.764 -174.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -134.07 147.43 50.9 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 47.2 m . . . . . 0 C--N 1.294 -1.845 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.892 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 . . . . . 0 CA--C 1.506 -0.725 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.5 p -109.45 172.21 6.99 Favored 'General case' 0 N--CA 1.424 -1.767 0 CA-C-O 121.649 0.738 . . . . 0.0 111.758 -177.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.72 135.42 41.16 Favored 'General case' 0 C--N 1.283 -2.284 0 CA-C-N 114.388 -1.278 . . . . 0.0 109.476 176.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.481 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 87.7 m-85 -91.46 -162.75 0.95 Allowed 'General case' 0 N--CA 1.399 -2.992 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 176.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.422 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 10.5 ttt -64.44 135.35 56.01 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 -175.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 75.77 9.67 3.45 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.828 1.251 . . . . 0.0 111.938 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.34 144.22 17.36 Favored Glycine 0 N--CA 1.434 -1.44 0 N-CA-C 109.161 -1.575 . . . . 0.0 109.161 173.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -62.47 145.6 53.75 Favored 'General case' 0 CA--C 1.493 -1.217 0 C-N-CA 123.079 0.551 . . . . 0.0 112.138 -176.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 21.6 p -153.47 155.13 35.71 Favored 'General case' 0 N--CA 1.422 -1.85 0 C-N-CA 120.011 -0.676 . . . . 0.0 110.757 -179.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -121.44 -34.33 3.47 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 172.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.6 pttt -131.36 174.09 10.42 Favored 'General case' 0 N--CA 1.42 -1.974 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 176.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -74.03 -16.06 61.06 Favored 'General case' 0 C--N 1.297 -1.717 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 -174.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -71.19 -24.7 62.27 Favored 'General case' 0 CA--C 1.483 -1.632 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.732 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -69.54 -25.54 64.06 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.609 -178.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 25.7 m -96.58 155.61 16.69 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.709 -178.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 60.7 m -66.13 178.01 1.26 Allowed 'General case' 0 C--N 1.291 -1.977 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.421 176.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 36.3 mmtp -57.61 -55.64 32.26 Favored 'General case' 0 CA--C 1.505 -0.763 0 C-N-CA 124.304 1.041 . . . . 0.0 113.066 -171.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 39.5 m80 -72.8 1.47 8.51 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 115.204 -0.907 . . . . 0.0 113.342 -176.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.3 mp -124.7 166.95 15.25 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-O 121.682 0.753 . . . . 0.0 111.961 -175.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -135.46 161.88 24.77 Favored Glycine 0 N--CA 1.419 -2.467 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 178.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.4 t -88.23 122.1 31.38 Favored 'General case' 0 C--N 1.285 -2.22 0 CA-C-N 116.92 0.36 . . . . 0.0 110.851 -176.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -83.9 114.37 21.62 Favored 'General case' 0 CA--C 1.465 -2.316 0 C-N-CA 119.426 -0.91 . . . . 0.0 110.06 175.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.471 ' NH1' ' HB2' ' A' ' 32' ' ' PHE . 6.5 mpt_? -67.11 -24.17 65.91 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 113.804 -1.544 . . . . 0.0 110.222 -178.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -87.39 -26.38 23.35 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 115.263 -0.88 . . . . 0.0 109.569 -174.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.548 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 76.3 mmm -110.4 -15.66 13.88 Favored 'General case' 0 C--N 1.291 -1.96 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.007 -170.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm 62.56 33.35 15.96 Favored 'General case' 0 CA--C 1.496 -1.124 0 C-N-CA 124.856 1.263 . . . . 0.0 110.348 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.548 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 3.3 p90 -151.18 161.23 43.1 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.063 -1.426 . . . . 0.0 111.419 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.481 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 57.6 m -79.28 135.36 36.73 Favored 'General case' 0 C--N 1.278 -2.536 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.719 -177.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.422 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -130.46 -178.89 4.96 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 176.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -71.91 0.38 9.36 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -175.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -166.48 -178.24 4.36 Favored 'General case' 0 N--CA 1.416 -2.152 0 N-CA-C 105.034 -2.21 . . . . 0.0 105.034 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.471 ' HB2' ' NH1' ' A' ' 23' ' ' ARG . 43.0 p90 -132.66 -21.81 2.19 Favored 'General case' 0 C--N 1.275 -2.637 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -171.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 44.3 p -66.84 157.96 31.71 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -173.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -91.19 97.64 11.26 Favored 'General case' 0 C--N 1.307 -1.264 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 63.6 m . . . . . 0 C--N 1.297 -1.706 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.293 -179.6 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 CA--C 1.507 -0.685 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.2 p -136.19 169.02 18.31 Favored 'General case' 0 N--CA 1.411 -2.421 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -95.29 132.7 40.0 Favored 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.205 177.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.413 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 78.7 m-85 -92.11 -165.43 1.35 Allowed 'General case' 0 N--CA 1.409 -2.505 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.867 -177.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.2 ttt -61.61 136.06 57.87 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -176.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 78.58 -4.99 2.1 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.571 1.149 . . . . 0.0 111.743 -178.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.13 147.72 36.65 Favored Glycine 0 N--CA 1.44 -1.089 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 174.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -63.66 143.71 57.61 Favored 'General case' 0 CA--C 1.484 -1.563 0 C-N-CA 123.25 0.62 . . . . 0.0 112.243 -174.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 12.7 p -152.9 147.68 26.27 Favored 'General case' 0 C--N 1.279 -2.496 0 C-N-CA 118.544 -1.262 . . . . 0.0 111.192 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -125.79 -23.29 4.02 Favored 'General case' 0 N--CA 1.424 -1.733 0 CA-C-N 114.642 -1.163 . . . . 0.0 108.646 172.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -139.64 165.08 28.21 Favored 'General case' 0 N--CA 1.424 -1.752 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 176.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -71.69 -15.69 62.22 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.232 0.539 . . . . 0.0 110.634 -176.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -65.3 -28.15 69.12 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 114.838 -1.073 . . . . 0.0 110.931 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -73.06 -30.12 63.47 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.206 -176.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 12.2 m -95.77 155.58 16.69 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.773 -176.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 18.3 m -61.67 171.15 1.65 Allowed 'General case' 0 C--N 1.304 -1.372 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.673 174.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -72.05 -42.89 65.75 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-O 121.281 0.562 . . . . 0.0 110.933 -173.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 36.0 m80 -64.03 0.35 0.93 Allowed 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 114.855 -1.066 . . . . 0.0 112.788 175.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.6 mp -128.73 -175.98 3.7 Favored 'General case' 0 N--CA 1.421 -1.916 0 CA-C-O 121.078 0.466 . . . . 0.0 110.616 -178.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -152.28 161.29 29.34 Favored Glycine 0 N--CA 1.418 -2.556 0 N-CA-C 108.918 -1.673 . . . . 0.0 108.918 175.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.3 t -87.6 131.62 34.35 Favored 'General case' 0 C--N 1.294 -1.837 0 CA-C-N 117.446 0.623 . . . . 0.0 111.136 -178.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -103.1 107.52 18.36 Favored 'General case' 0 CA--C 1.469 -2.148 0 CA-C-O 121.477 0.656 . . . . 0.0 110.259 172.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -74.75 -5.32 42.71 Favored 'General case' 0 C--N 1.293 -1.853 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.627 -177.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -89.03 -29.98 19.06 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.414 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 95.8 mmm -112.65 -9.98 13.69 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 114.791 -1.095 . . . . 0.0 112.589 -177.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp 65.15 28.71 12.15 Favored 'General case' 0 CA--C 1.504 -0.799 0 C-N-CA 124.901 1.28 . . . . 0.0 111.306 -178.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.414 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 1.3 p90 -145.56 162.44 37.45 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-N 114.849 -1.069 . . . . 0.0 111.747 179.357 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 52.3 m -77.24 135.21 38.45 Favored 'General case' 0 C--N 1.287 -2.14 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.589 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -124.67 -178.81 4.26 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 106.517 -1.66 . . . . 0.0 106.517 176.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -71.04 -3.92 22.24 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.471 1.285 . . . . 0.0 114.471 -175.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -163.13 162.05 25.44 Favored 'General case' 0 N--CA 1.41 -2.446 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 7.3 p90 -103.06 -0.53 30.59 Favored 'General case' 0 C--N 1.272 -2.793 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.372 -178.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 33.5 m -82.9 88.19 6.82 Favored 'General case' 0 N--CA 1.428 -1.562 0 CA-C-O 122.097 0.951 . . . . 0.0 110.728 -174.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -81.83 113.25 19.66 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 114.942 -1.026 . . . . 0.0 108.956 178.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 31.5 p . . . . . 0 C--N 1.291 -1.975 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.847 -179.631 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 . . . . . 0 CA--C 1.485 -1.547 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.4 p -127.37 169.4 13.63 Favored 'General case' 0 N--CA 1.413 -2.278 0 CA-C-O 121.385 0.612 . . . . 0.0 110.529 179.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.466 ' HB3' ' HA3' ' A' ' 7' ' ' GLY . 8.6 mpt_? -99.06 137.07 38.12 Favored 'General case' 0 C--N 1.285 -2.223 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.828 176.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.53 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 74.0 m-85 -86.98 -166.99 1.73 Allowed 'General case' 0 N--CA 1.399 -2.991 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.572 174.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 13.0 ttt -60.56 133.62 56.27 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 -175.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 74.99 5.59 4.31 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.618 1.167 . . . . 0.0 112.023 -178.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.466 ' HA3' ' HB3' ' A' ' 3' ' ' ARG . . . -80.03 160.84 44.98 Favored Glycine 0 N--CA 1.442 -0.932 0 N-CA-C 109.22 -1.552 . . . . 0.0 109.22 173.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.43 141.52 45.03 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -174.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 20.2 p -151.19 155.13 38.21 Favored 'General case' 0 N--CA 1.423 -1.775 0 C-N-CA 119.828 -0.749 . . . . 0.0 111.915 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -119.42 -39.23 2.91 Favored 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 124.725 1.21 . . . . 0.0 108.169 172.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.8 pttm -132.36 175.42 9.3 Favored 'General case' 0 N--CA 1.423 -1.785 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -74.84 -17.43 60.6 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 121.1 0.476 . . . . 0.0 110.294 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -69.68 -23.43 63.44 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.333 -177.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -76.81 -25.14 52.94 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 -177.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 39.5 m -91.73 159.66 15.73 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.758 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.511 ' HB2' HD12 ' A' ' 19' ' ' LEU . 69.9 m -67.09 178.66 1.36 Allowed 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.255 176.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -55.23 -61.29 2.43 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-O 121.855 0.836 . . . . 0.0 112.587 -172.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 63.8 m80 -78.93 22.06 0.4 Allowed 'General case' 0 C--N 1.281 -2.372 0 CA-C-N 113.93 -1.486 . . . . 0.0 112.362 -174.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.53 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 61.6 mt -131.49 157.77 42.64 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 120.893 0.378 . . . . 0.0 110.141 -178.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -135.12 152.28 20.75 Favored Glycine 0 N--CA 1.43 -1.761 0 N-CA-C 108.95 -1.66 . . . . 0.0 108.95 177.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 42.6 t -87.72 123.85 32.96 Favored 'General case' 0 C--N 1.287 -2.129 0 CA-C-N 117.293 0.546 . . . . 0.0 111.174 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.417 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 33.5 mmtm -87.16 108.9 19.12 Favored 'General case' 0 CA--C 1.468 -2.188 0 C-N-CA 120.424 -0.51 . . . . 0.0 110.114 172.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? -69.45 -5.0 20.95 Favored 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 114.336 -1.302 . . . . 0.0 112.06 -177.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -87.82 -39.49 14.81 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 -176.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 93.1 mmm -113.17 -3.35 13.93 Favored 'General case' 0 N--CA 1.427 -1.582 0 CA-C-N 114.519 -1.219 . . . . 0.0 112.136 -175.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.462 ' HD3' ' HA ' ' A' ' 26' ' ' LYS . 32.6 mmtp 55.11 45.67 25.62 Favored 'General case' 0 C--O 1.248 1.007 0 C-N-CA 124.555 1.142 . . . . 0.0 113.454 -178.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -142.14 162.81 34.54 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.945 176.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 61.4 m -81.76 127.36 32.87 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 115.316 -0.857 . . . . 0.0 111.288 -177.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -118.91 -176.12 3.04 Favored 'General case' 0 C--N 1.296 -1.732 0 N-CA-C 106.516 -1.661 . . . . 0.0 106.516 177.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -73.34 -9.95 59.24 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -176.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -171.61 151.43 2.94 Favored 'General case' 0 N--CA 1.425 -1.715 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 176.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -76.03 -58.18 3.43 Favored 'General case' 0 C--N 1.279 -2.472 0 C-N-CA 119.971 -0.691 . . . . 0.0 109.353 175.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.5 m -162.92 80.88 0.49 Allowed 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 177.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -95.39 113.43 25.09 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.134 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.9 m . . . . . 0 C--N 1.298 -1.671 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.185 179.785 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 . . . . . 0 CA--C 1.476 -1.871 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.9 p -71.18 150.79 45.01 Favored 'General case' 0 N--CA 1.418 -2.06 0 C-N-CA 119.191 -1.004 . . . . 0.0 111.08 178.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.418 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 28.5 mmt180 -95.07 143.4 26.56 Favored 'General case' 0 C--N 1.27 -2.86 0 CA-C-N 113.939 -1.482 . . . . 0.0 108.369 -177.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.433 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 65.6 m-85 -92.65 -165.71 1.4 Allowed 'General case' 0 N--CA 1.394 -3.23 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.574 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.9 ttt -64.32 138.14 58.28 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 -175.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 74.1 6.53 4.76 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.576 1.15 . . . . 0.0 111.815 -179.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -85.96 146.95 21.54 Favored Glycine 0 N--CA 1.436 -1.333 0 N-CA-C 109.819 -1.313 . . . . 0.0 109.819 174.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.418 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 16.2 t70 -67.11 139.92 57.55 Favored 'General case' 0 CA--C 1.495 -1.172 0 C-N-CA 123.694 0.798 . . . . 0.0 112.498 -176.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.568 ' O ' ' HE2' ' A' ' 26' ' ' LYS . 31.3 p -157.63 157.53 33.8 Favored 'General case' 0 C--N 1.297 -1.705 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.409 -177.185 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.2 mp0 -113.29 -37.42 4.71 Favored 'General case' 0 CA--C 1.507 -0.678 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 169.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.436 ' HE2' ' HB2' ' A' ' 13' ' ' GLU . 23.9 pttm -126.42 170.2 12.21 Favored 'General case' 0 N--CA 1.418 -2.034 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.01 -176.149 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -73.01 -19.26 61.24 Favored 'General case' 0 CA--C 1.486 -1.514 0 CA-C-O 121.122 0.487 . . . . 0.0 110.053 -176.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.436 ' HB2' ' HE2' ' A' ' 11' ' ' LYS . 47.2 mt-10 -72.44 -24.84 61.27 Favored 'General case' 0 CA--C 1.482 -1.66 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.996 -177.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 -71.0 -29.2 65.09 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 -178.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 33.5 m -88.76 162.29 16.31 Favored 'General case' 0 N--CA 1.44 -0.926 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.266 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 82.0 m -71.7 178.03 3.82 Favored 'General case' 0 N--CA 1.427 -1.62 0 CA-C-O 121.048 0.451 . . . . 0.0 111.48 176.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -54.84 -59.44 4.72 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.453 1.101 . . . . 0.0 113.926 -169.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 27.1 m170 -81.86 21.85 0.81 Allowed 'General case' 0 C--N 1.285 -2.229 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.076 -173.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.406 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 51.6 mt -125.02 167.92 14.06 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -178.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -140.87 146.2 17.35 Favored Glycine 0 N--CA 1.423 -2.207 0 N-CA-C 108.671 -1.772 . . . . 0.0 108.671 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 47.5 t -88.25 127.32 35.46 Favored 'General case' 0 C--N 1.283 -2.325 0 CA-C-O 121.333 0.587 . . . . 0.0 110.423 -176.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.437 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 56.4 mmtt -93.59 107.95 19.74 Favored 'General case' 0 N--CA 1.413 -2.302 0 C-N-CA 120.372 -0.531 . . . . 0.0 111.0 175.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -72.48 -5.2 35.11 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 114.874 -1.057 . . . . 0.0 111.023 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -86.23 -37.52 18.54 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.509 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 95.6 mmm -112.86 -9.57 13.64 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.368 -174.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.568 ' HE2' ' O ' ' A' ' 9' ' ' CYS . 13.9 mmmm 66.4 35.04 5.91 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 124.738 1.215 . . . . 0.0 112.275 -179.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.509 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 14.2 p90 -147.18 160.46 42.43 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.879 178.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.433 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 57.1 m -79.78 130.71 35.55 Favored 'General case' 0 C--N 1.295 -1.801 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.308 -178.037 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -120.32 -175.53 3.02 Favored 'General case' 0 C--N 1.294 -1.816 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -79.4 1.97 23.41 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.321 0.964 . . . . 0.0 112.789 -178.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -176.27 151.13 0.98 Allowed 'General case' 0 N--CA 1.425 -1.69 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 -177.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.464 ' O ' ' HB ' ' A' ' 33' ' ' THR . 29.3 p90 -101.77 -1.92 31.29 Favored 'General case' 0 C--N 1.283 -2.299 0 O-C-N 123.69 0.619 . . . . 0.0 112.522 -177.06 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.464 ' HB ' ' O ' ' A' ' 32' ' ' PHE . 94.8 m 77.82 98.44 0.06 Allowed 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.817 0.847 . . . . 0.0 109.471 -172.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -81.68 100.22 9.34 Favored 'General case' 0 C--N 1.294 -1.819 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.414 -179.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 46.7 m . . . . . 0 C--N 1.301 -1.522 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.503 179.35 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 . . . . . 0 CA--C 1.486 -1.517 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.4 p -81.09 163.9 22.83 Favored 'General case' 0 N--CA 1.419 -2.001 0 CA-C-O 121.633 0.73 . . . . 0.0 110.883 178.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.573 ' HB2' ' SG ' ' A' ' 28' ' ' CYS . 20.6 mmt180 -90.85 132.16 36.06 Favored 'General case' 0 C--N 1.28 -2.456 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 178.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.456 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 48.0 m-85 -84.93 -165.66 1.26 Allowed 'General case' 0 N--CA 1.397 -3.1 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 172.144 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.7 ttt -66.39 137.53 56.94 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -175.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 77.47 1.09 2.98 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.74 1.216 . . . . 0.0 111.436 -178.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.18 136.27 16.5 Favored Glycine 0 N--CA 1.429 -1.768 0 N-CA-C 108.877 -1.689 . . . . 0.0 108.877 174.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -60.0 140.49 56.74 Favored 'General case' 0 CA--C 1.492 -1.26 0 C-N-CA 123.266 0.627 . . . . 0.0 112.588 -176.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.485 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 19.2 p -141.51 154.95 45.81 Favored 'General case' 0 N--CA 1.416 -2.174 0 C-N-CA 119.585 -0.846 . . . . 0.0 111.249 -176.152 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -118.14 -39.64 3.04 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 175.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.9 pttm -135.23 172.9 12.35 Favored 'General case' 0 N--CA 1.422 -1.872 0 CA-C-N 114.754 -1.112 . . . . 0.0 108.099 -178.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -75.6 -16.13 60.26 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-O 121.022 0.439 . . . . 0.0 111.025 -176.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -70.37 -24.07 62.89 Favored 'General case' 0 CA--C 1.489 -1.4 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.486 -178.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -72.23 -31.55 65.93 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -178.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 17.3 m -89.28 155.08 19.61 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.504 -176.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.432 ' HB2' HD12 ' A' ' 19' ' ' LEU . 43.9 m -67.01 178.03 1.53 Allowed 'General case' 0 C--N 1.302 -1.466 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.562 177.457 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -63.07 -55.12 28.17 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -171.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -74.09 11.48 0.91 Allowed 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.945 -178.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.556 HD23 ' HA ' ' A' ' 30' ' ' TRP . 62.2 mt -128.21 -179.42 5.0 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 -177.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -161.5 165.36 35.52 Favored Glycine 0 N--CA 1.418 -2.554 0 N-CA-C 108.936 -1.666 . . . . 0.0 108.936 177.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.3 t -92.51 124.83 36.84 Favored 'General case' 0 C--N 1.289 -2.052 0 CA-C-O 121.343 0.592 . . . . 0.0 110.31 -176.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.452 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 30.1 mmtp -99.86 112.29 24.56 Favored 'General case' 0 C--N 1.287 -2.124 0 CA-C-O 121.103 0.477 . . . . 0.0 110.374 173.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.9 mpt_? -73.11 -10.84 60.21 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 114.357 -1.292 . . . . 0.0 111.109 -177.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -85.26 -30.21 23.99 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -177.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 80.8 mmm -111.22 -10.69 14.27 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 114.407 -1.27 . . . . 0.0 110.856 -173.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.56 ' HD2' ' N ' ' A' ' 26' ' ' LYS . 9.6 mptt 62.1 26.1 15.68 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 125.816 1.646 . . . . 0.0 110.864 179.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -142.59 165.97 25.95 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.605 179.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.573 ' SG ' ' HB2' ' A' ' 3' ' ' ARG . 63.1 m -81.38 131.28 35.28 Favored 'General case' 0 N--CA 1.414 -2.253 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.37 -179.163 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.404 ' C ' ' H ' ' A' ' 31' ' ' ASP . . . -118.55 -175.82 2.96 Favored 'General case' 0 C--N 1.283 -2.308 0 N-CA-C 105.583 -2.006 . . . . 0.0 105.583 176.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.556 ' HA ' HD23 ' A' ' 19' ' ' LEU . 98.5 m95 -80.87 19.52 0.85 Allowed 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 119.303 0.956 . . . . 0.0 110.349 178.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.404 ' H ' ' C ' ' A' ' 29' ' ' ALA . 36.1 t70 -159.5 134.73 8.24 Favored 'General case' 0 N--CA 1.401 -2.878 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.387 -170.365 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 47.0 p90 -81.35 -174.19 4.78 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.735 177.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 94.9 m -94.73 106.8 18.8 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-O 121.537 0.684 . . . . 0.0 112.269 -178.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -116.21 98.77 6.79 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.363 -0.976 . . . . 0.0 108.363 176.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 50.2 m . . . . . 0 C--O 1.25 1.109 0 N-CA-C 109.684 -0.488 . . . . 0.0 109.684 179.257 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 . . . . . 0 CA--C 1.496 -1.128 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.3 p -86.28 158.55 19.66 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 121.818 0.818 . . . . 0.0 111.796 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 39.5 mmt180 -86.92 133.95 33.56 Favored 'General case' 0 C--N 1.282 -2.332 0 CA-C-N 114.3 -1.318 . . . . 0.0 110.079 178.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.416 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 25.0 m-85 -84.71 -166.6 1.52 Allowed 'General case' 0 N--CA 1.399 -3.008 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.156 174.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.473 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 11.3 ttt -65.74 138.8 58.19 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 -176.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 77.03 2.6 3.27 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.205 1.402 . . . . 0.0 111.832 -179.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -82.62 146.69 24.75 Favored Glycine 0 N--CA 1.435 -1.427 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 175.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.417 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 14.5 t70 -64.3 145.14 56.5 Favored 'General case' 0 CA--C 1.492 -1.251 0 C-N-CA 123.106 0.562 . . . . 0.0 112.207 -178.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.423 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 31.0 p -152.59 149.24 28.26 Favored 'General case' 0 N--CA 1.417 -2.094 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.145 -178.112 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -113.21 -23.73 9.79 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 173.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.8 pttm -145.67 172.25 13.55 Favored 'General case' 0 N--CA 1.423 -1.816 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 179.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -74.2 -16.71 60.96 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 121.337 0.589 . . . . 0.0 110.143 -177.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -73.15 -22.36 60.53 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-N 114.831 -1.077 . . . . 0.0 110.393 -178.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -77.02 -24.98 52.08 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 -179.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.8 m -89.94 161.62 15.82 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 115.157 -0.928 . . . . 0.0 109.034 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.417 ' HB2' HD12 ' A' ' 19' ' ' LEU . 56.4 m -70.38 178.42 2.91 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.517 174.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -61.55 -51.01 70.36 Favored 'General case' 0 CA--C 1.498 -1.019 0 CA-C-O 121.542 0.687 . . . . 0.0 112.799 -171.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 38.4 m-70 -76.55 14.06 0.86 Allowed 'General case' 0 C--N 1.283 -2.298 0 CA-C-N 114.658 -1.155 . . . . 0.0 112.417 -176.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.417 HD12 ' HB2' ' A' ' 16' ' ' CYS . 46.7 mt -128.93 153.2 47.74 Favored 'General case' 0 N--CA 1.433 -1.318 0 CA-C-O 121.151 0.5 . . . . 0.0 110.207 -175.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -131.16 145.77 17.25 Favored Glycine 0 N--CA 1.426 -1.992 0 N-CA-C 108.814 -1.714 . . . . 0.0 108.814 177.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 39.0 t -84.81 111.88 20.02 Favored 'General case' 0 C--N 1.284 -2.248 0 CA-C-N 116.96 0.38 . . . . 0.0 111.231 -175.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.437 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 71.3 mmtt -72.53 113.34 9.45 Favored 'General case' 0 CA--C 1.482 -1.66 0 O-C-N 121.301 -0.874 . . . . 0.0 108.667 177.119 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.6 mmt180 -69.38 -12.74 61.91 Favored 'General case' 0 C--N 1.315 -0.897 0 O-C-N 124.49 1.119 . . . . 0.0 109.896 -178.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -89.59 -29.93 18.52 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-O 122.093 0.949 . . . . 0.0 109.378 -175.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.577 ' HB3' ' CD1' ' A' ' 27' ' ' TYR . 23.3 mmt -111.81 -16.28 13.2 Favored 'General case' 0 C--N 1.294 -1.808 0 CA-C-N 114.673 -1.149 . . . . 0.0 112.268 -173.08 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 66.44 33.7 6.69 Favored 'General case' 0 CA--C 1.499 -1.015 0 C-N-CA 124.372 1.069 . . . . 0.0 110.119 -178.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.577 ' CD1' ' HB3' ' A' ' 25' ' ' MET . 4.0 p90 -143.45 158.29 43.76 Favored 'General case' 0 CA--C 1.489 -1.369 0 CA-C-N 114.511 -1.222 . . . . 0.0 112.55 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.468 ' O ' ' HA ' ' A' ' 5' ' ' MET . 77.0 m -78.86 123.84 27.63 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.494 -1.23 . . . . 0.0 109.963 -178.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.473 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -119.61 -172.39 2.32 Favored 'General case' 0 C--N 1.289 -2.036 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 177.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -78.55 1.15 23.44 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 119.155 0.889 . . . . 0.0 112.915 -176.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.437 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 19.5 t70 -179.73 148.78 0.34 Allowed 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 125.158 1.383 . . . . 0.0 107.914 177.706 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.1 p90 -83.04 -28.16 29.8 Favored 'General case' 0 C--N 1.287 -2.132 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 -175.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.6 m -56.97 136.62 56.17 Favored 'General case' 0 C--O 1.246 0.911 0 C-N-CA 123.759 0.824 . . . . 0.0 112.355 -173.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -98.53 177.09 5.44 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.692 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 C--N 1.302 -1.468 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 -179.467 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 . . . . . 0 CA--C 1.482 -1.647 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 6.2 p -92.63 168.78 11.0 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 174.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.45 ' HD2' ' HA3' ' A' ' 7' ' ' GLY . 16.4 tpp180 -92.26 124.98 36.73 Favored 'General case' 0 C--N 1.272 -2.761 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -88.39 -167.36 1.86 Allowed 'General case' 0 N--CA 1.412 -2.363 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.707 -177.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 13.3 ttt -64.23 139.16 58.74 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.704 -173.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 74.28 8.6 4.56 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.934 1.294 . . . . 0.0 111.674 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.45 ' HA3' ' HD2' ' A' ' 3' ' ' ARG . . . -95.06 145.07 17.56 Favored Glycine 0 N--CA 1.419 -2.498 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 175.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.485 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 20.9 t70 -64.78 143.66 57.78 Favored 'General case' 0 CA--C 1.493 -1.248 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -176.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 23.9 p -150.51 149.69 30.29 Favored 'General case' 0 N--CA 1.417 -2.11 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.872 -177.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -112.14 -35.52 5.62 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 175.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.9 pttp -134.34 162.33 32.5 Favored 'General case' 0 N--CA 1.42 -1.95 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.16 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -64.14 -18.68 64.68 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-O 121.04 0.447 . . . . 0.0 111.946 -178.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -71.48 -21.96 61.87 Favored 'General case' 0 CA--C 1.493 -1.245 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.953 -177.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -75.24 -30.8 60.64 Favored 'General case' 0 N--CA 1.42 -1.928 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.971 -178.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 20.7 m -90.22 155.46 18.99 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.042 -178.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.498 ' HB2' HD13 ' A' ' 19' ' ' LEU . 32.5 m -61.41 176.97 0.42 Allowed 'General case' 0 C--N 1.298 -1.651 0 C-N-CA 124.515 1.126 . . . . 0.0 112.942 176.213 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 54.1 mttp -66.36 -48.48 70.06 Favored 'General case' 0 CA--C 1.496 -1.098 0 CA-C-O 122.377 1.084 . . . . 0.0 109.902 -175.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 12.8 m170 -68.14 -1.39 5.91 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 113.597 -1.638 . . . . 0.0 112.708 -178.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.498 HD13 ' HB2' ' A' ' 16' ' ' CYS . 5.8 mp -130.51 176.5 8.11 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-O 121.251 0.548 . . . . 0.0 111.473 -175.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.73 160.77 28.01 Favored Glycine 0 N--CA 1.419 -2.468 0 N-CA-C 108.506 -1.837 . . . . 0.0 108.506 177.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 44.4 t -93.7 120.58 34.15 Favored 'General case' 0 C--N 1.289 -2.049 0 CA-C-N 117.351 0.576 . . . . 0.0 110.412 -177.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.415 ' HE2' ' O ' ' A' ' 31' ' ' ASP . 73.8 mmtt -85.15 108.72 17.83 Favored 'General case' 0 CA--C 1.455 -2.687 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 173.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.538 ' H ' ' HD2' ' A' ' 23' ' ' ARG . 1.3 mpt_? -79.68 -8.08 58.99 Favored 'General case' 0 C--N 1.282 -2.328 0 CA-C-N 114.991 -1.004 . . . . 0.0 108.64 -174.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -90.01 -27.77 19.53 Favored 'General case' 0 CA--C 1.501 -0.918 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.128 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.589 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 90.5 mmm -109.64 -19.06 13.32 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.655 -172.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.485 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 71.8 mmtt 72.84 29.64 1.85 Allowed 'General case' 0 CA--C 1.497 -1.088 0 C-N-CA 125.555 1.542 . . . . 0.0 111.568 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.589 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 27.4 p90 -147.89 158.68 44.16 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.875 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 58.2 m -77.44 130.8 37.51 Favored 'General case' 0 C--N 1.291 -1.97 0 CA-C-N 114.676 -1.147 . . . . 0.0 110.51 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -122.73 -178.18 3.86 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 177.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -76.05 8.2 3.42 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 119.307 0.958 . . . . 0.0 113.072 -176.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.415 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 3.8 p30 -169.51 174.67 5.8 Favored 'General case' 0 N--CA 1.409 -2.501 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 -179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 10.3 p90 -118.45 -47.71 2.53 Favored 'General case' 0 C--N 1.277 -2.552 0 O-C-N 124.018 0.824 . . . . 0.0 111.453 179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.3 p -118.77 4.48 11.55 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -177.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -78.59 -52.8 7.94 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.081 -177.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 34.3 p . . . . . 0 C--O 1.259 1.602 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.514 178.62 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 . . . . . 0 CA--C 1.501 -0.933 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.5 p -126.15 159.6 32.46 Favored 'General case' 0 N--CA 1.423 -1.782 0 CA-C-O 121.003 0.43 . . . . 0.0 110.361 177.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.453 ' HB3' ' HA3' ' A' ' 7' ' ' GLY . 9.0 mpt_? -83.83 131.47 34.88 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.882 178.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.486 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 79.1 m-85 -89.79 -163.06 0.95 Allowed 'General case' 0 N--CA 1.391 -3.377 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 175.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.2 ttt -66.56 134.0 51.48 Favored 'General case' 0 C--N 1.299 -1.587 0 C-N-CA 120.279 -0.568 . . . . 0.0 109.934 -173.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 76.57 6.48 3.43 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 124.955 1.302 . . . . 0.0 111.966 -178.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.453 ' HA3' ' HB3' ' A' ' 3' ' ' ARG . . . -79.02 156.37 41.84 Favored Glycine 0 N--CA 1.443 -0.839 0 N-CA-C 108.047 -2.021 . . . . 0.0 108.047 172.038 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -88.36 140.2 29.71 Favored 'General case' 0 CA--C 1.476 -1.875 0 CA-C-N 118.256 1.028 . . . . 0.0 110.733 -172.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.9 p -144.04 147.22 33.54 Favored 'General case' 0 C--N 1.272 -2.797 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.984 -175.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -110.34 -30.0 7.88 Favored 'General case' 0 C--N 1.293 -1.89 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 177.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.509 ' HD2' ' OE1' ' A' ' 13' ' ' GLU . 17.2 pttp -139.43 167.18 22.66 Favored 'General case' 0 N--CA 1.426 -1.649 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 177.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.9 m-20 -70.73 -18.17 62.8 Favored 'General case' 0 CA--C 1.493 -1.212 0 CA-C-O 121.121 0.486 . . . . 0.0 110.911 -174.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.509 ' OE1' ' HD2' ' A' ' 11' ' ' LYS . 36.4 mt-10 -70.88 -19.13 62.65 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.119 -176.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -79.84 -24.73 41.11 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-N 115.065 -0.97 . . . . 0.0 109.314 -176.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 35.0 m -92.83 159.71 15.26 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.425 ' HB2' HD13 ' A' ' 19' ' ' LEU . 38.3 m -64.33 174.06 1.8 Allowed 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.536 177.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 31.6 mtpt -75.99 -33.4 59.72 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 121.655 0.741 . . . . 0.0 110.978 -171.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 36.3 m80 -81.8 6.57 15.15 Favored 'General case' 0 C--N 1.297 -1.713 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.208 178.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.425 HD13 ' HB2' ' A' ' 16' ' ' CYS . 5.2 mp -131.84 -180.0 5.73 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-O 121.066 0.46 . . . . 0.0 110.797 -178.69 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -148.03 163.04 28.86 Favored Glycine 0 N--CA 1.424 -2.115 0 N-CA-C 109.661 -1.376 . . . . 0.0 109.661 177.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 43.1 t -95.96 120.34 36.07 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 117.304 0.552 . . . . 0.0 109.714 -178.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.457 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 73.1 mmtt -81.62 107.28 14.24 Favored 'General case' 0 CA--C 1.453 -2.774 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 172.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.464 ' H ' ' HD2' ' A' ' 23' ' ' ARG . 2.1 mpt_? -75.56 -3.16 32.65 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.411 -173.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -90.44 -31.68 16.72 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-O 122.198 0.999 . . . . 0.0 109.081 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 87.9 mmm -111.86 -9.9 14.03 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.964 -175.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp 63.71 36.69 10.53 Favored 'General case' 0 CA--C 1.503 -0.843 0 C-N-CA 124.455 1.102 . . . . 0.0 111.852 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -143.07 159.04 43.01 Favored 'General case' 0 CA--C 1.486 -1.505 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.438 177.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.486 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 39.2 m -82.03 130.28 35.03 Favored 'General case' 0 C--N 1.284 -2.264 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.988 -176.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -121.31 -175.47 3.08 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 106.025 -1.843 . . . . 0.0 106.025 176.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -79.8 10.97 3.54 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 119.588 1.085 . . . . 0.0 113.115 -175.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -172.03 165.79 6.23 Favored 'General case' 0 N--CA 1.415 -2.18 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 178.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.8 p90 -111.25 -53.18 2.73 Favored 'General case' 0 C--N 1.277 -2.581 0 O-C-N 123.97 0.794 . . . . 0.0 110.033 175.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 88.6 m -149.15 106.71 3.65 Favored 'General case' 0 N--CA 1.428 -1.573 0 N-CA-C 106.765 -1.569 . . . . 0.0 106.765 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -75.22 102.6 5.06 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-O 121.156 0.503 . . . . 0.0 110.566 -177.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 38.9 m . . . . . 0 C--N 1.3 -1.563 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.011 175.264 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 . . . . . 0 CA--C 1.489 -1.375 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.6 p -96.54 160.44 14.4 Favored 'General case' 0 N--CA 1.413 -2.295 0 CA-C-O 122.031 0.92 . . . . 0.0 112.237 -177.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -91.15 136.82 32.82 Favored 'General case' 0 C--N 1.279 -2.498 0 CA-C-N 113.964 -1.471 . . . . 0.0 108.609 177.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.426 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 51.2 m-85 -85.19 -167.55 1.88 Allowed 'General case' 0 N--CA 1.401 -2.923 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.087 178.077 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 12.6 ttt -66.54 136.51 55.75 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 -175.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 76.46 9.58 3.06 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 124.99 1.316 . . . . 0.0 111.765 -178.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.417 ' O ' ' HA ' ' A' ' 27' ' ' TYR . . . -88.14 145.45 19.16 Favored Glycine 0 N--CA 1.44 -1.08 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 173.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.555 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 15.3 t70 -60.91 143.02 55.83 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.704 0.802 . . . . 0.0 112.258 -177.373 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 21.1 p -153.75 148.92 26.91 Favored 'General case' 0 C--N 1.311 -1.092 0 C-N-CA 119.226 -0.99 . . . . 0.0 113.374 -177.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -106.02 -38.53 6.28 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 173.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.579 ' HG2' ' OD1' ' A' ' 14' ' ' ASP . 5.0 ptpp? -137.37 177.21 8.04 Favored 'General case' 0 N--CA 1.414 -2.258 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 -175.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -74.54 -18.12 60.64 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-O 121.163 0.506 . . . . 0.0 111.038 -175.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.485 ' H ' ' HG3' ' A' ' 11' ' ' LYS . 12.0 mm-40 -72.98 -21.58 60.82 Favored 'General case' 0 CA--C 1.495 -1.141 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.919 -178.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.579 ' OD1' ' HG2' ' A' ' 11' ' ' LYS . 31.0 m-20 -72.99 -27.61 61.9 Favored 'General case' 0 N--CA 1.431 -1.391 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.0 m -92.6 164.32 13.47 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.893 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.41 ' HB2' HD12 ' A' ' 19' ' ' LEU . 62.4 m -70.57 176.51 4.05 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.93 175.121 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -68.91 -49.9 54.16 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-O 121.542 0.687 . . . . 0.0 112.089 -170.133 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 55.9 m80 -76.94 15.67 0.65 Allowed 'General case' 0 C--N 1.287 -2.122 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.385 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.426 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 87.0 mt -122.08 174.68 6.79 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.88 144.09 11.56 Favored Glycine 0 C--N 1.306 -1.09 0 N-CA-C 110.221 -1.152 . . . . 0.0 110.221 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 39.2 t -90.23 123.02 33.68 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -174.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.529 ' HE2' ' O ' ' A' ' 32' ' ' PHE . 41.2 mmtt -90.13 110.8 21.8 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.786 -0.571 . . . . 0.0 110.106 168.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -76.26 -12.79 60.14 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.79 -177.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -87.88 -26.28 22.83 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 -178.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.549 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 91.9 mmm -108.0 -16.2 14.35 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 114.721 -1.127 . . . . 0.0 110.687 -173.529 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.555 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 32.2 mmmt 66.29 33.04 7.4 Favored 'General case' 0 CA--C 1.492 -1.28 0 C-N-CA 124.574 1.15 . . . . 0.0 112.31 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.549 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 11.4 p90 -150.05 159.26 44.54 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.925 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.7 m -82.33 130.85 35.19 Favored 'General case' 0 C--N 1.289 -2.057 0 CA-C-N 113.806 -1.543 . . . . 0.0 110.469 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -115.84 -172.27 2.13 Favored 'General case' 0 C--N 1.291 -1.939 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 175.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -76.52 -19.18 58.23 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.65 1.114 . . . . 0.0 111.056 178.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -175.74 144.2 0.63 Allowed 'General case' 0 C--N 1.282 -2.358 0 N-CA-C 103.873 -2.64 . . . . 0.0 103.873 177.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.529 ' O ' ' HE2' ' A' ' 22' ' ' LYS . 35.5 p90 -79.51 -12.07 59.88 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-O 121.668 0.747 . . . . 0.0 109.344 177.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.3 m -85.96 90.11 7.99 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.736 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -89.57 -28.71 19.39 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.432 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 15.3 t . . . . . 0 C--N 1.309 -1.164 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 178.527 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 CA--C 1.487 -1.46 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.1 p -77.6 158.35 29.83 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 121.574 0.702 . . . . 0.0 110.392 175.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -92.29 140.73 29.3 Favored 'General case' 0 C--N 1.273 -2.721 0 CA-C-N 114.744 -1.117 . . . . 0.0 109.966 -178.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.49 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 60.2 m-85 -93.23 -165.9 1.42 Allowed 'General case' 0 N--CA 1.396 -3.16 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.919 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.514 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 10.7 ttt -62.81 135.04 57.13 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 -176.121 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 76.8 3.99 3.41 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 125.452 1.501 . . . . 0.0 111.753 -178.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.39 149.21 38.44 Favored Glycine 0 N--CA 1.439 -1.101 0 N-CA-C 108.428 -1.869 . . . . 0.0 108.428 171.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -76.63 146.34 38.27 Favored 'General case' 0 CA--C 1.483 -1.602 0 CA-C-N 117.258 0.529 . . . . 0.0 110.073 -174.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.3 p -146.02 150.7 36.48 Favored 'General case' 0 C--N 1.278 -2.505 0 C-N-CA 118.556 -1.258 . . . . 0.0 112.368 -176.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -108.16 -43.76 4.31 Favored 'General case' 0 N--CA 1.433 -1.319 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 173.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.547 ' HD2' ' OE1' ' A' ' 13' ' ' GLU . 46.1 pttt -131.2 169.91 15.29 Favored 'General case' 0 N--CA 1.419 -1.991 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.152 -179.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -68.06 -18.76 64.77 Favored 'General case' 0 CA--C 1.491 -1.327 0 CA-C-O 121.093 0.473 . . . . 0.0 110.864 -179.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.547 ' OE1' ' HD2' ' A' ' 11' ' ' LYS . 1.2 mp0 -67.15 -24.7 65.92 Favored 'General case' 0 CA--C 1.492 -1.253 0 CA-C-N 115.084 -0.962 . . . . 0.0 111.027 -179.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -72.19 -26.62 62.13 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 121.419 0.628 . . . . 0.0 109.634 -178.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 18.4 m -93.49 159.19 15.35 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.793 -178.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.425 ' HB2' HD12 ' A' ' 19' ' ' LEU . 63.9 m -67.08 176.0 2.33 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.727 174.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -58.74 -57.12 14.43 Favored 'General case' 0 CA--C 1.504 -0.801 0 C-N-CA 123.909 0.884 . . . . 0.0 113.079 -171.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 28.9 m80 -79.08 15.01 1.23 Allowed 'General case' 0 C--N 1.283 -2.304 0 CA-C-N 114.928 -1.033 . . . . 0.0 112.017 -174.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.49 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 68.1 mt -123.6 169.05 11.84 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -179.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -144.8 154.19 25.7 Favored Glycine 0 N--CA 1.418 -2.557 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 178.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.4 t -89.24 108.93 19.89 Favored 'General case' 0 C--N 1.285 -2.223 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -177.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.415 ' HE2' ' HB3' ' A' ' 29' ' ' ALA . 72.8 mmtt -70.88 112.94 7.45 Favored 'General case' 0 CA--C 1.473 -2.013 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 176.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -74.45 -8.43 56.27 Favored 'General case' 0 C--N 1.292 -1.933 0 O-C-N 124.748 1.28 . . . . 0.0 110.119 -176.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -88.97 -36.35 15.91 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 -176.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.446 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 96.9 mmm -112.74 -12.85 13.3 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 114.43 -1.259 . . . . 0.0 112.931 -171.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.9 mmtp 66.95 38.08 3.7 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 125.006 1.322 . . . . 0.0 111.542 -179.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.446 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 8.0 p90 -145.53 161.45 39.74 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.375 -0.83 . . . . 0.0 112.114 178.131 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 59.2 m -81.3 128.6 33.99 Favored 'General case' 0 N--CA 1.419 -1.992 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.452 -176.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.514 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -124.67 -171.65 2.4 Favored 'General case' 0 C--N 1.284 -2.245 0 N-CA-C 106.292 -1.744 . . . . 0.0 106.292 175.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -75.31 3.01 9.75 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 118.767 0.712 . . . . 0.0 112.748 -178.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -173.72 171.31 3.82 Favored 'General case' 0 N--CA 1.416 -2.154 0 N-CA-C 106.65 -1.611 . . . . 0.0 106.65 175.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.468 ' O ' ' HB ' ' A' ' 33' ' ' THR . 26.6 p90 -101.18 5.9 42.86 Favored 'General case' 0 C--N 1.278 -2.502 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -176.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.468 ' HB ' ' O ' ' A' ' 32' ' ' PHE . 99.8 m 73.42 106.52 0.07 Allowed 'General case' 0 C--O 1.24 0.6 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -170.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -64.39 104.04 0.72 Allowed 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.926 0.869 . . . . 0.0 112.066 -173.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.3 m . . . . . 0 C--O 1.257 1.488 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 179.697 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 . . . . . 0 CA--C 1.496 -1.127 0 N-CA-C 107.537 -1.282 . . . . 0.0 107.537 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.4 p -91.84 169.34 10.77 Favored 'General case' 0 N--CA 1.423 -1.779 0 CA-C-O 121.306 0.574 . . . . 0.0 110.558 177.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.552 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 39.0 mmt180 -102.58 135.39 44.31 Favored 'General case' 0 C--N 1.291 -1.959 0 CA-C-N 115.109 -0.95 . . . . 0.0 109.501 -179.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.539 ' O ' ' HB2' ' A' ' 28' ' ' CYS . 87.5 m-85 -95.23 -161.77 0.89 Allowed 'General case' 0 N--CA 1.403 -2.777 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 174.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.59 ' HA ' ' O ' ' A' ' 28' ' ' CYS . 49.4 ttm -62.72 135.87 57.58 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 82.13 -8.82 1.24 Allowed 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 125.069 1.348 . . . . 0.0 112.115 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.426 ' HA3' ' HB3' ' A' ' 3' ' ' ARG . . . -76.8 139.65 23.91 Favored Glycine 0 N--CA 1.434 -1.44 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 176.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.552 ' O ' ' HG3' ' A' ' 3' ' ' ARG . 17.2 t70 -69.54 141.12 53.9 Favored 'General case' 0 CA--C 1.487 -1.476 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -173.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.489 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 23.4 p -143.42 152.77 41.95 Favored 'General case' 0 N--CA 1.414 -2.235 0 C-N-CA 119.783 -0.767 . . . . 0.0 111.51 -176.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -113.59 -35.72 5.14 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 174.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 45.7 pttt -141.57 177.52 8.08 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 124.45 1.1 . . . . 0.0 108.36 179.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -73.63 -16.07 61.24 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 122.227 -0.296 . . . . 0.0 111.197 -175.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -67.87 -25.24 65.42 Favored 'General case' 0 CA--C 1.496 -1.134 0 CA-C-O 121.656 0.741 . . . . 0.0 110.497 179.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -68.7 -31.78 71.12 Favored 'General case' 0 N--CA 1.425 -1.677 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.121 -179.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 14.9 m -86.82 159.19 19.17 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.257 -176.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 63.9 m -66.14 178.47 1.14 Allowed 'General case' 0 C--N 1.307 -1.283 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.288 174.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -61.46 -52.31 65.05 Favored 'General case' 0 CA--C 1.485 -1.552 0 CA-C-O 121.701 0.762 . . . . 0.0 112.246 -171.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 30.3 m-70 -74.52 3.92 6.89 Favored 'General case' 0 C--N 1.28 -2.427 0 CA-C-N 114.204 -1.362 . . . . 0.0 113.35 -175.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.0 mp -123.93 167.94 13.46 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.571 0.701 . . . . 0.0 112.781 -177.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -135.5 159.96 24.31 Favored Glycine 0 N--CA 1.433 -1.558 0 N-CA-C 109.157 -1.577 . . . . 0.0 109.157 179.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 32.1 t -94.35 130.65 40.59 Favored 'General case' 0 C--N 1.285 -2.221 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -174.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.436 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 58.9 mmtt -96.95 107.21 19.69 Favored 'General case' 0 CA--C 1.474 -1.952 0 CA-C-O 121.351 0.596 . . . . 0.0 110.731 172.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -72.22 -12.04 60.99 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 114.563 -1.198 . . . . 0.0 111.837 -176.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -89.32 -26.68 20.98 Favored 'General case' 0 C--N 1.302 -1.5 0 CA-C-O 121.972 0.891 . . . . 0.0 108.858 -176.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.479 ' HB3' ' CE1' ' A' ' 27' ' ' TYR . 97.5 mmm -112.1 -8.6 14.01 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.19 -176.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm 63.45 28.75 15.48 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.846 1.258 . . . . 0.0 112.642 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.479 ' CE1' ' HB3' ' A' ' 25' ' ' MET . 8.7 p90 -143.71 161.06 39.55 Favored 'General case' 0 C--N 1.286 -2.179 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.662 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.59 ' O ' ' HA ' ' A' ' 5' ' ' MET . 66.6 m -81.14 140.17 35.17 Favored 'General case' 0 C--N 1.285 -2.213 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.666 -179.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -131.52 178.53 6.66 Favored 'General case' 0 C--N 1.297 -1.686 0 N-CA-C 105.499 -2.037 . . . . 0.0 105.499 177.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -68.56 -12.16 60.91 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 119.935 1.243 . . . . 0.0 113.801 -175.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -166.77 142.12 4.31 Favored 'General case' 0 N--CA 1.415 -2.194 0 CA-C-O 121.335 0.588 . . . . 0.0 109.76 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 33.6 p90 -75.79 -22.77 56.07 Favored 'General case' 0 C--N 1.28 -2.431 0 CA-C-N 114.928 -1.033 . . . . 0.0 112.554 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.6 m -95.54 -0.41 52.08 Favored 'General case' 0 CA--C 1.553 1.091 0 CA-C-O 121.781 0.801 . . . . 0.0 109.756 -178.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -55.39 139.26 43.76 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.226 178.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 15.4 t . . . . . 0 C--N 1.309 -1.159 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.285 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 24.5 t70 . . . . . 0 CA--C 1.494 -1.191 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 20.9 p -108.55 158.22 17.76 Favored 'General case' 0 N--CA 1.405 -2.709 0 CA-C-O 121.629 0.728 . . . . 0.0 110.835 179.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 13.0 tpp180 -86.06 129.86 34.71 Favored 'General case' 0 C--N 1.273 -2.728 0 CA-C-N 114.357 -1.292 . . . . 0.0 108.717 -178.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -86.55 -168.31 2.19 Favored 'General case' 0 N--CA 1.408 -2.544 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.062 178.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.461 ' HG3' ' HA ' ' A' ' 29' ' ' ALA . 12.8 ttt -69.56 140.08 53.8 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 120.828 0.347 . . . . 0.0 111.16 -172.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 74.48 -2.37 2.83 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.745 1.618 . . . . 0.0 112.253 -179.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.17 148.64 30.02 Favored Glycine 0 N--CA 1.422 -2.236 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 176.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -63.13 139.76 58.8 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 123.774 0.83 . . . . 0.0 112.636 -177.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.438 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 23.5 p -146.0 153.9 41.28 Favored 'General case' 0 C--N 1.287 -2.109 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.452 -178.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -112.47 -36.27 5.3 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 177.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -145.54 167.56 22.73 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 114.159 -1.382 . . . . 0.0 108.475 -179.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -67.72 -18.48 64.92 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.23 0.538 . . . . 0.0 111.509 -176.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -66.01 -27.26 67.99 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.853 -178.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -79.24 -27.2 42.41 Favored 'General case' 0 N--CA 1.431 -1.403 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.56 -175.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.6 m -88.65 163.49 15.77 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.417 -178.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.472 ' HB2' HD13 ' A' ' 19' ' ' LEU . 31.4 m -69.37 172.03 7.74 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.113 175.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -66.18 -47.15 74.91 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-O 121.568 0.699 . . . . 0.0 112.027 -172.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 51.4 m80 -72.02 1.79 6.74 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.719 179.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.472 HD13 ' HB2' ' A' ' 16' ' ' CYS . 5.3 mp -117.65 178.47 4.38 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-O 121.093 0.473 . . . . 0.0 111.256 179.045 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -151.09 151.93 23.83 Favored Glycine 0 N--CA 1.423 -2.179 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 177.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 38.0 t -93.26 116.56 29.12 Favored 'General case' 0 C--N 1.27 -2.872 0 CA-C-N 117.014 0.407 . . . . 0.0 110.251 -175.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.534 ' HE3' ' O ' ' A' ' 33' ' ' THR . 39.9 mmtm -77.33 110.52 12.13 Favored 'General case' 0 CA--C 1.461 -2.45 0 N-CA-C 106.565 -1.643 . . . . 0.0 106.565 172.417 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.523 ' H ' ' HD2' ' A' ' 23' ' ' ARG . 1.1 mpt_? -76.8 -13.25 60.03 Favored 'General case' 0 C--N 1.286 -2.18 0 O-C-N 123.884 0.74 . . . . 0.0 109.22 -173.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -90.74 -24.71 20.3 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 122.181 0.991 . . . . 0.0 109.21 -177.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.578 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 96.8 mmm -110.0 -7.06 15.0 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 114.765 -1.107 . . . . 0.0 111.229 -175.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.499 ' HD2' ' N ' ' A' ' 26' ' ' LYS . 3.4 mptp? 61.92 26.28 15.87 Favored 'General case' 0 CA--C 1.505 -0.769 0 C-N-CA 125.271 1.428 . . . . 0.0 111.769 177.09 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.578 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 23.1 p90 -140.42 158.88 43.34 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.788 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.438 ' SG ' ' HB3' ' A' ' 9' ' ' CYS . 59.5 m -81.69 131.7 35.27 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.111 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.461 ' HA ' ' HG3' ' A' ' 5' ' ' MET . . . -124.14 -174.17 2.94 Favored 'General case' 0 C--N 1.288 -2.102 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 176.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -76.61 -1.83 29.55 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 120.248 1.386 . . . . 0.0 113.203 -176.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -169.27 163.14 10.79 Favored 'General case' 0 N--CA 1.417 -2.107 0 N-CA-C 106.439 -1.689 . . . . 0.0 106.439 179.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 9.6 p90 -103.72 4.66 35.55 Favored 'General case' 0 C--N 1.268 -2.937 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -173.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.534 ' O ' ' HE3' ' A' ' 22' ' ' LYS . 25.8 m -84.99 132.31 34.36 Favored 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 120.269 -0.573 . . . . 0.0 110.28 -175.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -52.01 -54.26 32.06 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-O 121.436 0.636 . . . . 0.0 111.232 -177.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 25.4 m . . . . . 0 C--N 1.303 -1.441 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.167 179.865 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 . . . . . 0 C--O 1.237 0.401 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.6 p -90.54 164.26 14.29 Favored 'General case' 0 CA--C 1.494 -1.188 0 CA-C-O 121.63 0.728 . . . . 0.0 111.319 -179.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -93.47 132.8 37.4 Favored 'General case' 0 C--N 1.278 -2.528 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.679 -179.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.517 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 53.6 m-85 -85.05 -170.79 3.3 Favored 'General case' 0 N--CA 1.398 -3.05 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.579 176.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 10.3 ttt -62.97 134.09 55.63 Favored 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 -178.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 81.65 2.44 1.47 Allowed 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 125.067 1.347 . . . . 0.0 112.139 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -86.45 146.6 20.96 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 174.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.454 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 28.4 t70 -65.96 142.77 57.75 Favored 'General case' 0 CA--C 1.493 -1.222 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -175.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 26.8 p -150.99 154.72 37.61 Favored 'General case' 0 C--N 1.291 -1.954 0 C-N-CA 120.103 -0.639 . . . . 0.0 111.202 -177.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -115.12 -36.6 4.34 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 174.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.0 pttm -138.55 175.58 9.44 Favored 'General case' 0 N--CA 1.427 -1.613 0 CA-C-N 115.222 -0.899 . . . . 0.0 108.612 177.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -72.04 -16.75 62.05 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 120.512 0.196 . . . . 0.0 111.42 -174.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -61.65 -36.99 82.38 Favored 'General case' 0 CA--C 1.502 -0.888 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 179.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -63.2 -32.48 73.88 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.604 -177.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.0 m -88.59 159.18 18.01 Favored 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.316 -177.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.492 ' HB2' HD12 ' A' ' 19' ' ' LEU . 58.5 m -66.83 176.88 1.85 Allowed 'General case' 0 C--N 1.303 -1.416 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.55 175.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.5 ' HA ' ' HE2' ' A' ' 17' ' ' LYS . 10.3 mmpt? -64.47 -52.6 57.1 Favored 'General case' 0 CA--C 1.502 -0.895 0 CA-C-O 121.192 0.52 . . . . 0.0 111.889 -171.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -72.9 9.95 1.02 Allowed 'General case' 0 C--N 1.297 -1.679 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.504 -178.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.517 ' CD1' ' HA ' ' A' ' 4' ' ' TYR . 64.8 mt -125.01 177.12 6.23 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 -175.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -151.26 166.57 30.6 Favored Glycine 0 N--CA 1.434 -1.488 0 N-CA-C 108.64 -1.784 . . . . 0.0 108.64 176.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 40.9 t -99.46 129.5 45.64 Favored 'General case' 0 C--N 1.288 -2.069 0 CA-C-N 118.125 0.962 . . . . 0.0 112.064 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.6 mmmt -96.53 107.53 19.96 Favored 'General case' 0 CA--C 1.473 -1.997 0 CA-C-O 121.255 0.55 . . . . 0.0 111.0 173.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -69.1 -15.3 63.4 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 114.208 -1.36 . . . . 0.0 113.169 -175.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -89.33 -27.59 20.41 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.897 0.856 . . . . 0.0 109.177 -177.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.417 ' HB3' ' CE2' ' A' ' 27' ' ' TYR . 74.7 mmm -109.54 -10.97 14.84 Favored 'General case' 0 N--CA 1.426 -1.666 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.838 -172.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.454 ' O ' ' HA ' ' A' ' 8' ' ' ASP . 71.1 mmtt 63.61 30.22 15.01 Favored 'General case' 0 CA--C 1.5 -0.958 0 C-N-CA 124.75 1.22 . . . . 0.0 111.194 -178.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.417 ' CE2' ' HB3' ' A' ' 25' ' ' MET . 4.9 p90 -145.35 159.43 43.07 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.301 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 4' ' ' TYR . 72.0 m -76.68 134.7 39.18 Favored 'General case' 0 C--N 1.287 -2.125 0 CA-C-N 114.519 -1.219 . . . . 0.0 111.473 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -122.09 -167.59 1.57 Allowed 'General case' 0 C--N 1.296 -1.717 0 N-CA-C 105.731 -1.951 . . . . 0.0 105.731 177.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -81.66 -6.14 58.73 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 119.691 1.132 . . . . 0.0 112.723 -176.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -169.13 171.61 7.99 Favored 'General case' 0 N--CA 1.405 -2.693 0 N-CA-C 103.821 -2.659 . . . . 0.0 103.821 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 33.9 p90 -77.48 -13.7 59.86 Favored 'General case' 0 C--N 1.277 -2.574 0 CA-C-O 121.258 0.552 . . . . 0.0 110.825 179.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.6 m -95.37 115.26 27.19 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-N 115.337 -0.847 . . . . 0.0 108.856 178.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -156.6 121.97 4.73 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 179.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 39.9 m . . . . . 0 C--N 1.299 -1.626 0 CA-C-O 120.648 0.261 . . . . 0.0 110.932 -178.597 . . . . . . . . 0 0 . 1 stop_ save_