data_2m0d_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 2m0d _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.41 ' CZ ' ' HG3' ' A' ' 16' ' ' PRO . 59.0 m-85 . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 121.53 0.681 . . . . 1.3600000000000001 109.332 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.41 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 18.2 pt20 -85.92 154.64 21.36 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.075 -0.966 . . . . 2.7000000000000002 111.401 -175.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.739 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 51.6 t -93.08 130.86 38.55 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.185 -0.462 . . . . 0.45000000000000001 110.297 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -61.95 -22.9 66.02 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.723 -0.671 . . . . 2.46 112.69 -173.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -103.69 -23.69 13.42 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.595 0.712 . . . . 1.25 109.462 -174.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.739 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 47.3 m -98.58 -28.86 13.38 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.648 -1.16 . . . . 0.66000000000000003 112.358 -171.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.97 3.92 57.39 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.747 -0.74 . . . . 0.53000000000000003 111.796 -175.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.41 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 5.0 tpm_? -90.09 128.35 36.29 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 109.716 -0.476 . . . . 3.8100000000000001 109.716 -177.22 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 3.4 p -85.87 116.83 24.35 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.482 -0.781 . . . . 1.6299999999999999 110.574 179.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.704 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 49.9 m-85 -96.57 127.86 42.96 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.719 -0.845 . . . . 0.70999999999999996 108.719 173.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.2 m -82.69 5.58 20.8 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.032 0.444 . . . . 2.0899999999999999 110.737 -178.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.448 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 3.4 t70 -138.15 122.84 12.0 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 115.79 -0.641 . . . . 1.9199999999999999 110.31 -177.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.531 ' O ' ' HB2' ' A' ' 20' ' ' MET . 19.7 Cg_exo -65.42 -24.71 56.75 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 123.169 2.579 . . . . 0.85999999999999999 112.424 -178.033 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -68.67 -54.85 13.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.219 -0.446 . . . . 1.76 110.926 -177.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.3 p -73.2 -31.0 63.93 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.391 -0.368 . . . . 1.51 111.152 -179.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.633 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 1.5 tmtm? -65.8 -19.34 65.85 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.457 -0.572 . . . . 1.8300000000000001 109.457 172.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.531 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 11.7 tpt -86.79 -53.59 4.84 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.335 -0.617 . . . . 2.1899999999999999 109.335 -177.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.492 HH21 ' CD ' ' A' ' 24' ' ' GLU . 2.8 mmp_? -54.47 -44.75 72.86 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.568 -0.742 . . . . 4.7699999999999996 110.365 175.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 56.0 t60 -62.14 -34.57 76.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.078 -0.51 . . . . 0.55000000000000004 111.187 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.409 HD21 ' SG ' ' A' ' 6' ' ' CYS . 1.5 mm? -79.5 -33.5 42.07 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.992 -0.283 . . . . 2.0899999999999999 111.704 -177.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.492 ' CD ' HH21 ' A' ' 21' ' ' ARG . 16.5 pt-20 -85.41 -32.59 22.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.734 0.302 . . . . 2.46 111.163 -178.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 32.9 m -84.64 -3.68 58.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.363 0.601 . . . . 1.8999999999999999 110.45 177.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.225 0 N-CA-C 109.028 -0.73 . . . . 1.4399999999999999 109.028 169.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 . . . . . 0 N--CA 1.451 -0.421 0 N-CA-C 109.238 -0.653 . . . . 1.3600000000000001 109.238 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.49 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 16.5 pt20 -72.16 159.93 33.29 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.515 -0.766 . . . . 2.7000000000000002 110.827 -177.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.963 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 8.6 t -83.11 128.61 34.63 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.238 -1.023 . . . . 0.45000000000000001 108.238 178.176 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . 0.417 ' H ' HD13 ' A' ' 23' ' ' LEU . 12.6 m-20 -66.34 -6.29 13.67 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 112.856 0.688 . . . . 2.46 112.856 -171.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -111.72 -13.71 13.7 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.314 0.578 . . . . 1.25 109.982 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.847 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 74.9 m -119.31 -36.56 3.34 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.638 -0.71 . . . . 0.66000000000000003 112.868 -163.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.9 -16.01 39.7 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.432 -0.89 . . . . 0.53000000000000003 112.009 -176.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.49 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 72.6 ttt180 -62.69 135.4 57.35 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.936 -0.394 . . . . 3.8100000000000001 109.936 177.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 p -89.44 113.06 24.35 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.212 0.529 . . . . 1.6299999999999999 111.994 -174.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.963 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 69.4 m-85 -99.26 131.28 45.39 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.582 -0.895 . . . . 0.70999999999999996 108.582 172.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.5 m -79.67 4.33 16.43 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.386 -0.37 . . . . 2.0899999999999999 110.543 -176.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -131.3 115.83 16.35 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.448 -0.342 . . . . 1.9199999999999999 110.72 -174.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -61.8 -34.92 81.56 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 123.028 2.486 . . . . 0.85999999999999999 112.069 -178.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.9 p -70.9 -45.79 63.69 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.195 0.521 . . . . 1.76 110.474 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.4 m -71.65 -36.72 70.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.059 -0.519 . . . . 1.51 111.064 -177.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.7 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 0.2 OUTLIER -65.95 -19.42 65.86 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.82 -0.437 . . . . 1.8300000000000001 109.82 174.105 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 13.7 tpt -90.6 -46.34 8.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.872 -0.604 . . . . 2.1899999999999999 110.488 -174.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.8 mmm180 -64.05 -36.11 82.92 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.663 -0.495 . . . . 4.7699999999999996 109.663 176.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.411 ' NE2' ' NE2' ' A' ' 26' ' ' HIS . 44.0 t60 -70.18 -35.52 74.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.896 -0.593 . . . . 0.55000000000000004 110.372 176.142 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.543 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 5.2 tp -57.87 -58.59 7.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.578 -0.737 . . . . 2.0899999999999999 110.72 -178.174 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -64.14 -33.49 75.91 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.474 -0.785 . . . . 2.46 111.703 -176.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 25.9 m -74.15 -5.35 41.26 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.882 0.372 . . . . 1.8999999999999999 111.416 -176.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.411 ' NE2' ' NE2' ' A' ' 22' ' ' HIS . 13.6 m-70 . . . . . 0 N--CA 1.463 0.195 0 CA-C-O 120.865 0.364 . . . . 1.4399999999999999 110.345 173.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 . . . . . 0 N--CA 1.45 -0.458 0 CA-C-O 121.045 0.45 . . . . 1.3600000000000001 110.805 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.608 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 8.6 tt0 -73.92 142.29 45.94 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.42 -0.809 . . . . 2.7000000000000002 111.508 -176.166 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.966 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 8.4 t -77.0 122.13 24.48 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 108.341 -0.985 . . . . 0.45000000000000001 108.341 174.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -64.47 -8.15 12.59 Favored 'General case' 0 C--N 1.319 -0.744 0 O-C-N 123.802 0.689 . . . . 2.46 112.732 -170.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -111.58 -21.74 11.59 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 121.135 0.493 . . . . 1.25 110.051 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.562 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 63.4 m -114.48 -29.76 6.75 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.312 0.856 . . . . 0.66000000000000003 113.312 -163.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.6 -8.66 78.56 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.417 -0.897 . . . . 0.53000000000000003 112.772 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -78.86 135.65 37.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.726 0.263 . . . . 3.8100000000000001 110.719 177.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.608 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 36.9 m -99.59 116.31 31.43 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.855 0.359 . . . . 1.6299999999999999 110.803 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.966 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 42.3 m-85 -94.62 128.74 41.47 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.29 -0.633 . . . . 0.70999999999999996 109.29 177.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.1 t -84.16 17.4 2.51 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.62 0.724 . . . . 2.0899999999999999 110.14 -178.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.427 ' HA ' ' HD2' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -125.78 102.79 28.3 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 115.47 -0.786 . . . . 1.9199999999999999 109.78 177.584 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.52 ' O ' ' HB2' ' A' ' 20' ' ' MET . 12.0 Cg_endo -55.35 -38.41 93.85 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 123.496 2.798 . . . . 0.85999999999999999 112.452 -176.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.5 m -74.97 -36.02 62.05 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.136 -0.483 . . . . 1.76 110.918 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.5 t -76.98 -41.9 41.13 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 120.99 -0.284 . . . . 1.51 110.385 -176.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.833 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 2.7 tmtm? -63.79 -18.01 63.66 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.415 0.626 . . . . 1.8300000000000001 109.828 175.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.52 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 0.2 OUTLIER -84.19 -53.56 5.42 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.472 -0.785 . . . . 2.1899999999999999 109.484 -175.286 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 53.2 mtp180 -70.13 -20.53 63.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.918 -0.583 . . . . 4.7699999999999996 110.444 175.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.433 ' HD2' ' SG ' ' A' ' 6' ' ' CYS . 63.1 t60 -66.89 -42.94 84.68 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.033 -0.531 . . . . 0.55000000000000004 109.641 173.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.1 -38.08 89.77 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.257 0.551 . . . . 2.0899999999999999 109.696 174.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -60.64 -41.27 94.61 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.099 -0.955 . . . . 2.46 111.207 177.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.0 p -84.37 0.41 49.43 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.545 0.572 . . . . 1.8999999999999999 112.545 -174.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.8 m-70 . . . . . 0 C--N 1.33 -0.277 0 CA-C-O 121.029 0.442 . . . . 1.4399999999999999 110.472 173.825 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.668 ' HB3' ' HD2' ' A' ' 19' ' ' LYS . 80.8 m-85 . . . . . 0 N--CA 1.455 -0.19 0 CA-C-O 121.299 0.571 . . . . 1.3600000000000001 110.575 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.811 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 36.6 tt0 -76.53 139.4 40.72 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.467 -0.788 . . . . 2.7000000000000002 110.792 -176.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 1.02 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 50.0 t -80.44 119.6 23.34 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.923 -0.769 . . . . 0.45000000000000001 108.923 176.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -64.12 -6.3 6.28 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.755 1.02 . . . . 2.46 113.755 -170.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -109.09 -33.39 6.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.946 0.879 . . . . 1.25 109.075 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.757 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 7.0 m -85.96 -40.32 15.98 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.388 -1.278 . . . . 0.66000000000000003 112.162 -170.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.75 -1.5 88.05 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 110.714 -0.954 . . . . 0.53000000000000003 110.714 -169.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.1 tpt180 -89.5 129.23 36.02 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.067 -0.716 . . . . 3.8100000000000001 109.067 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.811 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 0.8 OUTLIER -98.57 118.0 34.29 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 120.932 0.396 . . . . 1.6299999999999999 110.665 -175.903 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 1.02 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 24.8 m-85 -97.53 129.22 44.7 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.091 -0.707 . . . . 0.70999999999999996 109.091 178.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 59.1 m -78.26 4.46 12.71 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.53 -0.305 . . . . 2.0899999999999999 111.467 -177.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.489 ' HB3' ' HB3' ' A' ' 18' ' ' SER . 11.7 t70 -120.06 113.63 34.09 Favored Pre-proline 0 C--N 1.33 -0.281 0 C-N-CA 120.947 -0.301 . . . . 1.9199999999999999 110.505 -178.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.507 ' O ' ' HB2' ' A' ' 20' ' ' MET . 28.1 Cg_endo -62.51 -32.77 80.07 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 123.201 2.601 . . . . 0.85999999999999999 113.035 -176.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 35.8 m -80.46 -45.08 18.18 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.099 0.476 . . . . 1.76 110.652 -178.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.489 ' HB3' ' HB3' ' A' ' 15' ' ' ASP . 40.9 t -70.17 -37.14 75.1 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.002 -0.544 . . . . 1.51 110.905 -178.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.869 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 6.8 tmtt? -67.15 -18.86 65.47 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.115 0.483 . . . . 1.8300000000000001 109.835 174.351 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.507 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 10.6 tpt -86.86 -43.9 12.11 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.375 -0.602 . . . . 2.1899999999999999 109.375 -174.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.0 ttt85 -63.33 -38.37 90.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.601 -0.727 . . . . 4.7699999999999996 109.378 174.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -63.34 -38.63 91.89 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.301 -0.863 . . . . 0.55000000000000004 110.81 177.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.03 -36.69 84.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.998 0.428 . . . . 2.0899999999999999 110.433 176.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -70.37 -29.46 66.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.195 0.522 . . . . 2.46 110.498 175.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.0 m -66.53 -27.18 67.56 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.673 -0.694 . . . . 1.8999999999999999 110.592 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 . . . . . 0 N--CA 1.464 0.255 0 CA-C-N 116.057 -0.52 . . . . 1.4399999999999999 112.004 -179.336 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.579 ' HB3' ' HE2' ' A' ' 19' ' ' LYS . 64.9 m-85 . . . . . 0 C--O 1.222 -0.394 0 N-CA-C 108.522 -0.918 . . . . 1.3600000000000001 108.522 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.423 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 9.3 pt20 -116.32 161.1 19.54 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.91 -0.316 . . . . 2.7000000000000002 111.138 -177.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.88 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 43.5 t -88.22 121.18 30.32 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.659 -1.237 . . . . 0.45000000000000001 107.659 172.088 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -65.45 -1.65 2.68 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 113.649 0.981 . . . . 2.46 113.649 -171.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -108.53 -24.14 11.53 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.491 0.662 . . . . 1.25 109.339 174.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.756 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 92.9 m -110.22 -35.15 6.17 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.0 -1.0 . . . . 0.66000000000000003 113.069 -166.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.0 -11.44 57.31 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.899 -0.667 . . . . 0.53000000000000003 112.191 -175.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.423 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 9.8 ttp180 -70.07 141.77 52.76 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 110.353 -0.24 . . . . 3.8100000000000001 110.353 -178.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' A' ' 4' ' ' TYR . 31.9 m -90.06 113.62 25.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.122 0.487 . . . . 1.6299999999999999 111.811 -176.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.88 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 46.1 m-85 -101.29 119.46 38.79 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.099 -1.074 . . . . 0.70999999999999996 108.099 170.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.0 p -87.12 21.5 2.34 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.374 0.607 . . . . 2.0899999999999999 110.41 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -137.36 96.85 10.85 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 115.202 -0.908 . . . . 1.9199999999999999 110.002 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -57.03 -43.39 54.31 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.657 2.905 . . . . 0.85999999999999999 113.863 -172.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.0 t -62.18 -44.35 96.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.261 0.553 . . . . 1.76 111.682 -176.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.09 -28.93 39.0 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.284 -0.416 . . . . 1.51 111.297 -179.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.579 ' HE2' ' HB3' ' A' ' 4' ' ' TYR . 7.9 tttp -65.84 -20.25 66.17 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.411 -0.589 . . . . 1.8300000000000001 109.411 168.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -82.46 -50.25 9.06 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 109.087 -0.708 . . . . 2.1899999999999999 109.087 -177.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.7 mmm180 -64.66 -29.58 70.58 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.712 -0.676 . . . . 4.7699999999999996 110.081 175.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -64.32 -40.54 96.11 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.734 -0.667 . . . . 0.55000000000000004 110.371 175.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -68.16 -31.53 71.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.011 0.434 . . . . 2.0899999999999999 110.535 177.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -65.48 -50.64 64.57 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.065 -0.516 . . . . 2.46 110.994 176.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 17.2 p -76.6 -5.38 47.49 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.549 0.574 . . . . 1.8999999999999999 112.549 -174.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 . . . . . 0 C--N 1.332 -0.194 0 N-CA-C 109.879 -0.415 . . . . 1.4399999999999999 109.879 173.164 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 . . . . . 0 N--CA 1.454 -0.238 0 CA-C-O 121.214 0.53 . . . . 1.3600000000000001 110.462 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -82.83 141.16 32.49 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.637 -0.711 . . . . 2.7000000000000002 111.939 -172.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.953 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 22.5 t -77.45 133.21 38.67 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.355 -0.98 . . . . 0.45000000000000001 108.355 176.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -55.6 -27.65 50.71 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.986 0.736 . . . . 2.46 112.986 -168.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -111.25 -9.27 14.31 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.241 -0.584 . . . . 1.25 110.753 -175.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.843 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 94.9 m -111.32 -37.95 5.13 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 113.929 1.085 . . . . 0.66000000000000003 113.929 -165.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.02 -20.15 30.57 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 119.959 -1.115 . . . . 0.53000000000000003 111.879 -174.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.6 ttt180 -64.49 137.2 57.74 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.828 0.347 . . . . 3.8100000000000001 110.411 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 11.2 m -95.28 112.16 23.91 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.653 -0.703 . . . . 1.6299999999999999 111.2 -176.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.953 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 60.8 m-85 -97.17 122.8 40.6 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.752 -0.833 . . . . 0.70999999999999996 108.752 174.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.6 m -81.96 10.58 6.25 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.129 0.49 . . . . 2.0899999999999999 110.851 -176.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -133.31 108.48 12.36 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.93 -0.577 . . . . 1.9199999999999999 109.816 178.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.427 ' O ' ' HB2' ' A' ' 20' ' ' MET . 35.4 Cg_endo -65.05 -26.43 58.14 Favored 'Trans proline' 0 CA--C 1.527 0.163 0 C-N-CA 123.004 2.469 . . . . 0.85999999999999999 113.106 -174.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 16.7 m -76.84 -45.89 26.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.848 0.356 . . . . 1.76 111.238 -176.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.0 p -77.51 -31.08 53.29 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.701 -0.399 . . . . 1.51 110.941 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 19.9 tttm -66.18 -19.22 65.77 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 121.216 0.532 . . . . 1.8300000000000001 109.645 171.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.427 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 43.5 tpp -78.41 -49.96 12.58 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.309 -0.626 . . . . 2.1899999999999999 109.309 -177.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.3 mmt85 -63.92 -33.53 75.92 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.704 -0.68 . . . . 4.7699999999999996 109.93 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 79.2 t60 -62.01 -43.68 98.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.732 -0.667 . . . . 0.55000000000000004 110.445 175.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.99 -40.95 90.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.17 0.51 . . . . 2.0899999999999999 109.771 177.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.86 -35.02 79.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.445 -0.798 . . . . 2.46 111.025 177.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 59.9 m -67.07 -25.79 66.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 1.8999999999999999 111.026 -178.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 57.1 m-70 . . . . . 0 C--N 1.325 -0.484 0 CA-C-O 121.092 0.472 . . . . 1.4399999999999999 110.429 176.498 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.596 ' CE1' ' HG3' ' A' ' 16' ' ' PRO . 75.6 m-85 . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 109.371 -0.603 . . . . 1.3600000000000001 109.371 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -83.1 150.94 25.97 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.603 -0.726 . . . . 2.7000000000000002 111.725 -173.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.745 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 51.1 t -99.56 111.45 23.79 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 115.428 -0.805 . . . . 0.45000000000000001 108.943 174.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.79 0.49 2.37 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.765 0.654 . . . . 2.46 112.765 -175.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -105.06 -21.24 13.31 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.938 -0.764 . . . . 1.25 108.938 175.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.745 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 4.1 m -103.52 -37.35 7.6 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.632 -1.167 . . . . 0.66000000000000003 111.832 -174.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.39 13.54 83.14 Favored Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 111.178 -0.769 . . . . 0.53000000000000003 111.178 -171.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 48.7 ttt180 -107.17 141.58 38.21 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 110.438 -0.208 . . . . 3.8100000000000001 110.438 -175.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.6 m -93.33 115.21 27.78 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 123.382 0.426 . . . . 1.6299999999999999 110.693 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.602 ' HB2' ' HB2' ' A' ' 19' ' ' LYS . 11.6 m-85 -95.53 133.82 39.1 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.791 -0.818 . . . . 0.70999999999999996 108.791 175.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.9 t -90.65 6.08 45.39 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.211 0.529 . . . . 2.0899999999999999 110.011 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -123.83 106.55 31.68 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.939 -0.573 . . . . 1.9199999999999999 110.101 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.596 ' HG3' ' CE1' ' A' ' 4' ' ' TYR . 38.7 Cg_exo -59.56 -42.95 42.96 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 123.184 2.59 . . . . 0.85999999999999999 112.817 -175.093 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 59.4 m -69.53 -44.3 71.25 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.003 0.43 . . . . 1.76 111.317 -176.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 12.9 m -75.0 -32.61 61.69 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.628 -0.429 . . . . 1.51 110.879 -178.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.602 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 8.7 tmtt? -67.12 -20.58 65.8 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 109.415 -0.587 . . . . 1.8300000000000001 109.415 173.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.414 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 4.1 tmm? -81.08 -53.92 5.99 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.813 -0.81 . . . . 2.1899999999999999 108.813 -175.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.2 mmt180 -58.24 -36.11 72.72 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.334 -0.848 . . . . 4.7699999999999996 110.026 174.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -62.6 -43.35 99.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.709 -0.678 . . . . 0.55000000000000004 111.029 177.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.1 mp -62.06 -39.53 92.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.905 0.383 . . . . 2.0899999999999999 110.24 177.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -65.21 -28.2 69.21 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.842 -0.617 . . . . 2.46 110.546 177.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 20.8 m -72.34 -16.87 61.88 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.902 -0.59 . . . . 1.8999999999999999 110.512 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 34.8 m-70 . . . . . 0 C--O 1.235 0.309 0 CA-C-O 121.096 0.474 . . . . 1.4399999999999999 110.171 175.036 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.452 ' HB2' ' HD3' ' A' ' 19' ' ' LYS . 83.0 m-85 . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 109.687 -0.486 . . . . 1.3600000000000001 109.687 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.493 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 73.7 mt-30 -82.53 137.09 34.7 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.474 0.654 . . . . 2.7000000000000002 112.241 -170.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.938 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 52.6 t -76.66 123.47 26.19 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.475 -0.784 . . . . 0.45000000000000001 108.964 176.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -63.17 -12.68 29.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.024 0.75 . . . . 2.46 113.024 -171.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -107.56 -23.69 12.06 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.657 0.741 . . . . 1.25 109.549 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.763 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 11.8 m -98.16 -41.49 7.88 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.83 -1.077 . . . . 0.66000000000000003 112.958 -172.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.31 -10.0 65.3 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 111.017 -0.833 . . . . 0.53000000000000003 111.017 -167.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -79.14 134.43 36.71 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 122.838 0.455 . . . . 3.8100000000000001 110.19 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.493 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 47.3 p -95.21 122.93 38.41 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.126 -0.488 . . . . 1.6299999999999999 111.372 -177.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.938 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 19.3 m-85 -104.04 124.03 48.29 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.463 -0.94 . . . . 0.70999999999999996 108.463 173.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.0 m -80.49 13.36 2.51 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.113 0.482 . . . . 2.0899999999999999 111.03 -175.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -136.18 115.53 10.99 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.158 -0.474 . . . . 1.9199999999999999 110.154 -179.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.539 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 48.0 Cg_exo -56.62 -40.19 86.15 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.464 2.776 . . . . 0.85999999999999999 112.673 -177.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 m -73.08 -40.25 65.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.94 0.4 . . . . 1.76 111.19 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.3 m -73.76 -32.37 63.78 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.085 0.469 . . . . 1.51 110.425 -178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.764 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 15.0 ttpp -69.59 -18.89 63.65 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.688 -0.687 . . . . 1.8300000000000001 109.683 171.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 43.1 ttm -87.45 -47.95 8.35 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.835 -0.62 . . . . 2.1899999999999999 110.57 -173.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -59.25 -38.94 81.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.347 0.594 . . . . 4.7699999999999996 109.568 172.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -60.04 -48.48 81.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.19 -0.913 . . . . 0.55000000000000004 110.897 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.419 HD22 ' O ' ' A' ' 19' ' ' LYS . 2.7 mm? -64.34 -34.19 77.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.918 0.39 . . . . 2.0899999999999999 111.006 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -66.76 -21.07 66.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.197 0.523 . . . . 2.46 110.887 178.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.1 m -98.07 0.25 45.8 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.38 0.609 . . . . 1.8999999999999999 110.71 -178.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 . . . . . 0 C--O 1.235 0.294 0 CA-C-N 116.429 -0.351 . . . . 1.4399999999999999 111.775 -178.692 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 . . . . . 0 N--CA 1.448 -0.572 0 CA-C-O 121.116 0.484 . . . . 1.3600000000000001 110.062 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.549 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 0.5 OUTLIER -77.65 152.81 33.63 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.726 -0.67 . . . . 2.7000000000000002 110.335 -179.815 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.969 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 21.5 t -84.13 129.41 34.9 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.201 -1.037 . . . . 0.45000000000000001 108.201 177.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . 0.421 ' OD1' HD22 ' A' ' 23' ' ' LEU . 2.3 m-20 -54.98 -23.05 17.34 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 113.431 0.9 . . . . 2.46 113.431 -169.002 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -111.07 -16.58 13.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.361 0.6 . . . . 1.25 110.093 -178.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.882 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 83.6 m -105.89 -33.53 7.93 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.459 -0.792 . . . . 0.66000000000000003 112.931 -167.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.33 -10.59 35.03 Favored Glycine 0 CA--C 1.517 0.202 0 C-N-CA 120.795 -0.717 . . . . 0.53000000000000003 112.104 -176.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.549 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 30.4 ttm180 -63.46 135.9 57.23 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 122.616 0.367 . . . . 3.8100000000000001 110.416 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.2 m -89.94 103.67 16.31 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 123.369 0.418 . . . . 1.6299999999999999 111.043 -176.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.969 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 61.8 m-85 -91.43 119.4 31.38 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.334 -0.987 . . . . 0.70999999999999996 108.334 173.563 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.7 p -77.32 12.62 1.44 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.076 -0.511 . . . . 2.0899999999999999 111.333 -175.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.542 ' HB2' ' HB2' ' A' ' 18' ' ' SER . 8.5 m-20 -131.32 114.94 16.08 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 116.199 -0.455 . . . . 1.9199999999999999 109.946 -176.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -57.57 -46.34 27.89 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 123.329 2.686 . . . . 0.85999999999999999 112.523 -178.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 57.6 m -70.32 -35.92 73.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.746 0.308 . . . . 1.76 110.995 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.542 ' HB2' ' HB2' ' A' ' 15' ' ' ASP . 6.3 m -75.8 -35.52 60.03 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.785 -0.366 . . . . 1.51 111.324 -176.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.769 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 1.6 tmtm? -67.26 -18.41 65.2 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.207 -0.664 . . . . 1.8300000000000001 109.207 173.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 11.5 tpt -88.43 -48.65 7.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.206 -0.906 . . . . 2.1899999999999999 109.962 -179.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.2 ttp180 -57.84 -41.22 81.88 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-O 121.509 0.671 . . . . 4.7699999999999996 109.325 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 75.2 t60 -61.73 -38.39 87.73 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.163 -0.926 . . . . 0.55000000000000004 111.227 178.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.421 HD22 ' OD1' ' A' ' 7' ' ' ASP . 1.2 mp -62.53 -43.57 98.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.929 0.395 . . . . 2.0899999999999999 110.394 177.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -63.67 -32.45 73.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.779 -0.646 . . . . 2.46 110.353 176.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 24.1 m -74.46 -14.87 60.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.871 -0.604 . . . . 1.8999999999999999 111.32 -177.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 . . . . . 0 CA--C 1.521 -0.166 0 CA-C-O 120.749 0.309 . . . . 1.4399999999999999 111.33 177.37 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 . . . . . 0 N--CA 1.452 -0.336 0 N-CA-C 109.863 -0.421 . . . . 1.3600000000000001 109.863 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.487 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 60.6 mt-30 -84.35 148.31 26.7 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.087 0.47 . . . . 2.7000000000000002 112.09 -170.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.991 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 42.8 t -81.49 123.11 28.33 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.23 -1.026 . . . . 0.45000000000000001 108.23 176.246 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -64.21 -9.53 17.69 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.744 0.646 . . . . 2.46 112.744 -171.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.456 ' HE2' ' HG ' ' A' ' 23' ' ' LEU . 1.2 m-85 -106.88 -17.07 14.3 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 109.205 -0.665 . . . . 1.25 109.205 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.773 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 71.6 m -115.47 -40.5 3.4 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 113.649 0.981 . . . . 0.66000000000000003 113.649 -168.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.59 -13.13 64.87 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.558 -0.829 . . . . 0.53000000000000003 111.77 -174.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.485 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 64.8 ttt180 -69.58 137.0 52.0 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.94 -0.393 . . . . 3.8100000000000001 109.94 177.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.487 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 8.8 m -98.19 112.15 24.23 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.168 -0.469 . . . . 1.6299999999999999 111.178 -175.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.991 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 50.1 m-85 -95.92 123.94 39.72 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.394 -0.595 . . . . 0.70999999999999996 109.394 176.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.6 t -80.88 10.25 5.29 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.932 0.396 . . . . 2.0899999999999999 110.508 -176.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.669 ' HB2' ' OG ' ' A' ' 18' ' ' SER . 8.0 m-20 -130.64 110.05 16.01 Favored Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 109.546 -0.539 . . . . 1.9199999999999999 109.546 -177.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.472 ' O ' ' HB2' ' A' ' 20' ' ' MET . 31.2 Cg_exo -59.39 -32.85 97.25 Favored 'Trans proline' 0 C--O 1.225 -0.14 0 C-N-CA 122.731 2.287 . . . . 0.85999999999999999 112.018 179.538 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.0 p -70.54 -43.08 70.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.84 -0.618 . . . . 1.76 111.806 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.669 ' OG ' ' HB2' ' A' ' 15' ' ' ASP . 81.1 p -77.33 -38.48 50.31 Favored 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 120.53 -0.468 . . . . 1.51 110.391 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.552 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 23.8 tttm -63.46 -18.81 64.15 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-O 121.067 0.461 . . . . 1.8300000000000001 110.007 173.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.472 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 14.7 tpt -80.85 -54.26 5.75 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.5 -0.556 . . . . 2.1899999999999999 109.5 -177.277 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.9 mtm180 -69.49 -20.75 63.73 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.167 0.508 . . . . 4.7699999999999996 110.287 176.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 78.4 t60 -71.75 -43.13 66.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.07 -0.514 . . . . 0.55000000000000004 110.541 174.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.456 ' HG ' ' HE2' ' A' ' 8' ' ' TYR . 1.4 mp -63.16 -32.07 73.36 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.777 -0.453 . . . . 2.0899999999999999 109.777 176.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -67.53 -29.93 69.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.732 -0.667 . . . . 2.46 110.828 172.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 54.4 m -69.81 -24.49 63.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.08 0.467 . . . . 1.8999999999999999 110.65 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 . . . . . 0 C--O 1.235 0.325 0 CA-C-N 116.346 -0.388 . . . . 1.4399999999999999 110.331 177.31 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.657 ' HB3' ' CD ' ' A' ' 19' ' ' LYS . 77.4 m-85 . . . . . 0 N--CA 1.452 -0.357 0 CA-C-O 121.096 0.474 . . . . 1.3600000000000001 111.398 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.456 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 22.1 mt-30 -86.83 160.22 18.83 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.852 -0.613 . . . . 2.7000000000000002 111.318 -176.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.972 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 35.9 t -90.1 119.95 30.87 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 107.898 -1.149 . . . . 0.45000000000000001 107.898 174.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -69.32 0.07 5.53 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.722 0.638 . . . . 2.46 112.722 -171.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.4 m-30 -103.51 -23.77 13.48 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.951 -0.759 . . . . 1.25 108.951 173.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.777 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 88.4 m -114.0 -40.41 3.74 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.876 -1.056 . . . . 0.66000000000000003 113.549 -164.459 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.88 -15.54 61.52 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.769 -0.729 . . . . 0.53000000000000003 112.017 -174.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.456 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 61.1 ttt180 -67.42 138.7 56.86 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.184 0.193 . . . . 3.8100000000000001 110.578 -179.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.6 m -94.62 122.64 37.43 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.419 -0.355 . . . . 1.6299999999999999 110.936 -177.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.972 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 84.0 m-85 -101.64 139.63 37.03 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.821 -0.627 . . . . 0.70999999999999996 109.432 176.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.7 p -80.79 2.54 25.85 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.621 -0.718 . . . . 2.0899999999999999 110.828 -176.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.821 ' HB2' ' HB3' ' A' ' 18' ' ' SER . 8.4 m-20 -134.24 118.02 13.77 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.336 -0.393 . . . . 1.9199999999999999 110.216 -174.388 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.472 ' O ' ' HG3' ' A' ' 20' ' ' MET . 18.5 Cg_endo -60.6 -40.82 52.71 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 123.051 2.5 . . . . 0.85999999999999999 112.605 -178.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 88.7 m -80.51 -31.12 37.21 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.698 0.285 . . . . 1.76 110.732 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.821 ' HB3' ' HB2' ' A' ' 15' ' ' ASP . 25.7 t -74.49 -37.5 63.13 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 120.661 -0.416 . . . . 1.51 109.906 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.657 ' CD ' ' HB3' ' A' ' 4' ' ' TYR . 8.8 tttp -57.8 -28.64 64.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.077 -0.511 . . . . 1.8300000000000001 109.686 170.144 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.472 ' HG3' ' O ' ' A' ' 16' ' ' PRO . 61.2 mtp -84.44 -45.69 12.44 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 116.046 -0.525 . . . . 2.1899999999999999 110.335 -173.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -62.93 -31.68 72.82 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.54 -0.754 . . . . 4.7699999999999996 109.636 174.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 67.5 t60 -63.05 -46.36 87.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.491 -0.777 . . . . 0.55000000000000004 110.626 173.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.404 HD23 ' O ' ' A' ' 19' ' ' LYS . 2.3 mm? -59.27 -38.82 81.04 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.475 -0.33 . . . . 2.0899999999999999 110.665 178.276 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 20' ' ' MET . 48.4 mt-10 -63.19 -34.14 76.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.237 -0.438 . . . . 2.46 110.281 176.09 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.9 m -76.69 -8.46 57.32 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.822 -0.626 . . . . 1.8999999999999999 110.838 -178.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 . . . . . 0 C--N 1.329 -0.321 0 CA-C-O 120.939 0.399 . . . . 1.4399999999999999 110.249 173.481 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 N--CA 1.448 -0.527 0 CA-C-O 121.143 0.497 . . . . 1.3600000000000001 109.842 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.523 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 4.7 pp0? -72.1 146.45 47.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.492 -0.776 . . . . 2.7000000000000002 110.356 -179.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 1.051 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 48.8 t -81.27 122.53 27.54 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.269 -0.641 . . . . 0.45000000000000001 109.269 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -59.91 -17.35 36.73 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.495 0.554 . . . . 2.46 112.495 -172.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -98.79 -25.4 14.66 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.657 0.742 . . . . 1.25 109.527 -178.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.823 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 35.6 m -107.61 -40.92 5.18 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.689 -1.141 . . . . 0.66000000000000003 113.147 -164.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.54 -12.39 65.31 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.641 -0.79 . . . . 0.53000000000000003 111.599 -171.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.414 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 14.2 tpp180 -69.34 129.91 41.11 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 122.534 0.333 . . . . 3.8100000000000001 110.186 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.523 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 19.6 m -89.8 110.2 21.14 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.086 -0.506 . . . . 1.6299999999999999 111.174 -178.046 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 1.051 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 25.8 m-85 -94.08 135.12 35.78 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.744 -0.835 . . . . 0.70999999999999996 108.744 173.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.3 m -90.06 5.31 47.24 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 121.068 0.461 . . . . 2.0899999999999999 110.475 -176.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -123.51 109.45 30.76 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.941 -0.572 . . . . 1.9199999999999999 110.39 179.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.466 ' O ' ' HB2' ' A' ' 20' ' ' MET . 19.2 Cg_endo -58.43 -40.95 70.24 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.252 2.635 . . . . 0.85999999999999999 113.064 -176.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.2 m -72.21 -40.58 67.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.24 0.543 . . . . 1.76 110.479 -178.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.6 t -74.9 -37.95 61.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.039 -0.528 . . . . 1.51 110.187 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.779 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 7.8 tmtt? -63.27 -20.75 65.74 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.283 0.563 . . . . 1.8300000000000001 109.766 172.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.466 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 9.7 tpt -89.85 -37.57 14.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.832 -0.622 . . . . 2.1899999999999999 109.955 -173.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 78.5 mtp180 -69.79 -35.13 74.61 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.854 -0.612 . . . . 4.7699999999999996 109.578 171.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 48.5 t60 -60.53 -43.93 96.6 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.482 -0.781 . . . . 0.55000000000000004 109.735 172.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 26' ' ' HIS . 6.4 tp -63.13 -36.95 85.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.076 -0.511 . . . . 2.0899999999999999 110.293 178.27 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -64.14 -37.27 86.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.402 -0.817 . . . . 2.46 110.418 176.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 6.3 m -78.47 0.47 25.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.895 -0.593 . . . . 1.8999999999999999 110.818 -178.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.417 ' HB2' ' O ' ' A' ' 23' ' ' LEU . 1.7 m-70 . . . . . 0 C--N 1.331 -0.225 0 O-C-N 122.032 -0.417 . . . . 1.4399999999999999 112.057 -178.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 . . . . . 0 N--CA 1.452 -0.342 0 CA-C-O 121.454 0.645 . . . . 1.3600000000000001 110.399 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.826 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 0.7 OUTLIER -76.38 145.68 39.26 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.098 -0.956 . . . . 2.7000000000000002 110.936 -176.585 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.851 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 53.1 t -84.89 119.39 25.29 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.583 -0.735 . . . . 0.45000000000000001 109.111 177.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -66.42 -3.07 5.33 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.437 0.532 . . . . 2.46 112.437 -175.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.6 m-85 -108.6 -17.81 13.88 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.239 -0.652 . . . . 1.25 109.239 178.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.749 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 15.5 m -111.6 -41.75 4.0 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.299 -0.864 . . . . 0.66000000000000003 112.847 -172.208 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.05 -3.65 84.55 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.722 -0.752 . . . . 0.53000000000000003 111.537 -170.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.5 tpt180 -91.48 131.39 36.96 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 109.949 -0.389 . . . . 3.8100000000000001 109.949 -178.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.826 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 44.9 m -92.88 121.54 34.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.014 0.435 . . . . 1.6299999999999999 111.082 -178.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.851 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 11.1 m-85 -100.87 127.6 47.27 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.469 -0.938 . . . . 0.70999999999999996 108.469 175.257 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 21.3 m -79.4 9.51 4.7 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.807 0.337 . . . . 2.0899999999999999 111.057 -177.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -122.88 106.22 34.39 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.201 -0.454 . . . . 1.9199999999999999 109.969 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.58 -38.72 88.2 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 123.02 2.48 . . . . 0.85999999999999999 112.65 -177.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.2 t -71.5 -40.22 70.32 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.993 -0.549 . . . . 1.76 110.941 -179.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.4 m -76.77 -35.02 57.97 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.406 -0.361 . . . . 1.51 110.477 -179.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.691 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 8.7 tmtt? -66.42 -18.85 65.6 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.306 -0.628 . . . . 1.8300000000000001 109.306 172.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 14.7 tpt -84.7 -50.09 7.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.52 -0.764 . . . . 2.1899999999999999 109.039 -178.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.1 ttp180 -59.79 -38.84 83.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.235 -0.893 . . . . 4.7699999999999996 109.629 176.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 41.6 t60 -62.27 -43.6 98.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.934 -1.03 . . . . 0.55000000000000004 110.986 178.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.5 mp -66.38 -31.51 72.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.498 -0.319 . . . . 2.0899999999999999 110.944 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -70.34 -30.03 66.88 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.219 0.533 . . . . 2.46 110.256 175.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.0 m -70.62 -17.87 62.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.926 -0.579 . . . . 1.8999999999999999 110.208 177.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 . . . . . 0 C--N 1.332 -0.156 0 CA-C-N 115.949 -0.569 . . . . 1.4399999999999999 111.272 176.928 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.478 ' HB3' ' HE2' ' A' ' 19' ' ' LYS . 82.3 m-85 . . . . . 0 N--CA 1.451 -0.389 0 N-CA-C 109.923 -0.399 . . . . 1.3600000000000001 109.923 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.524 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 4.0 pt20 -77.65 159.48 29.15 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.325 0.583 . . . . 2.7000000000000002 112.182 -173.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.887 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 33.4 t -98.54 119.49 37.35 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 108.09 -1.078 . . . . 0.45000000000000001 108.09 171.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -62.14 -18.35 60.64 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.579 0.585 . . . . 2.46 112.579 -170.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -102.9 -13.66 16.85 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.507 0.67 . . . . 1.25 109.28 -176.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.809 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 32.7 m -113.32 -36.64 4.93 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.203 -0.908 . . . . 0.66000000000000003 112.975 -170.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.26 -3.33 84.98 Favored Glycine 0 N--CA 1.453 -0.187 0 N-CA-C 111.181 -0.768 . . . . 0.53000000000000003 111.181 -173.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -80.82 130.07 34.86 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.71 0.404 . . . . 3.8100000000000001 110.374 -178.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.524 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 5.1 p -93.75 122.02 35.79 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.087 -0.506 . . . . 1.6299999999999999 111.481 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.887 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 40.8 m-85 -99.84 142.91 30.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.907 -0.588 . . . . 0.70999999999999996 109.731 177.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.5 p -88.87 13.29 13.0 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.942 -0.572 . . . . 2.0899999999999999 110.368 178.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.435 ' O ' ' HB3' ' A' ' 19' ' ' LYS . 2.1 m-20 -124.87 115.22 26.5 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.464 -0.789 . . . . 1.9199999999999999 110.543 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.424 ' HG3' ' CE1' ' A' ' 4' ' ' TYR . 19.2 Cg_exo -65.1 -46.93 5.24 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 123.003 2.469 . . . . 0.85999999999999999 112.308 -178.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.8 m -72.69 -39.69 66.84 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.994 -0.548 . . . . 1.76 110.499 -178.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.405 ' HB2' ' CB ' ' A' ' 15' ' ' ASP . 16.8 m -70.85 -39.21 73.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.436 -0.347 . . . . 1.51 111.142 -179.11 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 1.2 tmtm? -63.86 -19.14 64.83 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.407 0.622 . . . . 1.8300000000000001 109.751 174.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 33.2 tpp -89.82 -44.73 9.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.591 -0.731 . . . . 2.1899999999999999 110.344 -176.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -67.27 -31.2 71.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.268 0.556 . . . . 4.7699999999999996 109.7 174.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -66.08 -48.27 71.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.339 -0.846 . . . . 0.55000000000000004 111.101 177.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.772 HD13 ' HA ' ' A' ' 6' ' ' CYS . 2.5 mp -67.35 -25.3 65.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.901 0.381 . . . . 2.0899999999999999 111.018 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -75.63 -35.55 60.44 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.142 -0.481 . . . . 2.46 110.855 177.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.1 p -88.24 1.62 54.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.173 -0.467 . . . . 1.8999999999999999 111.774 -177.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.467 0.381 0 N-CA-C 111.885 0.328 . . . . 1.4399999999999999 111.885 179.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.512 ' HB3' ' HE3' ' A' ' 19' ' ' LYS . 96.3 m-85 . . . . . 0 N--CA 1.453 -0.301 0 CA-C-O 120.671 0.272 . . . . 1.3600000000000001 111.067 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -76.36 133.76 39.86 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.845 -0.428 . . . . 2.7000000000000002 109.845 175.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.985 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 44.6 t -82.82 122.96 28.89 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 108.521 -0.918 . . . . 0.45000000000000001 108.521 171.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -62.71 -15.24 51.91 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.922 0.712 . . . . 2.46 112.922 -171.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -109.97 -16.77 13.76 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.775 0.798 . . . . 1.25 109.547 -176.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.805 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 12.7 m -99.2 -37.0 9.47 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.882 -1.054 . . . . 0.66000000000000003 111.801 -178.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.77 8.57 87.68 Favored Glycine 0 N--CA 1.451 -0.327 0 N-CA-C 111.062 -0.815 . . . . 0.53000000000000003 111.062 -173.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 64.3 ttt180 -106.61 137.85 43.87 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.457 -0.372 . . . . 3.8100000000000001 110.59 -173.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.5 m -91.44 114.36 26.87 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.942 -0.572 . . . . 1.6299999999999999 110.709 -179.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.985 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 19.1 m-85 -97.17 121.83 39.49 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.747 -0.835 . . . . 0.70999999999999996 108.747 173.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 34.9 t -82.57 22.0 0.92 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.39 0.614 . . . . 2.0899999999999999 109.889 178.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.448 ' H ' ' C ' ' A' ' 13' ' ' PHE . 11.7 m-20 -123.53 96.33 43.76 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.385 -0.825 . . . . 1.9199999999999999 109.806 -178.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.0 -43.11 62.62 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.439 2.759 . . . . 0.85999999999999999 113.938 -173.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 94.6 m -82.01 -34.3 29.66 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.145 0.498 . . . . 1.76 110.996 -177.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.3 m -77.95 -31.1 50.71 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.667 -0.413 . . . . 1.51 110.909 -177.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.741 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 8.8 tmtt? -69.17 -22.17 63.93 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 109.098 -0.704 . . . . 1.8300000000000001 109.098 171.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -77.32 -53.53 7.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.407 -0.815 . . . . 2.1899999999999999 109.525 -174.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -67.71 -28.58 67.78 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.661 -0.7 . . . . 4.7699999999999996 110.343 177.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 62.6 t60 -60.62 -46.09 91.57 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.052 0.453 . . . . 0.55000000000000004 109.834 172.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -61.7 -46.95 87.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.808 -0.633 . . . . 2.0899999999999999 110.44 177.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -56.44 -31.09 63.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.731 0.301 . . . . 2.46 111.576 178.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 96.2 m -74.26 -57.28 4.05 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 112.649 0.611 . . . . 1.8999999999999999 112.649 -173.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.533 0.317 0 C-N-CA 119.676 -0.81 . . . . 1.4399999999999999 112.163 -171.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.662 ' HB3' ' HD3' ' A' ' 19' ' ' LYS . 83.6 m-85 . . . . . 0 N--CA 1.452 -0.345 0 CA-C-O 121.334 0.587 . . . . 1.3600000000000001 111.011 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.475 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 37.8 tt0 -71.99 146.1 47.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.335 -0.848 . . . . 2.7000000000000002 111.213 -178.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.844 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 53.4 t -87.35 123.25 32.11 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.568 -0.901 . . . . 0.45000000000000001 108.568 169.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -68.17 -8.57 39.82 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 112.043 0.386 . . . . 2.46 112.043 -175.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.575 ' CE2' ' HG ' ' A' ' 23' ' ' LEU . 15.5 m-85 -111.11 -6.08 14.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.048 0.451 . . . . 1.25 109.864 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.844 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 11.0 m -120.08 -36.72 3.2 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.825 0.676 . . . . 0.66000000000000003 112.825 -172.566 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.15 -7.95 72.96 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.699 -0.763 . . . . 0.53000000000000003 111.737 -173.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.475 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 63.2 ttt180 -80.53 139.7 36.22 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 120.53 0.205 . . . . 3.8100000000000001 110.632 -177.336 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 p -91.51 117.95 30.15 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.987 -0.551 . . . . 1.6299999999999999 110.743 176.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.727 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 54.5 m-85 -98.69 147.54 24.75 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.69 -0.485 . . . . 0.70999999999999996 109.69 177.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 55.4 m -91.59 2.96 56.1 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.392 -0.596 . . . . 2.0899999999999999 109.392 176.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.576 ' O ' ' HB3' ' A' ' 19' ' ' LYS . 25.2 m-20 -120.98 109.34 35.71 Favored Pre-proline 0 CA--C 1.516 -0.33 0 CA-C-N 115.686 -0.688 . . . . 1.9199999999999999 110.689 -176.012 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.454 ' HG3' ' CE1' ' A' ' 4' ' ' TYR . 25.0 Cg_exo -62.56 -43.49 21.65 Favored 'Trans proline' 0 N--CA 1.464 -0.248 0 C-N-CA 122.454 2.103 . . . . 0.85999999999999999 111.764 177.608 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.9 m -75.75 -40.01 56.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.728 -0.669 . . . . 1.76 111.181 -178.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.569 ' HB2' ' CB ' ' A' ' 15' ' ' ASP . 70.4 m -79.81 -25.13 40.96 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.675 -0.41 . . . . 1.51 111.347 -177.38 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.662 ' HD3' ' HB3' ' A' ' 4' ' ' TYR . 6.4 tttp -68.97 -24.32 64.24 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.213 -0.662 . . . . 1.8300000000000001 109.213 167.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 13.9 tpt -80.12 -53.23 6.89 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.666 -0.697 . . . . 2.1899999999999999 110.131 -171.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -60.52 -33.28 72.4 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 121.272 0.558 . . . . 4.7699999999999996 109.614 176.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -63.24 -48.07 79.77 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.272 -0.876 . . . . 0.55000000000000004 110.432 175.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.575 ' HG ' ' CE2' ' A' ' 8' ' ' TYR . 0.6 OUTLIER -64.79 -42.19 95.25 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.365 -0.834 . . . . 2.0899999999999999 111.053 -175.074 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -80.18 -1.24 39.58 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.963 0.357 . . . . 2.46 111.963 -176.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 88.6 m -96.46 -40.1 9.24 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.49 -0.484 . . . . 1.8999999999999999 111.177 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 p80 . . . . . 0 C--N 1.33 -0.252 0 C-N-CA 119.499 -0.88 . . . . 1.4399999999999999 112.149 -174.86 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 109.767 -0.456 . . . . 1.3600000000000001 109.767 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.614 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 19.9 pt20 -76.01 160.1 30.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.303 0.573 . . . . 2.7000000000000002 111.68 -174.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.714 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 36.5 t -110.15 121.25 44.82 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.098 -0.704 . . . . 0.45000000000000001 109.098 171.356 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.5 -11.54 35.05 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.359 0.503 . . . . 2.46 112.359 -173.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -103.72 -26.51 12.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.769 0.795 . . . . 1.25 109.193 -178.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.714 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 4.1 m -94.65 -41.09 9.48 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.674 -1.148 . . . . 0.66000000000000003 112.041 -173.225 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.35 11.17 85.76 Favored Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 110.559 -1.017 . . . . 0.53000000000000003 110.559 -166.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -109.95 132.03 54.52 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.786 -0.449 . . . . 3.8100000000000001 109.786 -177.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.614 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 14.4 m -92.84 118.28 30.94 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.501 -0.772 . . . . 1.6299999999999999 110.646 -177.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.671 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 44.7 m-85 -99.06 122.88 42.89 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.075 -0.713 . . . . 0.70999999999999996 109.075 177.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.7 t -83.17 17.85 1.89 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.182 0.515 . . . . 2.0899999999999999 109.788 178.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.413 ' H ' ' C ' ' A' ' 13' ' ' PHE . 6.7 m-20 -131.06 100.44 17.15 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 109.183 -0.673 . . . . 1.9199999999999999 109.183 -176.637 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.419 ' O ' ' HB2' ' A' ' 20' ' ' MET . 43.8 Cg_exo -55.73 -43.77 54.29 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.191 2.594 . . . . 0.85999999999999999 112.797 -175.685 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.8 m -65.97 -42.57 89.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.109 -0.496 . . . . 1.76 111.24 -178.236 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.9 m -74.85 -37.49 62.21 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.564 -0.289 . . . . 1.51 111.197 -178.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.651 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 26.1 tttp -64.31 -20.24 65.96 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.158 0.504 . . . . 1.8300000000000001 109.717 174.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.419 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 12.8 tpt -85.83 -51.44 6.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.492 -0.776 . . . . 2.1899999999999999 109.734 -173.114 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 48.2 mtp180 -63.32 -37.58 87.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.372 -0.831 . . . . 4.7699999999999996 110.29 175.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -66.18 -38.4 87.94 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.745 -0.661 . . . . 0.55000000000000004 110.512 178.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.493 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 3.2 tp -62.72 -43.7 98.14 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.996 0.426 . . . . 2.0899999999999999 109.987 178.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -57.95 -38.71 76.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.406 -0.816 . . . . 2.46 110.902 177.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 16.0 m -77.86 0.25 24.67 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.628 -0.715 . . . . 1.8999999999999999 111.425 -176.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 12.5 m-70 . . . . . 0 C--O 1.234 0.258 0 O-C-N 121.91 -0.494 . . . . 1.4399999999999999 111.716 176.883 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 . . . . . 0 N--CA 1.454 -0.229 0 N-CA-C 109.621 -0.511 . . . . 1.3600000000000001 109.621 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.719 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 3.8 pt20 -71.89 141.42 49.53 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.108 -0.497 . . . . 2.7000000000000002 111.251 -178.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.728 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 44.4 t -90.6 130.09 36.66 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.834 -0.621 . . . . 0.45000000000000001 109.759 177.478 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -75.22 -2.65 28.95 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 111.65 0.241 . . . . 2.46 111.65 -175.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -101.76 -32.15 10.42 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 122.202 1.001 . . . . 1.25 108.643 177.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.728 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 27.7 m -101.28 -37.57 8.45 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 113.618 -1.628 . . . . 0.66000000000000003 112.563 -167.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.69 -2.37 88.14 Favored Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.832 -0.699 . . . . 0.53000000000000003 111.584 -173.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.432 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 75.0 ttt180 -96.17 139.63 32.05 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.944 -0.391 . . . . 3.8100000000000001 109.944 -176.131 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.719 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 20.0 m -92.73 106.05 18.09 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.028 -0.533 . . . . 1.6299999999999999 110.457 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.876 ' HB2' ' HB2' ' A' ' 19' ' ' LYS . 50.0 m-85 -88.61 119.78 29.39 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.834 -0.802 . . . . 0.70999999999999996 108.834 177.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.2 t -78.76 8.44 5.43 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.777 0.323 . . . . 2.0899999999999999 110.612 -176.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.442 ' HA ' ' HD2' ' A' ' 16' ' ' PRO . 0.7 OUTLIER -121.03 104.64 41.15 Favored Pre-proline 0 C--N 1.328 -0.329 0 N-CA-C 109.807 -0.442 . . . . 1.9199999999999999 109.807 177.251 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.442 ' HD2' ' HA ' ' A' ' 15' ' ' ASP . 18.3 Cg_endo -57.6 -32.9 95.66 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 123.058 2.506 . . . . 0.85999999999999999 112.728 -175.272 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.0 m -83.07 -31.92 27.09 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.253 -0.431 . . . . 1.76 111.195 -178.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.0 m -81.18 -32.32 33.64 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.936 0.398 . . . . 1.51 110.376 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.876 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 7.6 tmtt? -66.76 -19.12 65.68 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.825 -0.625 . . . . 1.8300000000000001 109.338 170.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -87.77 -51.9 5.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.349 -0.841 . . . . 2.1899999999999999 109.2 -177.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.464 ' HA ' ' OE1' ' A' ' 24' ' ' GLU . 55.2 ttp180 -54.01 -39.33 65.99 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.759 -0.655 . . . . 4.7699999999999996 110.275 173.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.526 ' HA ' HG23 ' A' ' 25' ' ' THR . 64.7 t60 -69.08 -30.29 68.57 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.451 -0.795 . . . . 0.55000000000000004 110.914 177.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.08 -34.55 75.3 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.471 -0.566 . . . . 2.0899999999999999 109.471 177.021 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.464 ' OE1' ' HA ' ' A' ' 21' ' ' ARG . 42.4 mt-10 -66.43 -46.67 75.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.667 -0.697 . . . . 2.46 110.691 176.194 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.526 HG23 ' HA ' ' A' ' 22' ' ' HIS . 12.1 t -71.76 -7.34 47.55 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.129 -0.487 . . . . 1.8999999999999999 111.877 -174.33 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 14.1 m-70 . . . . . 0 C--N 1.33 -0.249 0 N-CA-C 109.671 -0.492 . . . . 1.4399999999999999 109.671 172.733 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.562 ' CE2' ' HG3' ' A' ' 16' ' ' PRO . 90.8 m-85 . . . . . 0 N--CA 1.452 -0.339 0 N-CA-C 109.618 -0.512 . . . . 1.3600000000000001 109.618 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.749 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 0.0 OUTLIER -88.2 149.94 23.58 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.303 0.573 . . . . 2.7000000000000002 112.234 -170.783 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.992 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 48.6 t -95.03 125.29 39.59 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.631 -0.713 . . . . 0.45000000000000001 109.595 175.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -63.79 -21.61 66.51 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.325 0.491 . . . . 2.46 112.325 -173.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -95.59 -27.88 15.12 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.967 0.889 . . . . 1.25 108.964 -176.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.729 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 6.8 m -95.75 -40.46 9.35 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.224 -1.353 . . . . 0.66000000000000003 112.821 -170.467 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.57 10.41 85.87 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.404 -0.903 . . . . 0.53000000000000003 110.907 -171.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -105.44 132.97 50.94 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.686 -0.487 . . . . 3.8100000000000001 109.686 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.749 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 19.6 m -96.5 120.12 36.24 Favored 'General case' 0 C--N 1.32 -0.71 0 O-C-N 123.428 0.455 . . . . 1.6299999999999999 110.485 179.666 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.992 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 24.7 m-85 -95.32 126.95 40.98 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.273 -0.64 . . . . 0.70999999999999996 109.273 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.6 t -77.41 9.95 2.88 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.971 -0.558 . . . . 2.0899999999999999 111.525 -173.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.413 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 5.0 m-20 -135.31 120.15 13.61 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-O 121.041 0.448 . . . . 1.9199999999999999 110.153 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.562 ' HG3' ' CE2' ' A' ' 4' ' ' TYR . 31.7 Cg_exo -57.2 -53.2 5.14 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 123.574 2.849 . . . . 0.85999999999999999 112.592 -176.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.1 m -55.42 -46.74 76.63 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.354 -0.385 . . . . 1.76 111.742 -177.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.0 p -84.41 -16.63 42.01 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 120.538 -0.465 . . . . 1.51 111.704 -175.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.879 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 10.7 tmtt? -77.63 -23.26 49.8 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 108.611 -0.885 . . . . 1.8300000000000001 108.611 170.041 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.553 ' HG2' ' O ' ' A' ' 16' ' ' PRO . 77.4 mmm -83.58 -52.57 6.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.343 -0.844 . . . . 2.1899999999999999 110.265 -175.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 92.9 mtt-85 -59.83 -30.84 69.22 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.282 0.563 . . . . 4.7699999999999996 110.042 176.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.408 ' O ' ' HD2' ' A' ' 26' ' ' HIS . 38.5 t60 -68.58 -41.91 79.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.432 -0.804 . . . . 0.55000000000000004 110.596 178.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.453 HD23 ' HA ' ' A' ' 6' ' ' CYS . 2.1 mm? -65.54 -38.98 91.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.937 0.398 . . . . 2.0899999999999999 110.192 176.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 20' ' ' MET . 39.0 mm-40 -62.89 -34.3 77.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.656 -0.702 . . . . 2.46 111.166 177.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.4 p -84.51 -0.43 53.04 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.261 0.467 . . . . 1.8999999999999999 112.261 -176.146 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.408 ' HD2' ' O ' ' A' ' 22' ' ' HIS . 17.7 m-70 . . . . . 0 C--N 1.33 -0.244 0 CA-C-O 121.542 0.687 . . . . 1.4399999999999999 109.148 168.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 . . . . . 0 N--CA 1.45 -0.44 0 N-CA-C 109.576 -0.527 . . . . 1.3600000000000001 109.576 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.526 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 43.6 mt-30 -77.11 157.55 30.96 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.522 -0.308 . . . . 2.7000000000000002 110.381 -177.404 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.769 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 45.3 t -88.39 127.68 35.5 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 108.535 -0.913 . . . . 0.45000000000000001 108.535 175.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -67.01 -13.23 61.71 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.988 0.736 . . . . 2.46 112.988 -168.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -103.36 -30.28 10.7 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.884 0.85 . . . . 1.25 108.775 177.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.766 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 63.4 m -95.21 -40.37 9.61 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.544 -1.207 . . . . 0.66000000000000003 113.721 -166.664 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.76 -3.65 86.86 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.622 -0.799 . . . . 0.53000000000000003 112.116 -176.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.462 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 68.5 ttt180 -76.38 134.35 39.67 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.671 -0.492 . . . . 3.8100000000000001 109.671 176.505 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.526 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 50.2 p -90.96 110.0 21.24 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.051 0.453 . . . . 1.6299999999999999 110.6 -179.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.769 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 69.9 m-85 -88.91 124.76 34.53 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.56 -0.904 . . . . 0.70999999999999996 108.56 174.364 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.0 m -69.43 -6.45 30.29 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.718 -0.674 . . . . 2.0899999999999999 111.02 -176.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -135.7 124.34 15.66 Favored Pre-proline 0 CA--C 1.516 -0.336 0 CA-C-O 120.804 0.335 . . . . 1.9199999999999999 110.539 -173.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.62 ' O ' ' HB2' ' A' ' 20' ' ' MET . 38.0 Cg_endo -67.4 -23.05 44.62 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.599 2.199 . . . . 0.85999999999999999 111.425 177.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.8 m -67.53 -54.5 19.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.407 -0.815 . . . . 1.76 110.917 179.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.8 p -80.78 -28.96 36.18 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.541 -0.3 . . . . 1.51 111.272 -176.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.689 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 0.3 OUTLIER -65.47 -19.59 66.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.188 0.518 . . . . 1.8300000000000001 109.898 172.668 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.62 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -84.12 -53.85 5.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.902 -0.59 . . . . 2.1899999999999999 109.456 -177.355 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.475 ' HA ' ' OE1' ' A' ' 24' ' ' GLU . 60.2 ttt180 -57.24 -34.06 68.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.1 -0.5 . . . . 4.7699999999999996 109.9 174.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -55.94 -47.49 77.46 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.896 -0.593 . . . . 0.55000000000000004 110.684 174.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.35 -29.3 68.81 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.277 -0.42 . . . . 2.0899999999999999 110.678 -179.202 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.475 ' OE1' ' HA ' ' A' ' 21' ' ' ARG . 47.5 mt-10 -68.84 -56.91 6.47 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.176 0.512 . . . . 2.46 111.011 174.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.2 t -78.76 3.62 16.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.908 -0.587 . . . . 1.8999999999999999 111.739 -174.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.467 0.404 0 N-CA-C 113.326 0.862 . . . . 1.4399999999999999 113.326 -171.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.481 1.101 0 CA-C-O 120.884 0.373 . . . . 5.8300000000000001 110.626 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 62.7 tttp -143.03 117.89 6.38 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 109.299 -0.63 . . . . 4.7999999999999998 109.299 174.035 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 6.1 Cg_exo -79.05 129.78 9.05 Favored 'Trans proline' 0 N--CA 1.446 -1.282 0 C-N-CA 123.014 2.476 . . . . 1.74 111.275 -176.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.41 ' CZ ' ' HG3' ' A' ' 16' ' ' PRO . 59.0 m-85 -82.75 74.69 9.69 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.034 -0.985 . . . . 1.3600000000000001 109.332 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.41 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 18.2 pt20 -85.92 154.64 21.36 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.075 -0.966 . . . . 2.7000000000000002 111.401 -175.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.739 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 51.6 t -93.08 130.86 38.55 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.185 -0.462 . . . . 0.45000000000000001 110.297 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -61.95 -22.9 66.02 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.723 -0.671 . . . . 2.46 112.69 -173.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -103.69 -23.69 13.42 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.595 0.712 . . . . 1.25 109.462 -174.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.739 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 47.3 m -98.58 -28.86 13.38 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.648 -1.16 . . . . 0.66000000000000003 112.358 -171.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.97 3.92 57.39 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.747 -0.74 . . . . 0.53000000000000003 111.796 -175.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.41 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 5.0 tpm_? -90.09 128.35 36.29 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 109.716 -0.476 . . . . 3.8100000000000001 109.716 -177.22 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 3.4 p -85.87 116.83 24.35 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.482 -0.781 . . . . 1.6299999999999999 110.574 179.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.704 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 49.9 m-85 -96.57 127.86 42.96 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.719 -0.845 . . . . 0.70999999999999996 108.719 173.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.2 m -82.69 5.58 20.8 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.032 0.444 . . . . 2.0899999999999999 110.737 -178.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.448 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 3.4 t70 -138.15 122.84 12.0 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 115.79 -0.641 . . . . 1.9199999999999999 110.31 -177.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.531 ' O ' ' HB2' ' A' ' 20' ' ' MET . 19.7 Cg_exo -65.42 -24.71 56.75 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 123.169 2.579 . . . . 0.85999999999999999 112.424 -178.033 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -68.67 -54.85 13.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.219 -0.446 . . . . 1.76 110.926 -177.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.3 p -73.2 -31.0 63.93 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.391 -0.368 . . . . 1.51 111.152 -179.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.633 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 1.5 tmtm? -65.8 -19.34 65.85 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.457 -0.572 . . . . 1.8300000000000001 109.457 172.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.531 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 11.7 tpt -86.79 -53.59 4.84 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.335 -0.617 . . . . 2.1899999999999999 109.335 -177.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.492 HH21 ' CD ' ' A' ' 24' ' ' GLU . 2.8 mmp_? -54.47 -44.75 72.86 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.568 -0.742 . . . . 4.7699999999999996 110.365 175.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 56.0 t60 -62.14 -34.57 76.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.078 -0.51 . . . . 0.55000000000000004 111.187 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.409 HD21 ' SG ' ' A' ' 6' ' ' CYS . 1.5 mm? -79.5 -33.5 42.07 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.992 -0.283 . . . . 2.0899999999999999 111.704 -177.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.492 ' CD ' HH21 ' A' ' 21' ' ' ARG . 16.5 pt-20 -85.41 -32.59 22.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.734 0.302 . . . . 2.46 111.163 -178.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 32.9 m -84.64 -3.68 58.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.363 0.601 . . . . 1.8999999999999999 110.45 177.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.93 -29.38 60.04 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 109.028 -0.73 . . . . 1.4399999999999999 109.028 169.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -76.18 71.96 2.94 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 114.915 -1.039 . . . . 3.02 110.077 173.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -129.62 48.69 2.34 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.564 -0.743 . . . . 4.8499999999999996 110.205 177.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -77.52 -32.48 54.12 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.42 -0.809 . . . . 7.3600000000000003 110.073 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.0 tttp . . . . . 0 C--O 1.249 1.035 0 CA-C-N 115.611 -0.722 . . . . 9.6199999999999992 110.071 177.307 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.55 ' O ' ' HD3' ' A' ' 3' ' ' PRO . 1.6 mpt? . . . . . 0 N--CA 1.483 1.192 0 CA-C-O 120.67 0.271 . . . . 5.8300000000000001 110.86 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 34.8 mmtm -104.99 92.32 5.19 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.518 -0.31 . . . . 4.7999999999999998 110.201 174.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.55 ' HD3' ' O ' ' A' ' 1' ' ' MET . 10.9 Cg_endo -91.25 159.96 3.77 Favored 'Trans proline' 0 N--CA 1.446 -1.315 0 C-N-CA 123.288 2.659 . . . . 1.74 111.569 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -101.18 83.41 2.48 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.238 -0.653 . . . . 1.3600000000000001 109.238 177.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.49 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 16.5 pt20 -72.16 159.93 33.29 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.515 -0.766 . . . . 2.7000000000000002 110.827 -177.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.963 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 8.6 t -83.11 128.61 34.63 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.238 -1.023 . . . . 0.45000000000000001 108.238 178.176 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.417 ' H ' HD13 ' A' ' 23' ' ' LEU . 12.6 m-20 -66.34 -6.29 13.67 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 112.856 0.688 . . . . 2.46 112.856 -171.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -111.72 -13.71 13.7 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.314 0.578 . . . . 1.25 109.982 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.847 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 74.9 m -119.31 -36.56 3.34 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.638 -0.71 . . . . 0.66000000000000003 112.868 -163.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.9 -16.01 39.7 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.432 -0.89 . . . . 0.53000000000000003 112.009 -176.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.49 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 72.6 ttt180 -62.69 135.4 57.35 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.936 -0.394 . . . . 3.8100000000000001 109.936 177.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 p -89.44 113.06 24.35 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.212 0.529 . . . . 1.6299999999999999 111.994 -174.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.963 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 69.4 m-85 -99.26 131.28 45.39 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.582 -0.895 . . . . 0.70999999999999996 108.582 172.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.5 m -79.67 4.33 16.43 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.386 -0.37 . . . . 2.0899999999999999 110.543 -176.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -131.3 115.83 16.35 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.448 -0.342 . . . . 1.9199999999999999 110.72 -174.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -61.8 -34.92 81.56 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 123.028 2.486 . . . . 0.85999999999999999 112.069 -178.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.9 p -70.9 -45.79 63.69 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.195 0.521 . . . . 1.76 110.474 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.4 m -71.65 -36.72 70.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.059 -0.519 . . . . 1.51 111.064 -177.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.7 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 0.2 OUTLIER -65.95 -19.42 65.86 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.82 -0.437 . . . . 1.8300000000000001 109.82 174.105 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 13.7 tpt -90.6 -46.34 8.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.872 -0.604 . . . . 2.1899999999999999 110.488 -174.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.8 mmm180 -64.05 -36.11 82.92 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.663 -0.495 . . . . 4.7699999999999996 109.663 176.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 44.0 t60 -70.18 -35.52 74.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.896 -0.593 . . . . 0.55000000000000004 110.372 176.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.543 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 5.2 tp -57.87 -58.59 7.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.578 -0.737 . . . . 2.0899999999999999 110.72 -178.174 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -64.14 -33.49 75.91 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.474 -0.785 . . . . 2.46 111.703 -176.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 25.9 m -74.15 -5.35 41.26 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.882 0.372 . . . . 1.8999999999999999 111.416 -176.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 13.6 m-70 -65.31 -18.66 65.49 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.865 0.364 . . . . 1.4399999999999999 110.345 173.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.428 ' OD2' ' HB3' ' A' ' 29' ' ' ASP . 35.9 t70 -117.68 96.32 5.33 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.4 -0.593 . . . . 3.02 109.4 175.44 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.3 p -78.09 23.13 0.28 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.89 -0.595 . . . . 4.8499999999999996 112.219 -175.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.428 ' HB3' ' OD2' ' A' ' 27' ' ' ASP . 20.0 t70 -86.39 -21.41 27.17 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.526 0.679 . . . . 7.3600000000000003 109.171 175.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.7 mttp . . . . . 0 C--O 1.247 0.966 0 CA-C-N 115.285 -0.87 . . . . 9.6199999999999992 110.472 -174.607 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.478 0.95 0 CA-C-O 120.818 0.342 . . . . 5.8300000000000001 110.227 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.489 ' HD2' ' HD2' ' A' ' 3' ' ' PRO . 26.9 tptp -83.88 118.49 71.49 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.313 -0.403 . . . . 4.7999999999999998 110.452 179.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.544 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 2.2 Cg_endo -83.94 155.13 13.22 Favored 'Trans proline' 0 N--CA 1.449 -1.105 0 C-N-CA 123.068 2.512 . . . . 1.74 111.148 176.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -108.01 122.2 46.36 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.862 -0.608 . . . . 1.3600000000000001 110.805 -175.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.608 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 8.6 tt0 -73.92 142.29 45.94 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.42 -0.809 . . . . 2.7000000000000002 111.508 -176.166 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.966 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 8.4 t -77.0 122.13 24.48 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 108.341 -0.985 . . . . 0.45000000000000001 108.341 174.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -64.47 -8.15 12.59 Favored 'General case' 0 C--N 1.319 -0.744 0 O-C-N 123.802 0.689 . . . . 2.46 112.732 -170.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -111.58 -21.74 11.59 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 121.135 0.493 . . . . 1.25 110.051 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.562 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 63.4 m -114.48 -29.76 6.75 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.312 0.856 . . . . 0.66000000000000003 113.312 -163.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.6 -8.66 78.56 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.417 -0.897 . . . . 0.53000000000000003 112.772 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -78.86 135.65 37.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.726 0.263 . . . . 3.8100000000000001 110.719 177.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.608 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 36.9 m -99.59 116.31 31.43 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.855 0.359 . . . . 1.6299999999999999 110.803 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.966 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 42.3 m-85 -94.62 128.74 41.47 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.29 -0.633 . . . . 0.70999999999999996 109.29 177.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.1 t -84.16 17.4 2.51 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.62 0.724 . . . . 2.0899999999999999 110.14 -178.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.427 ' HA ' ' HD2' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -125.78 102.79 28.3 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 115.47 -0.786 . . . . 1.9199999999999999 109.78 177.584 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.52 ' O ' ' HB2' ' A' ' 20' ' ' MET . 12.0 Cg_endo -55.35 -38.41 93.85 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 123.496 2.798 . . . . 0.85999999999999999 112.452 -176.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.5 m -74.97 -36.02 62.05 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.136 -0.483 . . . . 1.76 110.918 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.5 t -76.98 -41.9 41.13 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 120.99 -0.284 . . . . 1.51 110.385 -176.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.833 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 2.7 tmtm? -63.79 -18.01 63.66 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.415 0.626 . . . . 1.8300000000000001 109.828 175.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.52 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 0.2 OUTLIER -84.19 -53.56 5.42 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.472 -0.785 . . . . 2.1899999999999999 109.484 -175.286 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 53.2 mtp180 -70.13 -20.53 63.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.918 -0.583 . . . . 4.7699999999999996 110.444 175.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.428 ' HD2' ' SG ' ' A' ' 6' ' ' CYS . 63.1 t60 -66.89 -42.94 84.68 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.033 -0.531 . . . . 0.55000000000000004 109.641 173.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.1 -38.08 89.77 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.257 0.551 . . . . 2.0899999999999999 109.696 174.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -60.64 -41.27 94.61 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.099 -0.955 . . . . 2.46 111.207 177.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.0 p -84.37 0.41 49.43 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.545 0.572 . . . . 1.8999999999999999 112.545 -174.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.8 m-70 -83.62 13.79 4.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.029 0.442 . . . . 1.4399999999999999 110.472 173.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -84.2 -5.98 59.33 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.664 0.745 . . . . 3.02 109.568 175.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 9.8 t -66.39 -13.55 60.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.368 -0.833 . . . . 4.8499999999999996 110.727 177.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -81.72 -4.76 57.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.001 -0.545 . . . . 7.3600000000000003 111.105 178.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.462 ' HZ1' ' HB2' ' A' ' 30' ' ' LYS . 4.2 ttmp? . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.762 -0.637 . . . . 9.6199999999999992 109.874 177.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ptt? . . . . . 0 N--CA 1.48 1.038 0 CA-C-O 120.723 0.297 . . . . 5.8300000000000001 110.596 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.415 ' HB2' ' HE3' ' A' ' 2' ' ' LYS . 14.5 ptmt -170.74 148.75 2.72 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.963 -0.562 . . . . 4.7999999999999998 109.653 175.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.553 ' HB2' ' OG ' ' A' ' 12' ' ' SER . 1.0 OUTLIER -85.21 131.18 4.15 Favored 'Trans proline' 0 N--CA 1.447 -1.232 0 C-N-CA 123.098 2.532 . . . . 1.74 110.341 174.373 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.668 ' HB3' ' HD2' ' A' ' 19' ' ' LYS . 80.8 m-85 -95.75 97.19 9.5 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.623 -0.717 . . . . 1.3600000000000001 110.575 -173.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.811 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 36.6 tt0 -76.53 139.4 40.72 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.467 -0.788 . . . . 2.7000000000000002 110.792 -176.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 1.02 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 50.0 t -80.44 119.6 23.34 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.923 -0.769 . . . . 0.45000000000000001 108.923 176.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -64.12 -6.3 6.28 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.755 1.02 . . . . 2.46 113.755 -170.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -109.09 -33.39 6.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.946 0.879 . . . . 1.25 109.075 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.757 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 7.0 m -85.96 -40.32 15.98 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.388 -1.278 . . . . 0.66000000000000003 112.162 -170.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.75 -1.5 88.05 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 110.714 -0.954 . . . . 0.53000000000000003 110.714 -169.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.1 tpt180 -89.5 129.23 36.02 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.067 -0.716 . . . . 3.8100000000000001 109.067 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.811 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 0.8 OUTLIER -98.57 118.0 34.29 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 120.932 0.396 . . . . 1.6299999999999999 110.665 -175.903 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 1.02 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 24.8 m-85 -97.53 129.22 44.7 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.091 -0.707 . . . . 0.70999999999999996 109.091 178.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 59.1 m -78.26 4.46 12.71 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.53 -0.305 . . . . 2.0899999999999999 111.467 -177.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.489 ' HB3' ' HB3' ' A' ' 18' ' ' SER . 11.7 t70 -120.06 113.63 34.09 Favored Pre-proline 0 C--N 1.33 -0.281 0 C-N-CA 120.947 -0.301 . . . . 1.9199999999999999 110.505 -178.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.507 ' O ' ' HB2' ' A' ' 20' ' ' MET . 28.1 Cg_endo -62.51 -32.77 80.07 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 123.201 2.601 . . . . 0.85999999999999999 113.035 -176.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 35.8 m -80.46 -45.08 18.18 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.099 0.476 . . . . 1.76 110.652 -178.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.489 ' HB3' ' HB3' ' A' ' 15' ' ' ASP . 40.9 t -70.17 -37.14 75.1 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.002 -0.544 . . . . 1.51 110.905 -178.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.869 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 6.8 tmtt? -67.15 -18.86 65.47 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.115 0.483 . . . . 1.8300000000000001 109.835 174.351 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.507 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 10.6 tpt -86.86 -43.9 12.11 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.375 -0.602 . . . . 2.1899999999999999 109.375 -174.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.0 ttt85 -63.33 -38.37 90.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.601 -0.727 . . . . 4.7699999999999996 109.378 174.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -63.34 -38.63 91.89 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.301 -0.863 . . . . 0.55000000000000004 110.81 177.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.03 -36.69 84.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.998 0.428 . . . . 2.0899999999999999 110.433 176.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -70.37 -29.46 66.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.195 0.522 . . . . 2.46 110.498 175.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.0 m -66.53 -27.18 67.56 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.673 -0.694 . . . . 1.8999999999999999 110.592 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -72.51 -0.45 12.76 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.057 -0.52 . . . . 1.4399999999999999 112.004 -179.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -76.56 -86.01 0.05 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.916 -0.402 . . . . 3.02 109.916 176.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.6 p -147.03 22.77 1.21 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.037 0.446 . . . . 4.8499999999999996 110.069 177.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -115.48 16.65 16.61 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.174 0.512 . . . . 7.3600000000000003 110.855 -172.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.498 ' HB3' ' NZ ' ' A' ' 30' ' ' LYS . 1.1 ttpm? . . . . . 0 C--O 1.245 0.823 0 CA-C-O 118.935 -0.555 . . . . 9.6199999999999992 109.958 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ptt? . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 110.354 -0.239 . . . . 5.8300000000000001 110.354 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt 59.15 84.61 0.2 Allowed Pre-proline 0 N--CA 1.471 0.62 0 O-C-N 123.844 0.715 . . . . 4.7999999999999998 110.689 177.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -86.82 130.1 3.07 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 123.366 2.711 . . . . 1.74 112.859 -174.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.579 ' HB3' ' HE2' ' A' ' 19' ' ' LYS . 64.9 m-85 -127.12 161.22 28.97 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 114.82 -1.082 . . . . 1.3600000000000001 108.522 175.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.423 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 9.3 pt20 -116.32 161.1 19.54 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.91 -0.316 . . . . 2.7000000000000002 111.138 -177.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.88 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 43.5 t -88.22 121.18 30.32 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.659 -1.237 . . . . 0.45000000000000001 107.659 172.088 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -65.45 -1.65 2.68 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 113.649 0.981 . . . . 2.46 113.649 -171.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -108.53 -24.14 11.53 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.491 0.662 . . . . 1.25 109.339 174.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.756 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 92.9 m -110.22 -35.15 6.17 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.0 -1.0 . . . . 0.66000000000000003 113.069 -166.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.0 -11.44 57.31 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.899 -0.667 . . . . 0.53000000000000003 112.191 -175.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.423 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 9.8 ttp180 -70.07 141.77 52.76 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 110.353 -0.24 . . . . 3.8100000000000001 110.353 -178.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' A' ' 4' ' ' TYR . 31.9 m -90.06 113.62 25.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.122 0.487 . . . . 1.6299999999999999 111.811 -176.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.88 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 46.1 m-85 -101.29 119.46 38.79 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.099 -1.074 . . . . 0.70999999999999996 108.099 170.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.0 p -87.12 21.5 2.34 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.374 0.607 . . . . 2.0899999999999999 110.41 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -137.36 96.85 10.85 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 115.202 -0.908 . . . . 1.9199999999999999 110.002 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -57.03 -43.39 54.31 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.657 2.905 . . . . 0.85999999999999999 113.863 -172.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.0 t -62.18 -44.35 96.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.261 0.553 . . . . 1.76 111.682 -176.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.09 -28.93 39.0 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.284 -0.416 . . . . 1.51 111.297 -179.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.579 ' HE2' ' HB3' ' A' ' 4' ' ' TYR . 7.9 tttp -65.84 -20.25 66.17 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.411 -0.589 . . . . 1.8300000000000001 109.411 168.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -82.46 -50.25 9.06 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 109.087 -0.708 . . . . 2.1899999999999999 109.087 -177.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.7 mmm180 -64.66 -29.58 70.58 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.712 -0.676 . . . . 4.7699999999999996 110.081 175.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -64.32 -40.54 96.11 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.734 -0.667 . . . . 0.55000000000000004 110.371 175.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -68.16 -31.53 71.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.011 0.434 . . . . 2.0899999999999999 110.535 177.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -65.48 -50.64 64.57 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.065 -0.516 . . . . 2.46 110.994 176.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 17.2 p -76.6 -5.38 47.49 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.549 0.574 . . . . 1.8999999999999999 112.549 -174.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -68.41 -25.82 65.23 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.879 -0.415 . . . . 1.4399999999999999 109.879 173.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -86.29 -74.23 0.43 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.092 -0.503 . . . . 3.02 110.264 176.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.0 m -156.28 150.75 25.68 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.297 -0.631 . . . . 4.8499999999999996 109.297 -179.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -79.08 -39.18 34.42 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.449 -0.574 . . . . 7.3600000000000003 109.449 177.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.411 ' HG2' ' O ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.128 0 CA-C-N 115.462 -0.79 . . . . 9.6199999999999992 109.896 169.085 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.9 ttp . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 120.696 0.284 . . . . 5.8300000000000001 110.52 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.482 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 36.9 ttmt -83.95 114.0 51.35 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.386 -0.37 . . . . 4.7999999999999998 110.456 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.65 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 2.0 Cg_endo -82.89 179.91 4.92 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 123.607 2.871 . . . . 1.74 112.287 -178.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -124.8 132.16 53.37 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.214 0.53 . . . . 1.3600000000000001 110.462 -178.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -82.83 141.16 32.49 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.637 -0.711 . . . . 2.7000000000000002 111.939 -172.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.953 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 22.5 t -77.45 133.21 38.67 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.355 -0.98 . . . . 0.45000000000000001 108.355 176.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -55.6 -27.65 50.71 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.986 0.736 . . . . 2.46 112.986 -168.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -111.25 -9.27 14.31 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.241 -0.584 . . . . 1.25 110.753 -175.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.843 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 94.9 m -111.32 -37.95 5.13 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 113.929 1.085 . . . . 0.66000000000000003 113.929 -165.212 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.02 -20.15 30.57 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 119.959 -1.115 . . . . 0.53000000000000003 111.879 -174.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.6 ttt180 -64.49 137.2 57.74 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.828 0.347 . . . . 3.8100000000000001 110.411 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.65 ' HB3' ' HB2' ' A' ' 3' ' ' PRO . 11.2 m -95.28 112.16 23.91 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.653 -0.703 . . . . 1.6299999999999999 111.2 -176.332 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.953 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 60.8 m-85 -97.17 122.8 40.6 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.752 -0.833 . . . . 0.70999999999999996 108.752 174.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.6 m -81.96 10.58 6.25 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.129 0.49 . . . . 2.0899999999999999 110.851 -176.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -133.31 108.48 12.36 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.93 -0.577 . . . . 1.9199999999999999 109.816 178.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.427 ' O ' ' HB2' ' A' ' 20' ' ' MET . 35.4 Cg_endo -65.05 -26.43 58.14 Favored 'Trans proline' 0 CA--C 1.527 0.163 0 C-N-CA 123.004 2.469 . . . . 0.85999999999999999 113.106 -174.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 16.7 m -76.84 -45.89 26.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.848 0.356 . . . . 1.76 111.238 -176.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.0 p -77.51 -31.08 53.29 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.701 -0.399 . . . . 1.51 110.941 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.519 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 19.9 tttm -66.18 -19.22 65.77 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 121.216 0.532 . . . . 1.8300000000000001 109.645 171.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.427 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 43.5 tpp -78.41 -49.96 12.58 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.309 -0.626 . . . . 2.1899999999999999 109.309 -177.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.3 mmt85 -63.92 -33.53 75.92 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.704 -0.68 . . . . 4.7699999999999996 109.93 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 79.2 t60 -62.01 -43.68 98.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.732 -0.667 . . . . 0.55000000000000004 110.445 175.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.99 -40.95 90.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.17 0.51 . . . . 2.0899999999999999 109.771 177.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.86 -35.02 79.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.445 -0.798 . . . . 2.46 111.025 177.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 59.9 m -67.07 -25.79 66.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 1.8999999999999999 111.026 -178.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 57.1 m-70 -69.3 -25.28 64.16 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.092 0.472 . . . . 1.4399999999999999 110.429 176.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.13 -14.08 54.31 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.126 -0.488 . . . . 3.02 110.424 178.218 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 9.1 m -70.2 -15.39 62.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.322 0.582 . . . . 4.8499999999999996 110.32 178.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -66.83 -22.36 66.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.641 -0.708 . . . . 7.3600000000000003 110.356 176.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.9 mmtt . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.642 -0.694 . . . . 9.6199999999999992 110.049 -178.966 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.9 ttt . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 120.945 0.402 . . . . 5.8300000000000001 110.643 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.436 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 17.6 tppt? -100.01 121.68 53.17 Favored Pre-proline 0 C--N 1.321 -0.647 0 N-CA-C 109.535 -0.542 . . . . 4.7999999999999998 109.535 177.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 1.2 Cg_endo -86.32 129.51 3.25 Favored 'Trans proline' 0 N--CA 1.448 -1.153 0 C-N-CA 123.067 2.512 . . . . 1.74 111.778 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.596 ' CE1' ' HG3' ' A' ' 16' ' ' PRO . 75.6 m-85 -99.37 105.3 17.26 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 114.886 -1.052 . . . . 1.3600000000000001 109.371 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -83.1 150.94 25.97 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.603 -0.726 . . . . 2.7000000000000002 111.725 -173.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.745 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 51.1 t -99.56 111.45 23.79 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 115.428 -0.805 . . . . 0.45000000000000001 108.943 174.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.79 0.49 2.37 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.765 0.654 . . . . 2.46 112.765 -175.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -105.06 -21.24 13.31 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.938 -0.764 . . . . 1.25 108.938 175.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.745 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 4.1 m -103.52 -37.35 7.6 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.632 -1.167 . . . . 0.66000000000000003 111.832 -174.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.39 13.54 83.14 Favored Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 111.178 -0.769 . . . . 0.53000000000000003 111.178 -171.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 48.7 ttt180 -107.17 141.58 38.21 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 110.438 -0.208 . . . . 3.8100000000000001 110.438 -175.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.427 ' HB3' ' HB2' ' A' ' 3' ' ' PRO . 14.6 m -93.33 115.21 27.78 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 123.382 0.426 . . . . 1.6299999999999999 110.693 178.153 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.602 ' HB2' ' HB2' ' A' ' 19' ' ' LYS . 11.6 m-85 -95.53 133.82 39.1 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.791 -0.818 . . . . 0.70999999999999996 108.791 175.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.9 t -90.65 6.08 45.39 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.211 0.529 . . . . 2.0899999999999999 110.011 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -123.83 106.55 31.68 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.939 -0.573 . . . . 1.9199999999999999 110.101 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.596 ' HG3' ' CE1' ' A' ' 4' ' ' TYR . 38.7 Cg_exo -59.56 -42.95 42.96 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 123.184 2.59 . . . . 0.85999999999999999 112.817 -175.093 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 59.4 m -69.53 -44.3 71.25 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.003 0.43 . . . . 1.76 111.317 -176.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 12.9 m -75.0 -32.61 61.69 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.628 -0.429 . . . . 1.51 110.879 -178.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.602 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 8.7 tmtt? -67.12 -20.58 65.8 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 109.415 -0.587 . . . . 1.8300000000000001 109.415 173.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.414 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 4.1 tmm? -81.08 -53.92 5.99 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.813 -0.81 . . . . 2.1899999999999999 108.813 -175.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.2 mmt180 -58.24 -36.11 72.72 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.334 -0.848 . . . . 4.7699999999999996 110.026 174.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -62.6 -43.35 99.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.709 -0.678 . . . . 0.55000000000000004 111.029 177.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.1 mp -62.06 -39.53 92.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.905 0.383 . . . . 2.0899999999999999 110.24 177.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -65.21 -28.2 69.21 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.842 -0.617 . . . . 2.46 110.546 177.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 20.8 m -72.34 -16.87 61.88 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.902 -0.59 . . . . 1.8999999999999999 110.512 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 34.8 m-70 -75.96 -20.86 57.56 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.096 0.474 . . . . 1.4399999999999999 110.171 175.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -86.22 -49.06 8.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.856 -0.611 . . . . 3.02 109.45 174.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.3 t -133.28 107.18 7.97 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.585 -0.734 . . . . 4.8499999999999996 110.165 175.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -80.62 -49.58 11.08 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.612 -0.722 . . . . 7.3600000000000003 110.239 -177.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.7 mttm . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.846 -0.597 . . . . 9.6199999999999992 109.988 175.065 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.4 tpt . . . . . 0 N--CA 1.48 1.055 0 N-CA-C 110.276 -0.268 . . . . 5.8300000000000001 110.276 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 30.7 mmtp 61.0 82.92 0.22 Allowed Pre-proline 0 C--N 1.329 -0.288 0 O-C-N 123.671 0.607 . . . . 4.7999999999999998 111.371 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.727 ' HB2' ' HB2' ' A' ' 12' ' ' SER . 36.4 Cg_endo -91.19 128.3 1.21 Allowed 'Trans proline' 0 N--CA 1.44 -1.618 0 C-N-CA 123.046 2.497 . . . . 1.74 111.831 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.452 ' HB2' ' HD3' ' A' ' 19' ' ' LYS . 83.0 m-85 -110.98 120.64 43.06 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 115.34 -0.845 . . . . 1.3600000000000001 109.687 179.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.493 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 73.7 mt-30 -82.53 137.09 34.7 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.474 0.654 . . . . 2.7000000000000002 112.241 -170.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.938 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 52.6 t -76.66 123.47 26.19 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.475 -0.784 . . . . 0.45000000000000001 108.964 176.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -63.17 -12.68 29.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.024 0.75 . . . . 2.46 113.024 -171.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -107.56 -23.69 12.06 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.657 0.741 . . . . 1.25 109.549 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.763 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 11.8 m -98.16 -41.49 7.88 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.83 -1.077 . . . . 0.66000000000000003 112.958 -172.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.31 -10.0 65.3 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 111.017 -0.833 . . . . 0.53000000000000003 111.017 -167.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -79.14 134.43 36.71 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 122.838 0.455 . . . . 3.8100000000000001 110.19 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.727 ' HB2' ' HB2' ' A' ' 3' ' ' PRO . 47.3 p -95.21 122.93 38.41 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.126 -0.488 . . . . 1.6299999999999999 111.372 -177.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.938 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 19.3 m-85 -104.04 124.03 48.29 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.463 -0.94 . . . . 0.70999999999999996 108.463 173.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.0 m -80.49 13.36 2.51 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.113 0.482 . . . . 2.0899999999999999 111.03 -175.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -136.18 115.53 10.99 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.158 -0.474 . . . . 1.9199999999999999 110.154 -179.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.539 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 48.0 Cg_exo -56.62 -40.19 86.15 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.464 2.776 . . . . 0.85999999999999999 112.673 -177.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 m -73.08 -40.25 65.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.94 0.4 . . . . 1.76 111.19 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.3 m -73.76 -32.37 63.78 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.085 0.469 . . . . 1.51 110.425 -178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.764 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 15.0 ttpp -69.59 -18.89 63.65 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.688 -0.687 . . . . 1.8300000000000001 109.683 171.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 43.1 ttm -87.45 -47.95 8.35 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.835 -0.62 . . . . 2.1899999999999999 110.57 -173.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -59.25 -38.94 81.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.347 0.594 . . . . 4.7699999999999996 109.568 172.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -60.04 -48.48 81.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.19 -0.913 . . . . 0.55000000000000004 110.897 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.419 HD22 ' O ' ' A' ' 19' ' ' LYS . 2.7 mm? -64.34 -34.19 77.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.918 0.39 . . . . 2.0899999999999999 111.006 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -66.76 -21.07 66.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.197 0.523 . . . . 2.46 110.887 178.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.1 m -98.07 0.25 45.8 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.38 0.609 . . . . 1.8999999999999999 110.71 -178.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -77.96 -30.02 50.12 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.429 -0.351 . . . . 1.4399999999999999 111.775 -178.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -106.01 81.74 1.68 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.095 0.474 . . . . 3.02 110.35 179.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.3 p -102.99 16.19 27.35 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.543 0.687 . . . . 4.8499999999999996 110.144 175.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -78.76 -38.87 37.62 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.308 -0.86 . . . . 7.3600000000000003 109.777 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.244 0.795 0 CA-C-N 115.626 -0.715 . . . . 9.6199999999999992 110.392 177.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.4 mtp . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 120.718 0.294 . . . . 5.8300000000000001 110.747 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.463 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 18.4 ptpt -125.08 128.36 24.83 Favored Pre-proline 0 C--N 1.319 -0.738 0 N-CA-C 109.085 -0.709 . . . . 4.7999999999999998 109.085 173.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 6.9 Cg_endo -87.86 134.04 3.13 Favored 'Trans proline' 0 N--CA 1.446 -1.298 0 C-N-CA 123.294 2.662 . . . . 1.74 112.29 -174.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -106.76 109.53 21.46 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 114.742 -1.117 . . . . 1.3600000000000001 110.062 176.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.549 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 0.5 OUTLIER -77.65 152.81 33.63 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.726 -0.67 . . . . 2.7000000000000002 110.335 -179.815 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.969 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 21.5 t -84.13 129.41 34.9 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.201 -1.037 . . . . 0.45000000000000001 108.201 177.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.421 ' OD1' HD22 ' A' ' 23' ' ' LEU . 2.3 m-20 -54.98 -23.05 17.34 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 113.431 0.9 . . . . 2.46 113.431 -169.002 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -111.07 -16.58 13.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.361 0.6 . . . . 1.25 110.093 -178.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.882 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 83.6 m -105.89 -33.53 7.93 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.459 -0.792 . . . . 0.66000000000000003 112.931 -167.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.33 -10.59 35.03 Favored Glycine 0 CA--C 1.517 0.202 0 C-N-CA 120.795 -0.717 . . . . 0.53000000000000003 112.104 -176.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.549 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 30.4 ttm180 -63.46 135.9 57.23 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 122.616 0.367 . . . . 3.8100000000000001 110.416 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.2 m -89.94 103.67 16.31 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 123.369 0.418 . . . . 1.6299999999999999 111.043 -176.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.969 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 61.8 m-85 -91.43 119.4 31.38 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.334 -0.987 . . . . 0.70999999999999996 108.334 173.563 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.7 p -77.32 12.62 1.44 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.076 -0.511 . . . . 2.0899999999999999 111.333 -175.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.542 ' HB2' ' HB2' ' A' ' 18' ' ' SER . 8.5 m-20 -131.32 114.94 16.08 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 116.199 -0.455 . . . . 1.9199999999999999 109.946 -176.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -57.57 -46.34 27.89 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 123.329 2.686 . . . . 0.85999999999999999 112.523 -178.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 57.6 m -70.32 -35.92 73.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.746 0.308 . . . . 1.76 110.995 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.542 ' HB2' ' HB2' ' A' ' 15' ' ' ASP . 6.3 m -75.8 -35.52 60.03 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.785 -0.366 . . . . 1.51 111.324 -176.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.769 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 1.6 tmtm? -67.26 -18.41 65.2 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.207 -0.664 . . . . 1.8300000000000001 109.207 173.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 11.5 tpt -88.43 -48.65 7.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.206 -0.906 . . . . 2.1899999999999999 109.962 -179.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.2 ttp180 -57.84 -41.22 81.88 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-O 121.509 0.671 . . . . 4.7699999999999996 109.325 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 75.2 t60 -61.73 -38.39 87.73 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.163 -0.926 . . . . 0.55000000000000004 111.227 178.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.421 HD22 ' OD1' ' A' ' 7' ' ' ASP . 1.2 mp -62.53 -43.57 98.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.929 0.395 . . . . 2.0899999999999999 110.394 177.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -63.67 -32.45 73.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.779 -0.646 . . . . 2.46 110.353 176.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 24.1 m -74.46 -14.87 60.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.871 -0.604 . . . . 1.8999999999999999 111.32 -177.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 -76.36 -3.94 39.57 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 120.749 0.309 . . . . 1.4399999999999999 111.33 177.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -64.18 139.08 58.73 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.77 -0.826 . . . . 3.02 108.77 170.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.7 p 49.31 59.15 4.68 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.309 0.576 . . . . 4.8499999999999996 111.238 -171.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -61.92 -40.93 97.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.494 -0.776 . . . . 7.3600000000000003 109.073 175.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.8 tptp . . . . . 0 C--O 1.249 1.071 0 CA-C-N 115.034 -0.984 . . . . 9.6199999999999992 109.283 172.996 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.0 mtp . . . . . 0 N--CA 1.479 1.017 0 N-CA-C 110.045 -0.354 . . . . 5.8300000000000001 110.045 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.471 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 56.1 mtmt -109.36 132.58 21.19 Favored Pre-proline 0 C--N 1.321 -0.67 0 CA-C-N 116.074 -0.512 . . . . 4.7999999999999998 109.943 178.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.633 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 2.1 Cg_endo -86.92 152.9 8.49 Favored 'Trans proline' 0 N--CA 1.446 -1.274 0 C-N-CA 123.378 2.718 . . . . 1.74 111.832 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -100.13 129.52 46.17 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.593 -0.731 . . . . 1.3600000000000001 109.863 -176.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.487 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 60.6 mt-30 -84.35 148.31 26.7 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.087 0.47 . . . . 2.7000000000000002 112.09 -170.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.991 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 42.8 t -81.49 123.11 28.33 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.23 -1.026 . . . . 0.45000000000000001 108.23 176.246 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -64.21 -9.53 17.69 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.744 0.646 . . . . 2.46 112.744 -171.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.456 ' HE2' ' HG ' ' A' ' 23' ' ' LEU . 1.2 m-85 -106.88 -17.07 14.3 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 109.205 -0.665 . . . . 1.25 109.205 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.773 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 71.6 m -115.47 -40.5 3.4 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 113.649 0.981 . . . . 0.66000000000000003 113.649 -168.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.59 -13.13 64.87 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.558 -0.829 . . . . 0.53000000000000003 111.77 -174.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.485 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 64.8 ttt180 -69.58 137.0 52.0 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.94 -0.393 . . . . 3.8100000000000001 109.94 177.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.633 ' HB3' ' HB2' ' A' ' 3' ' ' PRO . 8.8 m -98.19 112.15 24.23 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.168 -0.469 . . . . 1.6299999999999999 111.178 -175.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.991 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 50.1 m-85 -95.92 123.94 39.72 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.394 -0.595 . . . . 0.70999999999999996 109.394 176.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.534 ' HA ' ' HA ' ' A' ' 3' ' ' PRO . 32.6 t -80.88 10.25 5.29 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.932 0.396 . . . . 2.0899999999999999 110.508 -176.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.669 ' HB2' ' OG ' ' A' ' 18' ' ' SER . 8.0 m-20 -130.64 110.05 16.01 Favored Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 109.546 -0.539 . . . . 1.9199999999999999 109.546 -177.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.472 ' O ' ' HB2' ' A' ' 20' ' ' MET . 31.2 Cg_exo -59.39 -32.85 97.25 Favored 'Trans proline' 0 C--O 1.225 -0.14 0 C-N-CA 122.731 2.287 . . . . 0.85999999999999999 112.018 179.538 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.0 p -70.54 -43.08 70.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.84 -0.618 . . . . 1.76 111.806 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.669 ' OG ' ' HB2' ' A' ' 15' ' ' ASP . 81.1 p -77.33 -38.48 50.31 Favored 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 120.53 -0.468 . . . . 1.51 110.391 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.552 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 23.8 tttm -63.46 -18.81 64.15 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-O 121.067 0.461 . . . . 1.8300000000000001 110.007 173.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.472 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 14.7 tpt -80.85 -54.26 5.75 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.5 -0.556 . . . . 2.1899999999999999 109.5 -177.277 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 52.9 mtm180 -69.49 -20.75 63.73 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.167 0.508 . . . . 4.7699999999999996 110.287 176.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 78.4 t60 -71.75 -43.13 66.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.07 -0.514 . . . . 0.55000000000000004 110.541 174.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.456 ' HG ' ' HE2' ' A' ' 8' ' ' TYR . 1.4 mp -63.16 -32.07 73.36 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.777 -0.453 . . . . 2.0899999999999999 109.777 176.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -67.53 -29.93 69.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.732 -0.667 . . . . 2.46 110.828 172.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 54.4 m -69.81 -24.49 63.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.08 0.467 . . . . 1.8999999999999999 110.65 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -79.96 -5.83 56.4 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.346 -0.388 . . . . 1.4399999999999999 110.331 177.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.2 t70 71.29 -66.63 0.29 Allowed 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 115.359 -0.837 . . . . 3.02 112.233 174.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.3 m -82.78 117.08 22.43 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.919 0.39 . . . . 4.8499999999999996 110.748 -174.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -89.54 -15.36 33.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.984 -0.553 . . . . 7.3600000000000003 110.598 -178.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.6 -0.714 . . . . 9.6199999999999992 110.383 -179.341 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.1 ttp . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 121.042 0.449 . . . . 5.8300000000000001 110.914 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.428 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 50.1 tttm -88.21 137.22 31.15 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.843 -0.617 . . . . 4.7999999999999998 111.162 -174.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 4.2 Cg_exo -81.83 128.92 6.09 Favored 'Trans proline' 0 N--CA 1.449 -1.111 0 C-N-CA 122.942 2.428 . . . . 1.74 109.786 171.309 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.657 ' HB3' ' CD ' ' A' ' 19' ' ' LYS . 77.4 m-85 -99.52 104.03 15.82 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 115.461 -0.79 . . . . 1.3600000000000001 111.398 -171.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.456 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 22.1 mt-30 -86.83 160.22 18.83 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.852 -0.613 . . . . 2.7000000000000002 111.318 -176.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.972 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 35.9 t -90.1 119.95 30.87 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 107.898 -1.149 . . . . 0.45000000000000001 107.898 174.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -69.32 0.07 5.53 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.722 0.638 . . . . 2.46 112.722 -171.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.4 m-30 -103.51 -23.77 13.48 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.951 -0.759 . . . . 1.25 108.951 173.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.777 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 88.4 m -114.0 -40.41 3.74 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.876 -1.056 . . . . 0.66000000000000003 113.549 -164.459 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.88 -15.54 61.52 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.769 -0.729 . . . . 0.53000000000000003 112.017 -174.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.456 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 61.1 ttt180 -67.42 138.7 56.86 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.184 0.193 . . . . 3.8100000000000001 110.578 -179.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.6 m -94.62 122.64 37.43 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.419 -0.355 . . . . 1.6299999999999999 110.936 -177.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.972 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 84.0 m-85 -101.64 139.63 37.03 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.821 -0.627 . . . . 0.70999999999999996 109.432 176.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.7 p -80.79 2.54 25.85 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.621 -0.718 . . . . 2.0899999999999999 110.828 -176.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.821 ' HB2' ' HB3' ' A' ' 18' ' ' SER . 8.4 m-20 -134.24 118.02 13.77 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.336 -0.393 . . . . 1.9199999999999999 110.216 -174.388 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.472 ' O ' ' HG3' ' A' ' 20' ' ' MET . 18.5 Cg_endo -60.6 -40.82 52.71 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 123.051 2.5 . . . . 0.85999999999999999 112.605 -178.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 88.7 m -80.51 -31.12 37.21 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.698 0.285 . . . . 1.76 110.732 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.821 ' HB3' ' HB2' ' A' ' 15' ' ' ASP . 25.7 t -74.49 -37.5 63.13 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 120.661 -0.416 . . . . 1.51 109.906 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.657 ' CD ' ' HB3' ' A' ' 4' ' ' TYR . 8.8 tttp -57.8 -28.64 64.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.077 -0.511 . . . . 1.8300000000000001 109.686 170.144 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.472 ' HG3' ' O ' ' A' ' 16' ' ' PRO . 61.2 mtp -84.44 -45.69 12.44 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 116.046 -0.525 . . . . 2.1899999999999999 110.335 -173.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -62.93 -31.68 72.82 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.54 -0.754 . . . . 4.7699999999999996 109.636 174.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 67.5 t60 -63.05 -46.36 87.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.491 -0.777 . . . . 0.55000000000000004 110.626 173.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.404 HD23 ' O ' ' A' ' 19' ' ' LYS . 2.3 mm? -59.27 -38.82 81.04 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.475 -0.33 . . . . 2.0899999999999999 110.665 178.276 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 20' ' ' MET . 48.4 mt-10 -63.19 -34.14 76.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.237 -0.438 . . . . 2.46 110.281 176.09 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.9 m -76.69 -8.46 57.32 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.822 -0.626 . . . . 1.8999999999999999 110.838 -178.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -79.6 -28.96 41.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.939 0.399 . . . . 1.4399999999999999 110.249 173.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.589 ' O ' ' HB ' ' A' ' 28' ' ' THR . 55.3 m-20 58.14 -87.99 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.148 -0.933 . . . . 3.02 111.567 -179.24 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.589 ' HB ' ' O ' ' A' ' 27' ' ' ASP . 6.7 t 159.65 -20.72 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 123.884 0.874 . . . . 4.8499999999999996 108.791 -178.085 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -78.73 -21.63 47.76 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.135 -0.939 . . . . 7.3600000000000003 111.734 -175.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.841 -0.6 . . . . 9.6199999999999992 110.797 -173.197 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 N--CA 1.482 1.175 0 N-CA-C 110.006 -0.368 . . . . 5.8300000000000001 110.006 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 18.0 ptpt -108.61 115.59 57.43 Favored Pre-proline 0 C--N 1.323 -0.558 0 N-CA-C 109.171 -0.677 . . . . 4.7999999999999998 109.171 170.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.647 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 2.0 Cg_endo -84.14 161.71 13.46 Favored 'Trans proline' 0 N--CA 1.45 -1.069 0 C-N-CA 123.032 2.488 . . . . 1.74 111.201 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -88.47 85.2 6.81 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.881 -0.6 . . . . 1.3600000000000001 109.842 -177.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.523 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 4.7 pp0? -72.1 146.45 47.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.492 -0.776 . . . . 2.7000000000000002 110.356 -179.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 1.051 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 48.8 t -81.27 122.53 27.54 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.269 -0.641 . . . . 0.45000000000000001 109.269 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -59.91 -17.35 36.73 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.495 0.554 . . . . 2.46 112.495 -172.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -98.79 -25.4 14.66 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.657 0.742 . . . . 1.25 109.527 -178.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.823 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 35.6 m -107.61 -40.92 5.18 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.689 -1.141 . . . . 0.66000000000000003 113.147 -164.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.54 -12.39 65.31 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.641 -0.79 . . . . 0.53000000000000003 111.599 -171.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.414 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 14.2 tpp180 -69.34 129.91 41.11 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 122.534 0.333 . . . . 3.8100000000000001 110.186 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.647 ' HB3' ' HB2' ' A' ' 3' ' ' PRO . 19.6 m -89.8 110.2 21.14 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.086 -0.506 . . . . 1.6299999999999999 111.174 -178.046 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 1.051 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 25.8 m-85 -94.08 135.12 35.78 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.744 -0.835 . . . . 0.70999999999999996 108.744 173.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.3 m -90.06 5.31 47.24 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 121.068 0.461 . . . . 2.0899999999999999 110.475 -176.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -123.51 109.45 30.76 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.941 -0.572 . . . . 1.9199999999999999 110.39 179.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.466 ' O ' ' HB2' ' A' ' 20' ' ' MET . 19.2 Cg_endo -58.43 -40.95 70.24 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.252 2.635 . . . . 0.85999999999999999 113.064 -176.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.2 m -72.21 -40.58 67.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.24 0.543 . . . . 1.76 110.479 -178.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.6 t -74.9 -37.95 61.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.039 -0.528 . . . . 1.51 110.187 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.779 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 7.8 tmtt? -63.27 -20.75 65.74 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.283 0.563 . . . . 1.8300000000000001 109.766 172.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.466 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 9.7 tpt -89.85 -37.57 14.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.832 -0.622 . . . . 2.1899999999999999 109.955 -173.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 78.5 mtp180 -69.79 -35.13 74.61 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.854 -0.612 . . . . 4.7699999999999996 109.578 171.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 48.5 t60 -60.53 -43.93 96.6 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.482 -0.781 . . . . 0.55000000000000004 109.735 172.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 26' ' ' HIS . 6.4 tp -63.13 -36.95 85.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.076 -0.511 . . . . 2.0899999999999999 110.293 178.27 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -64.14 -37.27 86.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.402 -0.817 . . . . 2.46 110.418 176.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 6.3 m -78.47 0.47 25.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.895 -0.593 . . . . 1.8999999999999999 110.818 -178.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.759 ' HA ' ' HB2' ' A' ' 29' ' ' ASP . 1.7 m-70 -79.03 -6.12 55.61 Favored 'General case' 0 C--N 1.331 -0.225 0 O-C-N 122.032 -0.417 . . . . 1.4399999999999999 112.057 -178.116 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -62.02 -51.08 69.47 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 108.83 -0.804 . . . . 3.02 108.83 168.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.2 m -109.51 38.98 2.19 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.025 -0.989 . . . . 4.8499999999999996 110.344 -177.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.759 ' HB2' ' HA ' ' A' ' 26' ' ' HIS . 25.0 t70 -82.96 -59.93 2.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.016 -0.538 . . . . 7.3600000000000003 109.741 177.671 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 62.4 pttt . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.272 -0.871 . . . . 9.6199999999999992 109.785 174.61 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.4 mtm . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 121.057 0.456 . . . . 5.8300000000000001 110.078 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.405 ' HB2' ' HE3' ' A' ' 2' ' ' LYS . 33.9 mtmt -139.27 151.39 67.2 Favored Pre-proline 0 C--N 1.324 -0.54 0 CA-C-N 115.832 -0.622 . . . . 4.7999999999999998 109.552 178.342 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -89.99 127.6 1.52 Allowed 'Trans proline' 0 N--CA 1.444 -1.406 0 C-N-CA 122.843 2.362 . . . . 1.74 110.4 172.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -105.7 104.07 13.71 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.398 -0.819 . . . . 1.3600000000000001 110.399 -175.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.826 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 0.7 OUTLIER -76.38 145.68 39.26 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.098 -0.956 . . . . 2.7000000000000002 110.936 -176.585 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.851 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 53.1 t -84.89 119.39 25.29 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.583 -0.735 . . . . 0.45000000000000001 109.111 177.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -66.42 -3.07 5.33 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.437 0.532 . . . . 2.46 112.437 -175.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.6 m-85 -108.6 -17.81 13.88 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.239 -0.652 . . . . 1.25 109.239 178.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.749 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 15.5 m -111.6 -41.75 4.0 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.299 -0.864 . . . . 0.66000000000000003 112.847 -172.208 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.05 -3.65 84.55 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.722 -0.752 . . . . 0.53000000000000003 111.537 -170.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.5 tpt180 -91.48 131.39 36.96 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 109.949 -0.389 . . . . 3.8100000000000001 109.949 -178.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.826 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 44.9 m -92.88 121.54 34.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.014 0.435 . . . . 1.6299999999999999 111.082 -178.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.851 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 11.1 m-85 -100.87 127.6 47.27 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.469 -0.938 . . . . 0.70999999999999996 108.469 175.257 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 21.3 m -79.4 9.51 4.7 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.807 0.337 . . . . 2.0899999999999999 111.057 -177.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -122.88 106.22 34.39 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.201 -0.454 . . . . 1.9199999999999999 109.969 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.58 -38.72 88.2 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 123.02 2.48 . . . . 0.85999999999999999 112.65 -177.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.2 t -71.5 -40.22 70.32 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.993 -0.549 . . . . 1.76 110.941 -179.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.4 m -76.77 -35.02 57.97 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.406 -0.361 . . . . 1.51 110.477 -179.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.691 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 8.7 tmtt? -66.42 -18.85 65.6 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.306 -0.628 . . . . 1.8300000000000001 109.306 172.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 14.7 tpt -84.7 -50.09 7.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.52 -0.764 . . . . 2.1899999999999999 109.039 -178.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.1 ttp180 -59.79 -38.84 83.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.235 -0.893 . . . . 4.7699999999999996 109.629 176.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 41.6 t60 -62.27 -43.6 98.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.934 -1.03 . . . . 0.55000000000000004 110.986 178.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.5 mp -66.38 -31.51 72.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.498 -0.319 . . . . 2.0899999999999999 110.944 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -70.34 -30.03 66.88 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.219 0.533 . . . . 2.46 110.256 175.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.0 m -70.62 -17.87 62.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.926 -0.579 . . . . 1.8999999999999999 110.208 177.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -77.02 -9.31 58.61 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.949 -0.569 . . . . 1.4399999999999999 111.272 176.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -83.24 93.66 7.73 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.967 -0.753 . . . . 3.02 108.967 172.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 35.1 p -62.06 136.09 57.8 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.365 -0.834 . . . . 4.8499999999999996 111.3 -177.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -64.55 -32.6 74.32 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.513 -0.767 . . . . 7.3600000000000003 109.071 174.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 23.6 tptm . . . . . 0 C--O 1.247 0.937 0 CA-C-N 114.724 -1.125 . . . . 9.6199999999999992 108.923 173.877 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 mmt . . . . . 0 N--CA 1.48 1.061 0 N-CA-C 109.959 -0.385 . . . . 5.8300000000000001 109.959 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.451 ' HE3' ' HB2' ' A' ' 2' ' ' LYS . 30.2 ttmt -153.71 108.92 2.54 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-O 120.886 0.374 . . . . 4.7999999999999998 110.549 -178.103 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.507 ' HB2' ' HB2' ' A' ' 12' ' ' SER . 2.1 Cg_endo -82.78 168.16 14.22 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 122.919 2.412 . . . . 1.74 111.597 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.478 ' HB3' ' HE2' ' A' ' 19' ' ' LYS . 82.3 m-85 -116.54 107.29 14.55 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.8 -0.636 . . . . 1.3600000000000001 109.923 -177.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.524 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 4.0 pt20 -77.65 159.48 29.15 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.325 0.583 . . . . 2.7000000000000002 112.182 -173.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.887 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 33.4 t -98.54 119.49 37.35 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 108.09 -1.078 . . . . 0.45000000000000001 108.09 171.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -62.14 -18.35 60.64 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.579 0.585 . . . . 2.46 112.579 -170.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -102.9 -13.66 16.85 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.507 0.67 . . . . 1.25 109.28 -176.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.809 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 32.7 m -113.32 -36.64 4.93 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.203 -0.908 . . . . 0.66000000000000003 112.975 -170.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.26 -3.33 84.98 Favored Glycine 0 N--CA 1.453 -0.187 0 N-CA-C 111.181 -0.768 . . . . 0.53000000000000003 111.181 -173.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -80.82 130.07 34.86 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.71 0.404 . . . . 3.8100000000000001 110.374 -178.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.524 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 5.1 p -93.75 122.02 35.79 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.087 -0.506 . . . . 1.6299999999999999 111.481 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.887 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 40.8 m-85 -99.84 142.91 30.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.907 -0.588 . . . . 0.70999999999999996 109.731 177.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.5 p -88.87 13.29 13.0 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.942 -0.572 . . . . 2.0899999999999999 110.368 178.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.435 ' O ' ' HB3' ' A' ' 19' ' ' LYS . 2.1 m-20 -124.87 115.22 26.5 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.464 -0.789 . . . . 1.9199999999999999 110.543 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.424 ' HG3' ' CE1' ' A' ' 4' ' ' TYR . 19.2 Cg_exo -65.1 -46.93 5.24 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 123.003 2.469 . . . . 0.85999999999999999 112.308 -178.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.8 m -72.69 -39.69 66.84 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.994 -0.548 . . . . 1.76 110.499 -178.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.405 ' HB2' ' CB ' ' A' ' 15' ' ' ASP . 16.8 m -70.85 -39.21 73.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.436 -0.347 . . . . 1.51 111.142 -179.11 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.532 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 1.2 tmtm? -63.86 -19.14 64.83 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.407 0.622 . . . . 1.8300000000000001 109.751 174.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 33.2 tpp -89.82 -44.73 9.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.591 -0.731 . . . . 2.1899999999999999 110.344 -176.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -67.27 -31.2 71.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.268 0.556 . . . . 4.7699999999999996 109.7 174.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -66.08 -48.27 71.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.339 -0.846 . . . . 0.55000000000000004 111.101 177.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.772 HD13 ' HA ' ' A' ' 6' ' ' CYS . 2.5 mp -67.35 -25.3 65.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.901 0.381 . . . . 2.0899999999999999 111.018 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -75.63 -35.55 60.44 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.142 -0.481 . . . . 2.46 110.855 177.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.426 ' C ' ' H ' ' A' ' 27' ' ' ASP . 10.1 p -88.24 1.62 54.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.173 -0.467 . . . . 1.8999999999999999 111.774 -177.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.73 32.26 0.13 Allowed 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 111.885 0.328 . . . . 1.4399999999999999 111.885 179.294 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.426 ' H ' ' C ' ' A' ' 25' ' ' THR . 6.5 t70 -77.99 -154.24 0.07 Allowed 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 109.795 -0.446 . . . . 3.02 109.795 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.4 p -79.22 24.51 0.33 Allowed 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.776 -0.578 . . . . 4.8499999999999996 112.258 -177.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -62.36 -46.39 88.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.297 0.57 . . . . 7.3600000000000003 110.206 176.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 57.6 mttp . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.654 -0.689 . . . . 9.6199999999999992 109.555 173.879 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 70.2 mtm . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 120.932 0.396 . . . . 5.8300000000000001 110.982 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -132.45 153.18 81.1 Favored Pre-proline 0 C--N 1.321 -0.67 0 CA-C-N 115.75 -0.659 . . . . 4.7999999999999998 109.593 176.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.697 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 5.8 Cg_exo -80.62 129.49 7.34 Favored 'Trans proline' 0 N--CA 1.452 -0.962 0 C-N-CA 123.288 2.658 . . . . 1.74 111.758 -178.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.512 ' HB3' ' HE3' ' A' ' 19' ' ' LYS . 96.3 m-85 -108.53 129.36 55.3 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 114.705 -1.134 . . . . 1.3600000000000001 111.067 -177.735 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -76.36 133.76 39.86 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.845 -0.428 . . . . 2.7000000000000002 109.845 175.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.985 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 44.6 t -82.82 122.96 28.89 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 108.521 -0.918 . . . . 0.45000000000000001 108.521 171.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -62.71 -15.24 51.91 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.922 0.712 . . . . 2.46 112.922 -171.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -109.97 -16.77 13.76 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.775 0.798 . . . . 1.25 109.547 -176.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.805 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 12.7 m -99.2 -37.0 9.47 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.882 -1.054 . . . . 0.66000000000000003 111.801 -178.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.77 8.57 87.68 Favored Glycine 0 N--CA 1.451 -0.327 0 N-CA-C 111.062 -0.815 . . . . 0.53000000000000003 111.062 -173.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 64.3 ttt180 -106.61 137.85 43.87 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.457 -0.372 . . . . 3.8100000000000001 110.59 -173.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.5 m -91.44 114.36 26.87 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.942 -0.572 . . . . 1.6299999999999999 110.709 -179.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.985 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 19.1 m-85 -97.17 121.83 39.49 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.747 -0.835 . . . . 0.70999999999999996 108.747 173.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.697 ' HA ' ' HA ' ' A' ' 3' ' ' PRO . 34.9 t -82.57 22.0 0.92 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.39 0.614 . . . . 2.0899999999999999 109.889 178.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.448 ' H ' ' C ' ' A' ' 13' ' ' PHE . 11.7 m-20 -123.53 96.33 43.76 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.385 -0.825 . . . . 1.9199999999999999 109.806 -178.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.0 -43.11 62.62 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.439 2.759 . . . . 0.85999999999999999 113.938 -173.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 94.6 m -82.01 -34.3 29.66 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.145 0.498 . . . . 1.76 110.996 -177.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.3 m -77.95 -31.1 50.71 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.667 -0.413 . . . . 1.51 110.909 -177.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.741 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 8.8 tmtt? -69.17 -22.17 63.93 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 109.098 -0.704 . . . . 1.8300000000000001 109.098 171.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -77.32 -53.53 7.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.407 -0.815 . . . . 2.1899999999999999 109.525 -174.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -67.71 -28.58 67.78 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.661 -0.7 . . . . 4.7699999999999996 110.343 177.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 62.6 t60 -60.62 -46.09 91.57 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.052 0.453 . . . . 0.55000000000000004 109.834 172.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -61.7 -46.95 87.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.808 -0.633 . . . . 2.0899999999999999 110.44 177.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -56.44 -31.09 63.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.731 0.301 . . . . 2.46 111.576 178.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 96.2 m -74.26 -57.28 4.05 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 112.649 0.611 . . . . 1.8999999999999999 112.649 -173.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -109.24 25.4 11.85 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 119.676 -0.81 . . . . 1.4399999999999999 112.163 -171.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -97.88 -73.62 0.61 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.325 -0.398 . . . . 3.02 110.065 172.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 73.3 p 59.37 142.44 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.527 1.131 . . . . 4.8499999999999996 113.607 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -81.82 -19.33 41.33 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.977 -1.011 . . . . 7.3600000000000003 111.245 -177.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.8 ttpp . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.374 -0.822 . . . . 9.6199999999999992 110.139 -177.41 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.5 mmt . . . . . 0 N--CA 1.482 1.127 0 CA-C-O 121.016 0.436 . . . . 5.8300000000000001 110.755 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 54.7 pttt -70.39 145.72 93.41 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.602 -0.726 . . . . 4.7999999999999998 110.851 179.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -85.35 159.31 11.12 Favored 'Trans proline' 0 N--CA 1.45 -1.065 0 C-N-CA 123.392 2.728 . . . . 1.74 111.469 -178.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.662 ' HB3' ' HD3' ' A' ' 19' ' ' LYS . 83.6 m-85 -97.58 89.47 4.68 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-O 121.334 0.587 . . . . 1.3600000000000001 111.011 -176.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.475 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 37.8 tt0 -71.99 146.1 47.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.335 -0.848 . . . . 2.7000000000000002 111.213 -178.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.844 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 53.4 t -87.35 123.25 32.11 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.568 -0.901 . . . . 0.45000000000000001 108.568 169.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -68.17 -8.57 39.82 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 112.043 0.386 . . . . 2.46 112.043 -175.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.575 ' CE2' ' HG ' ' A' ' 23' ' ' LEU . 15.5 m-85 -111.11 -6.08 14.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.048 0.451 . . . . 1.25 109.864 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.844 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 11.0 m -120.08 -36.72 3.2 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.825 0.676 . . . . 0.66000000000000003 112.825 -172.566 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.15 -7.95 72.96 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.699 -0.763 . . . . 0.53000000000000003 111.737 -173.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.475 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 63.2 ttt180 -80.53 139.7 36.22 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 120.53 0.205 . . . . 3.8100000000000001 110.632 -177.336 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 p -91.51 117.95 30.15 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.987 -0.551 . . . . 1.6299999999999999 110.743 176.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.727 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 54.5 m-85 -98.69 147.54 24.75 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.69 -0.485 . . . . 0.70999999999999996 109.69 177.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 55.4 m -91.59 2.96 56.1 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.392 -0.596 . . . . 2.0899999999999999 109.392 176.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.576 ' O ' ' HB3' ' A' ' 19' ' ' LYS . 25.2 m-20 -120.98 109.34 35.71 Favored Pre-proline 0 CA--C 1.516 -0.33 0 CA-C-N 115.686 -0.688 . . . . 1.9199999999999999 110.689 -176.012 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.454 ' HG3' ' CE1' ' A' ' 4' ' ' TYR . 25.0 Cg_exo -62.56 -43.49 21.65 Favored 'Trans proline' 0 N--CA 1.464 -0.248 0 C-N-CA 122.454 2.103 . . . . 0.85999999999999999 111.764 177.608 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.9 m -75.75 -40.01 56.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.728 -0.669 . . . . 1.76 111.181 -178.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.569 ' HB2' ' CB ' ' A' ' 15' ' ' ASP . 70.4 m -79.81 -25.13 40.96 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.675 -0.41 . . . . 1.51 111.347 -177.38 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.662 ' HD3' ' HB3' ' A' ' 4' ' ' TYR . 6.4 tttp -68.97 -24.32 64.24 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.213 -0.662 . . . . 1.8300000000000001 109.213 167.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 13.9 tpt -80.12 -53.23 6.89 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.666 -0.697 . . . . 2.1899999999999999 110.131 -171.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -60.52 -33.28 72.4 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 121.272 0.558 . . . . 4.7699999999999996 109.614 176.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -63.24 -48.07 79.77 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.272 -0.876 . . . . 0.55000000000000004 110.432 175.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.575 ' HG ' ' CE2' ' A' ' 8' ' ' TYR . 0.6 OUTLIER -64.79 -42.19 95.25 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.365 -0.834 . . . . 2.0899999999999999 111.053 -175.074 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -80.18 -1.24 39.58 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.963 0.357 . . . . 2.46 111.963 -176.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 88.6 m -96.46 -40.1 9.24 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.49 -0.484 . . . . 1.8999999999999999 111.177 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -108.97 14.61 23.98 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 119.499 -0.88 . . . . 1.4399999999999999 112.149 -174.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -67.7 142.22 56.39 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.48 -0.563 . . . . 3.02 109.48 176.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 33.6 p -74.7 147.41 41.45 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.228 -0.442 . . . . 4.8499999999999996 111.84 -173.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -55.16 -37.84 67.51 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.669 -0.696 . . . . 7.3600000000000003 110.21 173.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 79.1 tttt . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.23 -0.89 . . . . 9.6199999999999992 109.952 177.128 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.1 mmm . . . . . 0 N--CA 1.48 1.054 0 CA-C-O 120.748 0.309 . . . . 5.8300000000000001 110.699 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.774 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 70.2 mmtt -96.71 -59.1 0.17 Allowed Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.392 -0.367 . . . . 4.7999999999999998 111.012 178.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.774 ' HD3' ' HB2' ' A' ' 2' ' ' LYS . 7.6 Cg_endo -90.29 140.63 3.26 Favored 'Trans proline' 0 N--CA 1.45 -1.073 0 C-N-CA 122.729 2.286 . . . . 1.74 111.835 179.219 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -105.37 125.75 51.34 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.55 -0.75 . . . . 1.3600000000000001 109.767 -178.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.614 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 19.9 pt20 -76.01 160.1 30.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.303 0.573 . . . . 2.7000000000000002 111.68 -174.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.714 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 36.5 t -110.15 121.25 44.82 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.098 -0.704 . . . . 0.45000000000000001 109.098 171.356 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.5 -11.54 35.05 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.359 0.503 . . . . 2.46 112.359 -173.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -103.72 -26.51 12.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.769 0.795 . . . . 1.25 109.193 -178.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.714 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 4.1 m -94.65 -41.09 9.48 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.674 -1.148 . . . . 0.66000000000000003 112.041 -173.225 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.35 11.17 85.76 Favored Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 110.559 -1.017 . . . . 0.53000000000000003 110.559 -166.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -109.95 132.03 54.52 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.786 -0.449 . . . . 3.8100000000000001 109.786 -177.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.627 ' HB3' ' HB2' ' A' ' 3' ' ' PRO . 14.4 m -92.84 118.28 30.94 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.501 -0.772 . . . . 1.6299999999999999 110.646 -177.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.671 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 44.7 m-85 -99.06 122.88 42.89 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.075 -0.713 . . . . 0.70999999999999996 109.075 177.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' A' ' 3' ' ' PRO . 22.7 t -83.17 17.85 1.89 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.182 0.515 . . . . 2.0899999999999999 109.788 178.323 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.413 ' H ' ' C ' ' A' ' 13' ' ' PHE . 6.7 m-20 -131.06 100.44 17.15 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 109.183 -0.673 . . . . 1.9199999999999999 109.183 -176.637 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.419 ' O ' ' HB2' ' A' ' 20' ' ' MET . 43.8 Cg_exo -55.73 -43.77 54.29 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.191 2.594 . . . . 0.85999999999999999 112.797 -175.685 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.8 m -65.97 -42.57 89.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.109 -0.496 . . . . 1.76 111.24 -178.236 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.9 m -74.85 -37.49 62.21 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.564 -0.289 . . . . 1.51 111.197 -178.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.651 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 26.1 tttp -64.31 -20.24 65.96 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.158 0.504 . . . . 1.8300000000000001 109.717 174.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.419 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 12.8 tpt -85.83 -51.44 6.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.492 -0.776 . . . . 2.1899999999999999 109.734 -173.114 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 48.2 mtp180 -63.32 -37.58 87.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.372 -0.831 . . . . 4.7699999999999996 110.29 175.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -66.18 -38.4 87.94 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.745 -0.661 . . . . 0.55000000000000004 110.512 178.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.493 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 3.2 tp -62.72 -43.7 98.14 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.996 0.426 . . . . 2.0899999999999999 109.987 178.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -57.95 -38.71 76.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.406 -0.816 . . . . 2.46 110.902 177.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 16.0 m -77.86 0.25 24.67 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.628 -0.715 . . . . 1.8999999999999999 111.425 -176.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 12.5 m-70 -78.65 -0.07 28.53 Favored 'General case' 0 C--O 1.234 0.258 0 O-C-N 121.91 -0.494 . . . . 1.4399999999999999 111.716 176.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -82.33 57.01 3.45 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.979 0.895 . . . . 3.02 108.946 172.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 16.2 p -134.52 179.17 6.45 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.867 -1.06 . . . . 4.8499999999999996 110.081 -176.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -97.17 18.11 15.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.219 -0.446 . . . . 7.3600000000000003 110.328 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? . . . . . 0 C--O 1.244 0.809 0 CA-C-N 115.832 -0.622 . . . . 9.6199999999999992 109.809 -178.894 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ttt . . . . . 0 N--CA 1.48 1.048 0 CA-C-O 120.621 0.248 . . . . 5.8300000000000001 111.057 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.47 151.28 58.78 Favored Pre-proline 0 C--N 1.328 -0.354 0 N-CA-C 109.509 -0.552 . . . . 4.7999999999999998 109.509 177.099 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.892 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 7.2 Cg_endo -88.89 137.34 3.25 Favored 'Trans proline' 0 N--CA 1.447 -1.223 0 C-N-CA 123.274 2.649 . . . . 1.74 112.165 -176.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -101.42 103.5 14.41 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.044 -0.98 . . . . 1.3600000000000001 109.621 -179.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.719 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 3.8 pt20 -71.89 141.42 49.53 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.108 -0.497 . . . . 2.7000000000000002 111.251 -178.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.728 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 44.4 t -90.6 130.09 36.66 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.834 -0.621 . . . . 0.45000000000000001 109.759 177.478 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -75.22 -2.65 28.95 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 111.65 0.241 . . . . 2.46 111.65 -175.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -101.76 -32.15 10.42 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 122.202 1.001 . . . . 1.25 108.643 177.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.728 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 27.7 m -101.28 -37.57 8.45 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 113.618 -1.628 . . . . 0.66000000000000003 112.563 -167.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.69 -2.37 88.14 Favored Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.832 -0.699 . . . . 0.53000000000000003 111.584 -173.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.432 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 75.0 ttt180 -96.17 139.63 32.05 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.944 -0.391 . . . . 3.8100000000000001 109.944 -176.131 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.892 ' HB3' ' HB2' ' A' ' 3' ' ' PRO . 20.0 m -92.73 106.05 18.09 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.028 -0.533 . . . . 1.6299999999999999 110.457 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.876 ' HB2' ' HB2' ' A' ' 19' ' ' LYS . 50.0 m-85 -88.61 119.78 29.39 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.834 -0.802 . . . . 0.70999999999999996 108.834 177.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.572 ' HA ' ' HA ' ' A' ' 3' ' ' PRO . 18.2 t -78.76 8.44 5.43 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.777 0.323 . . . . 2.0899999999999999 110.612 -176.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.442 ' HA ' ' HD2' ' A' ' 16' ' ' PRO . 0.7 OUTLIER -121.03 104.64 41.15 Favored Pre-proline 0 C--N 1.328 -0.329 0 N-CA-C 109.807 -0.442 . . . . 1.9199999999999999 109.807 177.251 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.442 ' HD2' ' HA ' ' A' ' 15' ' ' ASP . 18.3 Cg_endo -57.6 -32.9 95.66 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 123.058 2.506 . . . . 0.85999999999999999 112.728 -175.272 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.0 m -83.07 -31.92 27.09 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.253 -0.431 . . . . 1.76 111.195 -178.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.0 m -81.18 -32.32 33.64 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.936 0.398 . . . . 1.51 110.376 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.876 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 7.6 tmtt? -66.76 -19.12 65.68 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.825 -0.625 . . . . 1.8300000000000001 109.338 170.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -87.77 -51.9 5.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.349 -0.841 . . . . 2.1899999999999999 109.2 -177.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.464 ' HA ' ' OE1' ' A' ' 24' ' ' GLU . 55.2 ttp180 -54.01 -39.33 65.99 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.759 -0.655 . . . . 4.7699999999999996 110.275 173.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.526 ' HA ' HG23 ' A' ' 25' ' ' THR . 64.7 t60 -69.08 -30.29 68.57 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.451 -0.795 . . . . 0.55000000000000004 110.914 177.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.08 -34.55 75.3 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.471 -0.566 . . . . 2.0899999999999999 109.471 177.021 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.464 ' OE1' ' HA ' ' A' ' 21' ' ' ARG . 42.4 mt-10 -66.43 -46.67 75.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.667 -0.697 . . . . 2.46 110.691 176.194 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.526 HG23 ' HA ' ' A' ' 22' ' ' HIS . 12.1 t -71.76 -7.34 47.55 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.129 -0.487 . . . . 1.8999999999999999 111.877 -174.33 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 14.1 m-70 -63.9 -40.45 96.52 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.671 -0.492 . . . . 1.4399999999999999 109.671 172.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -84.74 58.51 4.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.713 -0.676 . . . . 3.02 111.054 -177.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.0 p -129.96 172.63 11.51 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.156 -0.475 . . . . 4.8499999999999996 109.763 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -82.32 37.27 0.5 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.235 0.541 . . . . 7.3600000000000003 110.735 -177.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.0 pttp . . . . . 0 C--O 1.246 0.895 0 CA-C-O 118.071 -0.966 . . . . 9.6199999999999992 110.169 178.352 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.7 ttp . . . . . 0 N--CA 1.482 1.145 0 CA-C-O 120.61 0.243 . . . . 5.8300000000000001 110.641 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 57.0 mtpt -129.4 115.18 18.39 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 109.962 -0.384 . . . . 4.7999999999999998 109.962 -179.774 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.561 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 11.3 Cg_endo -91.01 133.72 1.66 Allowed 'Trans proline' 0 N--CA 1.448 -1.189 0 C-N-CA 123.618 2.879 . . . . 1.74 112.262 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.562 ' CE2' ' HG3' ' A' ' 16' ' ' PRO . 90.8 m-85 -110.64 127.02 55.09 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.208 -0.906 . . . . 1.3600000000000001 109.618 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.749 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 0.0 OUTLIER -88.2 149.94 23.58 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.303 0.573 . . . . 2.7000000000000002 112.234 -170.783 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.992 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 48.6 t -95.03 125.29 39.59 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.631 -0.713 . . . . 0.45000000000000001 109.595 175.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -63.79 -21.61 66.51 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.325 0.491 . . . . 2.46 112.325 -173.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -95.59 -27.88 15.12 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.967 0.889 . . . . 1.25 108.964 -176.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.729 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 6.8 m -95.75 -40.46 9.35 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.224 -1.353 . . . . 0.66000000000000003 112.821 -170.467 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.57 10.41 85.87 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.404 -0.903 . . . . 0.53000000000000003 110.907 -171.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -105.44 132.97 50.94 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.686 -0.487 . . . . 3.8100000000000001 109.686 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.749 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 19.6 m -96.5 120.12 36.24 Favored 'General case' 0 C--N 1.32 -0.71 0 O-C-N 123.428 0.455 . . . . 1.6299999999999999 110.485 179.666 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.992 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 24.7 m-85 -95.32 126.95 40.98 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.273 -0.64 . . . . 0.70999999999999996 109.273 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.561 ' HA ' ' HA ' ' A' ' 3' ' ' PRO . 28.6 t -77.41 9.95 2.88 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.971 -0.558 . . . . 2.0899999999999999 111.525 -173.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.413 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 5.0 m-20 -135.31 120.15 13.61 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-O 121.041 0.448 . . . . 1.9199999999999999 110.153 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.562 ' HG3' ' CE2' ' A' ' 4' ' ' TYR . 31.7 Cg_exo -57.2 -53.2 5.14 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 123.574 2.849 . . . . 0.85999999999999999 112.592 -176.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.1 m -55.42 -46.74 76.63 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.354 -0.385 . . . . 1.76 111.742 -177.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.0 p -84.41 -16.63 42.01 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 120.538 -0.465 . . . . 1.51 111.704 -175.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.879 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 10.7 tmtt? -77.63 -23.26 49.8 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 108.611 -0.885 . . . . 1.8300000000000001 108.611 170.041 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.553 ' HG2' ' O ' ' A' ' 16' ' ' PRO . 77.4 mmm -83.58 -52.57 6.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.343 -0.844 . . . . 2.1899999999999999 110.265 -175.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 92.9 mtt-85 -59.83 -30.84 69.22 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.282 0.563 . . . . 4.7699999999999996 110.042 176.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.408 ' O ' ' HD2' ' A' ' 26' ' ' HIS . 38.5 t60 -68.58 -41.91 79.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.432 -0.804 . . . . 0.55000000000000004 110.596 178.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.453 HD23 ' HA ' ' A' ' 6' ' ' CYS . 2.1 mm? -65.54 -38.98 91.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.937 0.398 . . . . 2.0899999999999999 110.192 176.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 20' ' ' MET . 39.0 mm-40 -62.89 -34.3 77.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.656 -0.702 . . . . 2.46 111.166 177.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.4 p -84.51 -0.43 53.04 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.261 0.467 . . . . 1.8999999999999999 112.261 -176.146 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.408 ' HD2' ' O ' ' A' ' 22' ' ' HIS . 17.7 m-70 -80.5 -25.24 38.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.542 0.687 . . . . 1.4399999999999999 109.148 168.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -89.92 80.58 6.41 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.636 -0.875 . . . . 3.02 108.636 172.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.5 m -101.01 -65.97 0.94 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.888 -0.596 . . . . 4.8499999999999996 111.381 -172.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -109.47 -63.18 1.39 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.457 0.646 . . . . 7.3600000000000003 110.069 -173.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 40.8 pttt . . . . . 0 C--O 1.245 0.849 0 CA-C-N 115.089 -0.959 . . . . 9.6199999999999992 110.111 179.396 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 pmm? . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 120.63 0.252 . . . . 5.8300000000000001 110.687 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.442 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 23.3 tptm -125.87 110.51 24.9 Favored Pre-proline 0 C--N 1.327 -0.4 0 N-CA-C 110.114 -0.328 . . . . 4.7999999999999998 110.114 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 2.1 Cg_endo -86.07 -179.83 3.38 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.359 2.706 . . . . 1.74 112.504 -179.032 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -116.88 105.6 12.53 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.413 -0.812 . . . . 1.3600000000000001 109.576 178.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.526 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 43.6 mt-30 -77.11 157.55 30.96 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.522 -0.308 . . . . 2.7000000000000002 110.381 -177.404 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.769 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 45.3 t -88.39 127.68 35.5 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 108.535 -0.913 . . . . 0.45000000000000001 108.535 175.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -67.01 -13.23 61.71 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.988 0.736 . . . . 2.46 112.988 -168.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -103.36 -30.28 10.7 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.884 0.85 . . . . 1.25 108.775 177.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.766 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 63.4 m -95.21 -40.37 9.61 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.544 -1.207 . . . . 0.66000000000000003 113.721 -166.664 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.76 -3.65 86.86 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.622 -0.799 . . . . 0.53000000000000003 112.116 -176.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.462 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 68.5 ttt180 -76.38 134.35 39.67 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.671 -0.492 . . . . 3.8100000000000001 109.671 176.505 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.526 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 50.2 p -90.96 110.0 21.24 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.051 0.453 . . . . 1.6299999999999999 110.6 -179.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.769 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 69.9 m-85 -88.91 124.76 34.53 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.56 -0.904 . . . . 0.70999999999999996 108.56 174.364 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.0 m -69.43 -6.45 30.29 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.718 -0.674 . . . . 2.0899999999999999 111.02 -176.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -135.7 124.34 15.66 Favored Pre-proline 0 CA--C 1.516 -0.336 0 CA-C-O 120.804 0.335 . . . . 1.9199999999999999 110.539 -173.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.62 ' O ' ' HB2' ' A' ' 20' ' ' MET . 38.0 Cg_endo -67.4 -23.05 44.62 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.599 2.199 . . . . 0.85999999999999999 111.425 177.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.8 m -67.53 -54.5 19.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.407 -0.815 . . . . 1.76 110.917 179.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.8 p -80.78 -28.96 36.18 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.541 -0.3 . . . . 1.51 111.272 -176.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.689 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 0.3 OUTLIER -65.47 -19.59 66.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.188 0.518 . . . . 1.8300000000000001 109.898 172.668 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.62 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -84.12 -53.85 5.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.902 -0.59 . . . . 2.1899999999999999 109.456 -177.355 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.475 ' HA ' ' OE1' ' A' ' 24' ' ' GLU . 60.2 ttt180 -57.24 -34.06 68.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.1 -0.5 . . . . 4.7699999999999996 109.9 174.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -55.94 -47.49 77.46 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.896 -0.593 . . . . 0.55000000000000004 110.684 174.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.35 -29.3 68.81 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.277 -0.42 . . . . 2.0899999999999999 110.678 -179.202 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.475 ' OE1' ' HA ' ' A' ' 21' ' ' ARG . 47.5 mt-10 -68.84 -56.91 6.47 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.176 0.512 . . . . 2.46 111.011 174.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.2 t -78.76 3.62 16.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.908 -0.587 . . . . 1.8999999999999999 111.739 -174.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -66.21 4.11 0.76 Allowed 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 113.326 0.862 . . . . 1.4399999999999999 113.326 -171.571 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.4 t70 64.53 39.05 6.99 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.623 0.725 . . . . 3.02 109.687 -179.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.45 119.25 21.5 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.373 -0.83 . . . . 4.8499999999999996 110.778 -178.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -85.94 9.14 17.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.635 -0.711 . . . . 7.3600000000000003 111.378 -173.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.7 mttm . . . . . 0 C--O 1.246 0.907 0 CA-C-O 118.906 -0.569 . . . . 9.6199999999999992 110.349 -178.734 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.425 ' CZ ' ' HG3' ' A' ' 16' ' ' PRO . 59.0 m-85 . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 121.53 0.681 . . . . 1.0600000000000001 109.332 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.424 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 18.2 pt20 -85.92 154.64 21.36 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.075 -0.966 . . . . 2.3100000000000001 111.401 -175.121 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.765 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 51.6 t -93.08 130.86 38.55 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.185 -0.462 . . . . 0.45000000000000001 110.297 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -61.95 -22.9 66.02 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.723 -0.671 . . . . 2.46 112.69 -173.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -103.69 -23.69 13.42 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.595 0.712 . . . . 1.01 109.462 -174.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.765 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 47.3 m -98.58 -28.86 13.38 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.648 -1.16 . . . . 0.66000000000000003 112.358 -171.238 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.97 3.92 57.39 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.747 -0.74 . . . . 0.53000000000000003 111.796 -175.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.424 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 5.0 tpm_? -90.09 128.35 36.29 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 109.716 -0.476 . . . . 3.1899999999999999 109.716 -177.22 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 3.4 p -85.87 116.83 24.35 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.482 -0.781 . . . . 1.23 110.574 179.193 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.725 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 49.9 m-85 -96.57 127.86 42.96 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.719 -0.845 . . . . 0.46999999999999997 108.719 173.103 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.2 m -82.69 5.58 20.8 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.032 0.444 . . . . 1.51 110.737 -178.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 3.4 t70 -138.15 122.84 12.0 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 115.79 -0.641 . . . . 1.9199999999999999 110.31 -177.408 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.539 ' O ' ' HB2' ' A' ' 20' ' ' MET . 19.7 Cg_exo -65.42 -24.71 56.75 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 123.169 2.579 . . . . 0.5 112.424 -178.033 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -68.67 -54.85 13.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.219 -0.446 . . . . 1.1200000000000001 110.926 -177.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.3 p -73.2 -31.0 63.93 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.391 -0.368 . . . . 1.1699999999999999 111.152 -179.575 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.655 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 1.5 tmtm? -65.8 -19.34 65.85 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.457 -0.572 . . . . 1.21 109.457 172.571 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.539 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 11.7 tpt -86.79 -53.59 4.84 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.335 -0.617 . . . . 1.6899999999999999 109.335 -177.314 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.497 HH21 ' CD ' ' A' ' 24' ' ' GLU . 2.8 mmp_? -54.47 -44.75 72.86 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.568 -0.742 . . . . 4.1500000000000004 110.365 175.701 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 56.0 t60 -62.14 -34.57 76.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.078 -0.51 . . . . 0.42999999999999999 111.187 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -79.5 -33.5 42.07 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.992 -0.283 . . . . 1.47 111.704 -177.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.497 ' CD ' HH21 ' A' ' 21' ' ' ARG . 16.5 pt-20 -85.41 -32.59 22.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.734 0.302 . . . . 2.46 111.163 -178.619 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 32.9 m -84.64 -3.68 58.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.363 0.601 . . . . 1.3 110.45 177.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.225 0 N-CA-C 109.028 -0.73 . . . . 0.97999999999999998 109.028 169.094 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 . . . . . 0 N--CA 1.451 -0.421 0 N-CA-C 109.238 -0.653 . . . . 1.0600000000000001 109.238 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.501 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 16.5 pt20 -72.16 159.93 33.29 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.515 -0.766 . . . . 2.3100000000000001 110.827 -177.498 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.971 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 8.6 t -83.11 128.61 34.63 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.238 -1.023 . . . . 0.45000000000000001 108.238 178.176 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ASP . . . . . 0.47 ' H ' HD11 ' A' ' 23' ' ' LEU . 12.6 m-20 -66.34 -6.29 13.67 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 112.856 0.688 . . . . 2.46 112.856 -171.592 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -111.72 -13.71 13.7 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.314 0.578 . . . . 1.01 109.982 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.867 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 74.9 m -119.31 -36.56 3.34 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.638 -0.71 . . . . 0.66000000000000003 112.868 -163.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.9 -16.01 39.7 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.432 -0.89 . . . . 0.53000000000000003 112.009 -176.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.501 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 72.6 ttt180 -62.69 135.4 57.35 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.936 -0.394 . . . . 3.1899999999999999 109.936 177.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 p -89.44 113.06 24.35 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.212 0.529 . . . . 1.23 111.994 -174.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.971 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 69.4 m-85 -99.26 131.28 45.39 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.582 -0.895 . . . . 0.46999999999999997 108.582 172.261 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.5 m -79.67 4.33 16.43 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.386 -0.37 . . . . 1.51 110.543 -176.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -131.3 115.83 16.35 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.448 -0.342 . . . . 1.9199999999999999 110.72 -174.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -61.8 -34.92 81.56 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 123.028 2.486 . . . . 0.5 112.069 -178.378 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.9 p -70.9 -45.79 63.69 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.195 0.521 . . . . 1.1200000000000001 110.474 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.4 m -71.65 -36.72 70.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.059 -0.519 . . . . 1.1699999999999999 111.064 -177.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.724 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 0.2 OUTLIER -65.95 -19.42 65.86 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.82 -0.437 . . . . 1.21 109.82 174.105 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 13.7 tpt -90.6 -46.34 8.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.872 -0.604 . . . . 1.6899999999999999 110.488 -174.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.8 mmm180 -64.05 -36.11 82.92 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.663 -0.495 . . . . 4.1500000000000004 109.663 176.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 44.0 t60 -70.18 -35.52 74.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.896 -0.593 . . . . 0.42999999999999999 110.372 176.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.542 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 5.2 tp -57.87 -58.59 7.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.578 -0.737 . . . . 1.47 110.72 -178.174 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -64.14 -33.49 75.91 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.474 -0.785 . . . . 2.46 111.703 -176.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 25.9 m -74.15 -5.35 41.26 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.882 0.372 . . . . 1.3 111.416 -176.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 13.6 m-70 . . . . . 0 N--CA 1.463 0.195 0 CA-C-O 120.865 0.364 . . . . 0.97999999999999998 110.345 173.285 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 . . . . . 0 N--CA 1.45 -0.458 0 CA-C-O 121.045 0.45 . . . . 1.0600000000000001 110.805 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.601 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 8.6 tt0 -73.92 142.29 45.94 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.42 -0.809 . . . . 2.3100000000000001 111.508 -176.166 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.973 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 8.4 t -77.0 122.13 24.48 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 108.341 -0.985 . . . . 0.45000000000000001 108.341 174.33 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -64.47 -8.15 12.59 Favored 'General case' 0 C--N 1.319 -0.744 0 O-C-N 123.802 0.689 . . . . 2.46 112.732 -170.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -111.58 -21.74 11.59 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 121.135 0.493 . . . . 1.01 110.051 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.558 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 63.4 m -114.48 -29.76 6.75 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.312 0.856 . . . . 0.66000000000000003 113.312 -163.071 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.6 -8.66 78.56 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.417 -0.897 . . . . 0.53000000000000003 112.772 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -78.86 135.65 37.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.726 0.263 . . . . 3.1899999999999999 110.719 177.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.601 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 36.9 m -99.59 116.31 31.43 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.855 0.359 . . . . 1.23 110.803 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.973 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 42.3 m-85 -94.62 128.74 41.47 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.29 -0.633 . . . . 0.46999999999999997 109.29 177.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.1 t -84.16 17.4 2.51 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.62 0.724 . . . . 1.51 110.14 -178.586 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.419 ' HA ' ' HD2' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -125.78 102.79 28.3 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 115.47 -0.786 . . . . 1.9199999999999999 109.78 177.584 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.53 ' O ' ' HB2' ' A' ' 20' ' ' MET . 12.0 Cg_endo -55.35 -38.41 93.85 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 123.496 2.798 . . . . 0.5 112.452 -176.64 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.5 m -74.97 -36.02 62.05 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.136 -0.483 . . . . 1.1200000000000001 110.918 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.5 t -76.98 -41.9 41.13 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 120.99 -0.284 . . . . 1.1699999999999999 110.385 -176.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.851 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 2.7 tmtm? -63.79 -18.01 63.66 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.415 0.626 . . . . 1.21 109.828 175.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.53 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 0.2 OUTLIER -84.19 -53.56 5.42 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.472 -0.785 . . . . 1.6899999999999999 109.484 -175.286 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 53.2 mtp180 -70.13 -20.53 63.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.918 -0.583 . . . . 4.1500000000000004 110.444 175.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.428 ' CD2' ' SG ' ' A' ' 6' ' ' CYS . 63.1 t60 -66.89 -42.94 84.68 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.033 -0.531 . . . . 0.42999999999999999 109.641 173.306 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.1 -38.08 89.77 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.257 0.551 . . . . 1.47 109.696 174.799 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -60.64 -41.27 94.61 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.099 -0.955 . . . . 2.46 111.207 177.501 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.0 p -84.37 0.41 49.43 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.545 0.572 . . . . 1.3 112.545 -174.635 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.8 m-70 . . . . . 0 C--N 1.33 -0.277 0 CA-C-O 121.029 0.442 . . . . 0.97999999999999998 110.472 173.825 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.669 ' HB3' ' HD2' ' A' ' 19' ' ' LYS . 80.8 m-85 . . . . . 0 N--CA 1.455 -0.19 0 CA-C-O 121.299 0.571 . . . . 1.0600000000000001 110.575 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.799 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 36.6 tt0 -76.53 139.4 40.72 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.467 -0.788 . . . . 2.3100000000000001 110.792 -176.318 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 1.029 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 50.0 t -80.44 119.6 23.34 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.923 -0.769 . . . . 0.45000000000000001 108.923 176.516 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -64.12 -6.3 6.28 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.755 1.02 . . . . 2.46 113.755 -170.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -109.09 -33.39 6.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.946 0.879 . . . . 1.01 109.075 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.795 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 7.0 m -85.96 -40.32 15.98 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.388 -1.278 . . . . 0.66000000000000003 112.162 -170.438 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.75 -1.5 88.05 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 110.714 -0.954 . . . . 0.53000000000000003 110.714 -169.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.1 tpt180 -89.5 129.23 36.02 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.067 -0.716 . . . . 3.1899999999999999 109.067 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.799 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 0.8 OUTLIER -98.57 118.0 34.29 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 120.932 0.396 . . . . 1.23 110.665 -175.903 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 1.029 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 24.8 m-85 -97.53 129.22 44.7 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.091 -0.707 . . . . 0.46999999999999997 109.091 178.725 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 59.1 m -78.26 4.46 12.71 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.53 -0.305 . . . . 1.51 111.467 -177.003 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.509 ' HB3' ' HB3' ' A' ' 18' ' ' SER . 11.7 t70 -120.06 113.63 34.09 Favored Pre-proline 0 C--N 1.33 -0.281 0 C-N-CA 120.947 -0.301 . . . . 1.9199999999999999 110.505 -178.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.516 ' O ' ' HB2' ' A' ' 20' ' ' MET . 28.1 Cg_endo -62.51 -32.77 80.07 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 123.201 2.601 . . . . 0.5 113.035 -176.058 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 35.8 m -80.46 -45.08 18.18 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.099 0.476 . . . . 1.1200000000000001 110.652 -178.289 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.509 ' HB3' ' HB3' ' A' ' 15' ' ' ASP . 40.9 t -70.17 -37.14 75.1 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.002 -0.544 . . . . 1.1699999999999999 110.905 -178.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.886 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 6.8 tmtt? -67.15 -18.86 65.47 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.115 0.483 . . . . 1.21 109.835 174.351 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.516 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 10.6 tpt -86.86 -43.9 12.11 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.375 -0.602 . . . . 1.6899999999999999 109.375 -174.811 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.0 ttt85 -63.33 -38.37 90.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.601 -0.727 . . . . 4.1500000000000004 109.378 174.079 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -63.34 -38.63 91.89 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.301 -0.863 . . . . 0.42999999999999999 110.81 177.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.03 -36.69 84.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.998 0.428 . . . . 1.47 110.433 176.695 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -70.37 -29.46 66.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.195 0.522 . . . . 2.46 110.498 175.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.0 m -66.53 -27.18 67.56 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.673 -0.694 . . . . 1.3 110.592 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 . . . . . 0 N--CA 1.464 0.255 0 CA-C-N 116.057 -0.52 . . . . 0.97999999999999998 112.004 -179.336 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.596 ' HB3' ' HE2' ' A' ' 19' ' ' LYS . 64.9 m-85 . . . . . 0 C--O 1.222 -0.394 0 N-CA-C 108.522 -0.918 . . . . 1.0600000000000001 108.522 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.426 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 9.3 pt20 -116.32 161.1 19.54 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.91 -0.316 . . . . 2.3100000000000001 111.138 -177.661 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.898 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 43.5 t -88.22 121.18 30.32 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.659 -1.237 . . . . 0.45000000000000001 107.659 172.088 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -65.45 -1.65 2.68 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 113.649 0.981 . . . . 2.46 113.649 -171.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -108.53 -24.14 11.53 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.491 0.662 . . . . 1.01 109.339 174.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.77 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 92.9 m -110.22 -35.15 6.17 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.0 -1.0 . . . . 0.66000000000000003 113.069 -166.112 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.0 -11.44 57.31 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.899 -0.667 . . . . 0.53000000000000003 112.191 -175.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.426 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 9.8 ttp180 -70.07 141.77 52.76 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 110.353 -0.24 . . . . 3.1899999999999999 110.353 -178.697 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.535 ' HA ' ' O ' ' A' ' 4' ' ' TYR . 31.9 m -90.06 113.62 25.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.122 0.487 . . . . 1.23 111.811 -176.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.898 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 46.1 m-85 -101.29 119.46 38.79 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.099 -1.074 . . . . 0.46999999999999997 108.099 170.498 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.0 p -87.12 21.5 2.34 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.374 0.607 . . . . 1.51 110.41 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -137.36 96.85 10.85 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 115.202 -0.908 . . . . 1.9199999999999999 110.002 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -57.03 -43.39 54.31 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.657 2.905 . . . . 0.5 113.863 -172.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.4 ' O ' ' HB3' ' A' ' 20' ' ' MET . 9.0 t -62.18 -44.35 96.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.261 0.553 . . . . 1.1200000000000001 111.682 -176.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.09 -28.93 39.0 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.284 -0.416 . . . . 1.1699999999999999 111.297 -179.128 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.596 ' HE2' ' HB3' ' A' ' 4' ' ' TYR . 7.9 tttp -65.84 -20.25 66.17 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.411 -0.589 . . . . 1.21 109.411 168.629 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.4 ' HB3' ' O ' ' A' ' 17' ' ' THR . 1.1 tmt? -82.46 -50.25 9.06 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 109.087 -0.708 . . . . 1.6899999999999999 109.087 -177.512 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.7 mmm180 -64.66 -29.58 70.58 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.712 -0.676 . . . . 4.1500000000000004 110.081 175.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -64.32 -40.54 96.11 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.734 -0.667 . . . . 0.42999999999999999 110.371 175.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -68.16 -31.53 71.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.011 0.434 . . . . 1.47 110.535 177.102 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -65.48 -50.64 64.57 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.065 -0.516 . . . . 2.46 110.994 176.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 17.2 p -76.6 -5.38 47.49 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.549 0.574 . . . . 1.3 112.549 -174.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 . . . . . 0 C--N 1.332 -0.194 0 N-CA-C 109.879 -0.415 . . . . 0.97999999999999998 109.879 173.164 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 . . . . . 0 N--CA 1.454 -0.238 0 CA-C-O 121.214 0.53 . . . . 1.0600000000000001 110.462 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -82.83 141.16 32.49 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.637 -0.711 . . . . 2.3100000000000001 111.939 -172.167 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.96 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 22.5 t -77.45 133.21 38.67 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.355 -0.98 . . . . 0.45000000000000001 108.355 176.509 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -55.6 -27.65 50.71 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.986 0.736 . . . . 2.46 112.986 -168.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -111.25 -9.27 14.31 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.241 -0.584 . . . . 1.01 110.753 -175.08 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.882 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 94.9 m -111.32 -37.95 5.13 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 113.929 1.085 . . . . 0.66000000000000003 113.929 -165.212 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.02 -20.15 30.57 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 119.959 -1.115 . . . . 0.53000000000000003 111.879 -174.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.6 ttt180 -64.49 137.2 57.74 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.828 0.347 . . . . 3.1899999999999999 110.411 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 11.2 m -95.28 112.16 23.91 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.653 -0.703 . . . . 1.23 111.2 -176.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.96 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 60.8 m-85 -97.17 122.8 40.6 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.752 -0.833 . . . . 0.46999999999999997 108.752 174.461 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.6 m -81.96 10.58 6.25 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.129 0.49 . . . . 1.51 110.851 -176.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -133.31 108.48 12.36 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.93 -0.577 . . . . 1.9199999999999999 109.816 178.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.435 ' O ' ' HB2' ' A' ' 20' ' ' MET . 35.4 Cg_endo -65.05 -26.43 58.14 Favored 'Trans proline' 0 CA--C 1.527 0.163 0 C-N-CA 123.004 2.469 . . . . 0.5 113.106 -174.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 16.7 m -76.84 -45.89 26.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.848 0.356 . . . . 1.1200000000000001 111.238 -176.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.0 p -77.51 -31.08 53.29 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.701 -0.399 . . . . 1.1699999999999999 110.941 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 19.9 tttm -66.18 -19.22 65.77 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 121.216 0.532 . . . . 1.21 109.645 171.44 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.435 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 43.5 tpp -78.41 -49.96 12.58 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.309 -0.626 . . . . 1.6899999999999999 109.309 -177.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.3 mmt85 -63.92 -33.53 75.92 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.704 -0.68 . . . . 4.1500000000000004 109.93 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 79.2 t60 -62.01 -43.68 98.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.732 -0.667 . . . . 0.42999999999999999 110.445 175.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.99 -40.95 90.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.17 0.51 . . . . 1.47 109.771 177.845 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.86 -35.02 79.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.445 -0.798 . . . . 2.46 111.025 177.172 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 59.9 m -67.07 -25.79 66.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 1.3 111.026 -178.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 57.1 m-70 . . . . . 0 C--N 1.325 -0.484 0 CA-C-O 121.092 0.472 . . . . 0.97999999999999998 110.429 176.498 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.607 ' CE1' ' HG3' ' A' ' 16' ' ' PRO . 75.6 m-85 . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 109.371 -0.603 . . . . 1.0600000000000001 109.371 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.4 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 77.5 mt-30 -83.1 150.94 25.97 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.603 -0.726 . . . . 2.3100000000000001 111.725 -173.535 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.764 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 51.1 t -99.56 111.45 23.79 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 115.428 -0.805 . . . . 0.45000000000000001 108.943 174.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.79 0.49 2.37 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.765 0.654 . . . . 2.46 112.765 -175.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -105.06 -21.24 13.31 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.938 -0.764 . . . . 1.01 108.938 175.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.764 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 4.1 m -103.52 -37.35 7.6 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.632 -1.167 . . . . 0.66000000000000003 111.832 -174.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.39 13.54 83.14 Favored Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 111.178 -0.769 . . . . 0.53000000000000003 111.178 -171.304 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.4 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 48.7 ttt180 -107.17 141.58 38.21 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 110.438 -0.208 . . . . 3.1899999999999999 110.438 -175.609 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.6 m -93.33 115.21 27.78 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 123.382 0.426 . . . . 1.23 110.693 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.614 ' HB2' ' HB2' ' A' ' 19' ' ' LYS . 11.6 m-85 -95.53 133.82 39.1 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.791 -0.818 . . . . 0.46999999999999997 108.791 175.671 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.9 t -90.65 6.08 45.39 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.211 0.529 . . . . 1.51 110.011 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -123.83 106.55 31.68 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.939 -0.573 . . . . 1.9199999999999999 110.101 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.607 ' HG3' ' CE1' ' A' ' 4' ' ' TYR . 38.7 Cg_exo -59.56 -42.95 42.96 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 123.184 2.59 . . . . 0.5 112.817 -175.093 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 59.4 m -69.53 -44.3 71.25 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.003 0.43 . . . . 1.1200000000000001 111.317 -176.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 12.9 m -75.0 -32.61 61.69 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.628 -0.429 . . . . 1.1699999999999999 110.879 -178.258 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 8.7 tmtt? -67.12 -20.58 65.8 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 109.415 -0.587 . . . . 1.21 109.415 173.487 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.422 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 4.1 tmm? -81.08 -53.92 5.99 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.813 -0.81 . . . . 1.6899999999999999 108.813 -175.331 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.2 mmt180 -58.24 -36.11 72.72 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.334 -0.848 . . . . 4.1500000000000004 110.026 174.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -62.6 -43.35 99.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.709 -0.678 . . . . 0.42999999999999999 111.029 177.047 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.1 mp -62.06 -39.53 92.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.905 0.383 . . . . 1.47 110.24 177.551 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -65.21 -28.2 69.21 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.842 -0.617 . . . . 2.46 110.546 177.4 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 20.8 m -72.34 -16.87 61.88 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.902 -0.59 . . . . 1.3 110.512 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 34.8 m-70 . . . . . 0 C--O 1.235 0.309 0 CA-C-O 121.096 0.474 . . . . 0.97999999999999998 110.171 175.036 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.484 ' HB2' ' HD3' ' A' ' 19' ' ' LYS . 83.0 m-85 . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 109.687 -0.486 . . . . 1.0600000000000001 109.687 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.501 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 73.7 mt-30 -82.53 137.09 34.7 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.474 0.654 . . . . 2.3100000000000001 112.241 -170.738 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.942 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 52.6 t -76.66 123.47 26.19 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.475 -0.784 . . . . 0.45000000000000001 108.964 176.086 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -63.17 -12.68 29.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.024 0.75 . . . . 2.46 113.024 -171.474 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -107.56 -23.69 12.06 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.657 0.741 . . . . 1.01 109.549 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.791 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 11.8 m -98.16 -41.49 7.88 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.83 -1.077 . . . . 0.66000000000000003 112.958 -172.474 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.31 -10.0 65.3 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 111.017 -0.833 . . . . 0.53000000000000003 111.017 -167.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -79.14 134.43 36.71 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 122.838 0.455 . . . . 3.1899999999999999 110.19 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.501 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 47.3 p -95.21 122.93 38.41 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.126 -0.488 . . . . 1.23 111.372 -177.608 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.942 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 19.3 m-85 -104.04 124.03 48.29 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.463 -0.94 . . . . 0.46999999999999997 108.463 173.858 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.0 m -80.49 13.36 2.51 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.113 0.482 . . . . 1.51 111.03 -175.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -136.18 115.53 10.99 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.158 -0.474 . . . . 1.9199999999999999 110.154 -179.113 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.606 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 48.0 Cg_exo -56.62 -40.19 86.15 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.464 2.776 . . . . 0.5 112.673 -177.673 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 m -73.08 -40.25 65.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.94 0.4 . . . . 1.1200000000000001 111.19 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.3 m -73.76 -32.37 63.78 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.085 0.469 . . . . 1.1699999999999999 110.425 -178.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.781 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 15.0 ttpp -69.59 -18.89 63.65 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.688 -0.687 . . . . 1.21 109.683 171.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 43.1 ttm -87.45 -47.95 8.35 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.835 -0.62 . . . . 1.6899999999999999 110.57 -173.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -59.25 -38.94 81.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.347 0.594 . . . . 4.1500000000000004 109.568 172.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -60.04 -48.48 81.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.19 -0.913 . . . . 0.42999999999999999 110.897 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.461 HD23 ' O ' ' A' ' 19' ' ' LYS . 2.7 mm? -64.34 -34.19 77.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.918 0.39 . . . . 1.47 111.006 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -66.76 -21.07 66.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.197 0.523 . . . . 2.46 110.887 178.152 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.1 m -98.07 0.25 45.8 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.38 0.609 . . . . 1.3 110.71 -178.014 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 . . . . . 0 C--O 1.235 0.294 0 CA-C-N 116.429 -0.351 . . . . 0.97999999999999998 111.775 -178.692 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 . . . . . 0 N--CA 1.448 -0.572 0 CA-C-O 121.116 0.484 . . . . 1.0600000000000001 110.062 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.564 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 0.5 OUTLIER -77.65 152.81 33.63 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.726 -0.67 . . . . 2.3100000000000001 110.335 -179.815 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.991 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 21.5 t -84.13 129.41 34.9 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.201 -1.037 . . . . 0.45000000000000001 108.201 177.309 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ASP . . . . . 0.422 ' OD1' HD21 ' A' ' 23' ' ' LEU . 2.3 m-20 -54.98 -23.05 17.34 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 113.431 0.9 . . . . 2.46 113.431 -169.002 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -111.07 -16.58 13.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.361 0.6 . . . . 1.01 110.093 -178.164 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.911 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 83.6 m -105.89 -33.53 7.93 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.459 -0.792 . . . . 0.66000000000000003 112.931 -167.478 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.33 -10.59 35.03 Favored Glycine 0 CA--C 1.517 0.202 0 C-N-CA 120.795 -0.717 . . . . 0.53000000000000003 112.104 -176.586 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.564 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 30.4 ttm180 -63.46 135.9 57.23 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 122.616 0.367 . . . . 3.1899999999999999 110.416 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.2 m -89.94 103.67 16.31 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 123.369 0.418 . . . . 1.23 111.043 -176.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.991 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 61.8 m-85 -91.43 119.4 31.38 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.334 -0.987 . . . . 0.46999999999999997 108.334 173.563 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.7 p -77.32 12.62 1.44 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.076 -0.511 . . . . 1.51 111.333 -175.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.554 ' HB2' ' HB2' ' A' ' 18' ' ' SER . 8.5 m-20 -131.32 114.94 16.08 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 116.199 -0.455 . . . . 1.9199999999999999 109.946 -176.367 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -57.57 -46.34 27.89 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 123.329 2.686 . . . . 0.5 112.523 -178.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 57.6 m -70.32 -35.92 73.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.746 0.308 . . . . 1.1200000000000001 110.995 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.554 ' HB2' ' HB2' ' A' ' 15' ' ' ASP . 6.3 m -75.8 -35.52 60.03 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.785 -0.366 . . . . 1.1699999999999999 111.324 -176.643 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.788 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 1.6 tmtm? -67.26 -18.41 65.2 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.207 -0.664 . . . . 1.21 109.207 173.153 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 11.5 tpt -88.43 -48.65 7.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.206 -0.906 . . . . 1.6899999999999999 109.962 -179.033 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.2 ttp180 -57.84 -41.22 81.88 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-O 121.509 0.671 . . . . 4.1500000000000004 109.325 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 75.2 t60 -61.73 -38.39 87.73 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.163 -0.926 . . . . 0.42999999999999999 111.227 178.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.422 HD21 ' OD1' ' A' ' 7' ' ' ASP . 1.2 mp -62.53 -43.57 98.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.929 0.395 . . . . 1.47 110.394 177.766 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -63.67 -32.45 73.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.779 -0.646 . . . . 2.46 110.353 176.359 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 24.1 m -74.46 -14.87 60.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.871 -0.604 . . . . 1.3 111.32 -177.284 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 . . . . . 0 CA--C 1.521 -0.166 0 CA-C-O 120.749 0.309 . . . . 0.97999999999999998 111.33 177.37 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 . . . . . 0 N--CA 1.452 -0.336 0 N-CA-C 109.863 -0.421 . . . . 1.0600000000000001 109.863 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.499 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 60.6 mt-30 -84.35 148.31 26.7 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.087 0.47 . . . . 2.3100000000000001 112.09 -170.201 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 1.004 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 42.8 t -81.49 123.11 28.33 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.23 -1.026 . . . . 0.45000000000000001 108.23 176.246 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -64.21 -9.53 17.69 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.744 0.646 . . . . 2.46 112.744 -171.025 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.475 ' HE2' ' HG ' ' A' ' 23' ' ' LEU . 1.2 m-85 -106.88 -17.07 14.3 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 109.205 -0.665 . . . . 1.01 109.205 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.797 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 71.6 m -115.47 -40.5 3.4 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 113.649 0.981 . . . . 0.66000000000000003 113.649 -168.406 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.59 -13.13 64.87 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.558 -0.829 . . . . 0.53000000000000003 111.77 -174.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 64.8 ttt180 -69.58 137.0 52.0 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.94 -0.393 . . . . 3.1899999999999999 109.94 177.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.485 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 8.8 m -98.19 112.15 24.23 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.168 -0.469 . . . . 1.23 111.178 -175.43 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 1.004 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 50.1 m-85 -95.92 123.94 39.72 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.394 -0.595 . . . . 0.46999999999999997 109.394 176.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.6 t -80.88 10.25 5.29 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.932 0.396 . . . . 1.51 110.508 -176.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.684 ' HB2' ' OG ' ' A' ' 18' ' ' SER . 8.0 m-20 -130.64 110.05 16.01 Favored Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 109.546 -0.539 . . . . 1.9199999999999999 109.546 -177.841 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.482 ' O ' ' HB2' ' A' ' 20' ' ' MET . 31.2 Cg_exo -59.39 -32.85 97.25 Favored 'Trans proline' 0 C--O 1.225 -0.14 0 C-N-CA 122.731 2.287 . . . . 0.5 112.018 179.538 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.0 p -70.54 -43.08 70.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.84 -0.618 . . . . 1.1200000000000001 111.806 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.684 ' OG ' ' HB2' ' A' ' 15' ' ' ASP . 81.1 p -77.33 -38.48 50.31 Favored 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 120.53 -0.468 . . . . 1.1699999999999999 110.391 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.576 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 23.8 tttm -63.46 -18.81 64.15 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-O 121.067 0.461 . . . . 1.21 110.007 173.72 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.482 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 14.7 tpt -80.85 -54.26 5.75 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.5 -0.556 . . . . 1.6899999999999999 109.5 -177.277 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 21' ' ' ARG . 52.9 mtm180 -69.49 -20.75 63.73 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.167 0.508 . . . . 4.1500000000000004 110.287 176.707 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 78.4 t60 -71.75 -43.13 66.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.07 -0.514 . . . . 0.42999999999999999 110.541 174.185 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.475 ' HG ' ' HE2' ' A' ' 8' ' ' TYR . 1.4 mp -63.16 -32.07 73.36 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.777 -0.453 . . . . 1.47 109.777 176.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -67.53 -29.93 69.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.732 -0.667 . . . . 2.46 110.828 172.674 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 54.4 m -69.81 -24.49 63.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.08 0.467 . . . . 1.3 110.65 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 . . . . . 0 C--O 1.235 0.325 0 CA-C-N 116.346 -0.388 . . . . 0.97999999999999998 110.331 177.31 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.672 ' HB3' ' CD ' ' A' ' 19' ' ' LYS . 77.4 m-85 . . . . . 0 N--CA 1.452 -0.357 0 CA-C-O 121.096 0.474 . . . . 1.0600000000000001 111.398 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.464 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 92.4 mt-30 -86.83 160.22 18.83 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.852 -0.613 . . . . 2.3100000000000001 111.318 -176.426 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.993 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 35.9 t -90.1 119.95 30.87 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 107.898 -1.149 . . . . 0.45000000000000001 107.898 174.356 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -69.32 0.07 5.53 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.722 0.638 . . . . 2.46 112.722 -171.615 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.4 m-30 -103.51 -23.77 13.48 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.951 -0.759 . . . . 1.01 108.951 173.535 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.789 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 88.4 m -114.0 -40.41 3.74 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.876 -1.056 . . . . 0.66000000000000003 113.549 -164.459 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.88 -15.54 61.52 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.769 -0.729 . . . . 0.53000000000000003 112.017 -174.389 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.464 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 61.1 ttt180 -67.42 138.7 56.86 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.184 0.193 . . . . 3.1899999999999999 110.578 -179.489 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.6 m -94.62 122.64 37.43 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.419 -0.355 . . . . 1.23 110.936 -177.487 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.993 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 84.0 m-85 -101.64 139.63 37.03 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.821 -0.627 . . . . 0.46999999999999997 109.432 176.031 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.7 p -80.79 2.54 25.85 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.621 -0.718 . . . . 1.51 110.828 -176.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.857 ' HB2' ' HB3' ' A' ' 18' ' ' SER . 8.4 m-20 -134.24 118.02 13.77 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.336 -0.393 . . . . 1.9199999999999999 110.216 -174.388 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.466 ' O ' ' HG3' ' A' ' 20' ' ' MET . 18.5 Cg_endo -60.6 -40.82 52.71 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 123.051 2.5 . . . . 0.5 112.605 -178.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 88.7 m -80.51 -31.12 37.21 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.698 0.285 . . . . 1.1200000000000001 110.732 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.857 ' HB3' ' HB2' ' A' ' 15' ' ' ASP . 25.7 t -74.49 -37.5 63.13 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 120.661 -0.416 . . . . 1.1699999999999999 109.906 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.672 ' CD ' ' HB3' ' A' ' 4' ' ' TYR . 8.8 tttp -57.8 -28.64 64.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.077 -0.511 . . . . 1.21 109.686 170.144 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.47 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 61.2 mtp -84.44 -45.69 12.44 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 116.046 -0.525 . . . . 1.6899999999999999 110.335 -173.73 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -62.93 -31.68 72.82 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.54 -0.754 . . . . 4.1500000000000004 109.636 174.439 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 67.5 t60 -63.05 -46.36 87.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.491 -0.777 . . . . 0.42999999999999999 110.626 173.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.458 HD23 ' O ' ' A' ' 19' ' ' LYS . 2.3 mm? -59.27 -38.82 81.04 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.475 -0.33 . . . . 1.47 110.665 178.276 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 20' ' ' MET . 48.4 mt-10 -63.19 -34.14 76.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.237 -0.438 . . . . 2.46 110.281 176.09 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.9 m -76.69 -8.46 57.32 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.822 -0.626 . . . . 1.3 110.838 -178.693 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 . . . . . 0 C--N 1.329 -0.321 0 CA-C-O 120.939 0.399 . . . . 0.97999999999999998 110.249 173.481 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 N--CA 1.448 -0.527 0 CA-C-O 121.143 0.497 . . . . 1.0600000000000001 109.842 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.521 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 4.7 pp0? -72.1 146.45 47.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.492 -0.776 . . . . 2.3100000000000001 110.356 -179.216 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 1.062 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 48.8 t -81.27 122.53 27.54 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.269 -0.641 . . . . 0.45000000000000001 109.269 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -59.91 -17.35 36.73 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.495 0.554 . . . . 2.46 112.495 -172.477 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -98.79 -25.4 14.66 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.657 0.742 . . . . 1.01 109.527 -178.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.859 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 35.6 m -107.61 -40.92 5.18 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.689 -1.141 . . . . 0.66000000000000003 113.147 -164.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.54 -12.39 65.31 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.641 -0.79 . . . . 0.53000000000000003 111.599 -171.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.437 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 14.2 tpp180 -69.34 129.91 41.11 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 122.534 0.333 . . . . 3.1899999999999999 110.186 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.521 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 19.6 m -89.8 110.2 21.14 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.086 -0.506 . . . . 1.23 111.174 -178.046 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 1.062 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 25.8 m-85 -94.08 135.12 35.78 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.744 -0.835 . . . . 0.46999999999999997 108.744 173.006 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.3 m -90.06 5.31 47.24 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 121.068 0.461 . . . . 1.51 110.475 -176.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.443 ' HA ' ' HD2' ' A' ' 16' ' ' PRO . 35.2 m-20 -123.51 109.45 30.76 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.941 -0.572 . . . . 1.9199999999999999 110.39 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.474 ' O ' ' HB2' ' A' ' 20' ' ' MET . 19.2 Cg_endo -58.43 -40.95 70.24 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.252 2.635 . . . . 0.5 113.064 -176.615 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.2 m -72.21 -40.58 67.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.24 0.543 . . . . 1.1200000000000001 110.479 -178.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.6 t -74.9 -37.95 61.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.039 -0.528 . . . . 1.1699999999999999 110.187 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.797 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 7.8 tmtt? -63.27 -20.75 65.74 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.283 0.563 . . . . 1.21 109.766 172.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.474 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 9.7 tpt -89.85 -37.57 14.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.832 -0.622 . . . . 1.6899999999999999 109.955 -173.668 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 78.5 mtp180 -69.79 -35.13 74.61 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.854 -0.612 . . . . 4.1500000000000004 109.578 171.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 48.5 t60 -60.53 -43.93 96.6 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.482 -0.781 . . . . 0.42999999999999999 109.735 172.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' A' ' 26' ' ' HIS . 6.4 tp -63.13 -36.95 85.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.076 -0.511 . . . . 1.47 110.293 178.27 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -64.14 -37.27 86.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.402 -0.817 . . . . 2.46 110.418 176.397 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 6.3 m -78.47 0.47 25.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.895 -0.593 . . . . 1.3 110.818 -178.386 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.435 ' HB2' ' O ' ' A' ' 23' ' ' LEU . 1.7 m-70 . . . . . 0 C--N 1.331 -0.225 0 O-C-N 122.032 -0.417 . . . . 0.97999999999999998 112.057 -178.116 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 . . . . . 0 N--CA 1.452 -0.342 0 CA-C-O 121.454 0.645 . . . . 1.0600000000000001 110.399 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.832 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 0.7 OUTLIER -76.38 145.68 39.26 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.098 -0.956 . . . . 2.3100000000000001 110.936 -176.585 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.858 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 53.1 t -84.89 119.39 25.29 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.583 -0.735 . . . . 0.45000000000000001 109.111 177.13 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -66.42 -3.07 5.33 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.437 0.532 . . . . 2.46 112.437 -175.08 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.6 m-85 -108.6 -17.81 13.88 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.239 -0.652 . . . . 1.01 109.239 178.628 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.775 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 15.5 m -111.6 -41.75 4.0 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.299 -0.864 . . . . 0.66000000000000003 112.847 -172.208 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.05 -3.65 84.55 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.722 -0.752 . . . . 0.53000000000000003 111.537 -170.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.5 tpt180 -91.48 131.39 36.96 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 109.949 -0.389 . . . . 3.1899999999999999 109.949 -178.385 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.832 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 44.9 m -92.88 121.54 34.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.014 0.435 . . . . 1.23 111.082 -178.728 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.858 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 11.1 m-85 -100.87 127.6 47.27 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.469 -0.938 . . . . 0.46999999999999997 108.469 175.257 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 21.3 m -79.4 9.51 4.7 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.807 0.337 . . . . 1.51 111.057 -177.034 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -122.88 106.22 34.39 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.201 -0.454 . . . . 1.9199999999999999 109.969 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.58 -38.72 88.2 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 123.02 2.48 . . . . 0.5 112.65 -177.138 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.2 t -71.5 -40.22 70.32 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.993 -0.549 . . . . 1.1200000000000001 110.941 -179.503 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.4 m -76.77 -35.02 57.97 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.406 -0.361 . . . . 1.1699999999999999 110.477 -179.31 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.708 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 8.7 tmtt? -66.42 -18.85 65.6 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.306 -0.628 . . . . 1.21 109.306 172.919 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 14.7 tpt -84.7 -50.09 7.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.52 -0.764 . . . . 1.6899999999999999 109.039 -178.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.1 ttp180 -59.79 -38.84 83.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.235 -0.893 . . . . 4.1500000000000004 109.629 176.013 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 41.6 t60 -62.27 -43.6 98.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.934 -1.03 . . . . 0.42999999999999999 110.986 178.247 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.5 mp -66.38 -31.51 72.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.498 -0.319 . . . . 1.47 110.944 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -70.34 -30.03 66.88 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.219 0.533 . . . . 2.46 110.256 175.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.0 m -70.62 -17.87 62.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.926 -0.579 . . . . 1.3 110.208 177.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 . . . . . 0 C--N 1.332 -0.156 0 CA-C-N 115.949 -0.569 . . . . 0.97999999999999998 111.272 176.928 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.474 ' HB3' ' HE2' ' A' ' 19' ' ' LYS . 82.3 m-85 . . . . . 0 N--CA 1.451 -0.389 0 N-CA-C 109.923 -0.399 . . . . 1.0600000000000001 109.923 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.531 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 14.0 pt20 -77.65 159.48 29.15 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.325 0.583 . . . . 2.3100000000000001 112.182 -173.795 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.904 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 33.4 t -98.54 119.49 37.35 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 108.09 -1.078 . . . . 0.45000000000000001 108.09 171.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -62.14 -18.35 60.64 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.579 0.585 . . . . 2.46 112.579 -170.028 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -102.9 -13.66 16.85 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.507 0.67 . . . . 1.01 109.28 -176.039 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.846 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 32.7 m -113.32 -36.64 4.93 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.203 -0.908 . . . . 0.66000000000000003 112.975 -170.389 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.26 -3.33 84.98 Favored Glycine 0 N--CA 1.453 -0.187 0 N-CA-C 111.181 -0.768 . . . . 0.53000000000000003 111.181 -173.209 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -80.82 130.07 34.86 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.71 0.404 . . . . 3.1899999999999999 110.374 -178.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.531 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 5.1 p -93.75 122.02 35.79 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.087 -0.506 . . . . 1.23 111.481 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.904 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 40.8 m-85 -99.84 142.91 30.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.907 -0.588 . . . . 0.46999999999999997 109.731 177.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.5 p -88.87 13.29 13.0 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.942 -0.572 . . . . 1.51 110.368 178.011 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.441 ' O ' ' HB3' ' A' ' 19' ' ' LYS . 2.1 m-20 -124.87 115.22 26.5 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.464 -0.789 . . . . 1.9199999999999999 110.543 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.416 ' HG3' ' CE1' ' A' ' 4' ' ' TYR . 19.2 Cg_exo -65.1 -46.93 5.24 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 123.003 2.469 . . . . 0.5 112.308 -178.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.8 m -72.69 -39.69 66.84 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.994 -0.548 . . . . 1.1200000000000001 110.499 -178.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.8 m -70.85 -39.21 73.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.436 -0.347 . . . . 1.1699999999999999 111.142 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.552 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 1.2 tmtm? -63.86 -19.14 64.83 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.407 0.622 . . . . 1.21 109.751 174.167 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 33.2 tpp -89.82 -44.73 9.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.591 -0.731 . . . . 1.6899999999999999 110.344 -176.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -67.27 -31.2 71.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.268 0.556 . . . . 4.1500000000000004 109.7 174.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -66.08 -48.27 71.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.339 -0.846 . . . . 0.42999999999999999 111.101 177.281 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.808 HD11 ' HA ' ' A' ' 6' ' ' CYS . 2.5 mp -67.35 -25.3 65.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.901 0.381 . . . . 1.47 111.018 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -75.63 -35.55 60.44 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.142 -0.481 . . . . 2.46 110.855 177.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.1 p -88.24 1.62 54.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.173 -0.467 . . . . 1.3 111.774 -177.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.467 0.381 0 N-CA-C 111.885 0.328 . . . . 0.97999999999999998 111.885 179.294 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.527 ' HB3' ' HE3' ' A' ' 19' ' ' LYS . 96.3 m-85 . . . . . 0 N--CA 1.453 -0.301 0 CA-C-O 120.671 0.272 . . . . 1.0600000000000001 111.067 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -76.36 133.76 39.86 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.845 -0.428 . . . . 2.3100000000000001 109.845 175.602 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 1.014 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 44.6 t -82.82 122.96 28.89 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 108.521 -0.918 . . . . 0.45000000000000001 108.521 171.655 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -62.71 -15.24 51.91 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.922 0.712 . . . . 2.46 112.922 -171.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -109.97 -16.77 13.76 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.775 0.798 . . . . 1.01 109.547 -176.669 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.83 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 12.7 m -99.2 -37.0 9.47 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.882 -1.054 . . . . 0.66000000000000003 111.801 -178.346 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.77 8.57 87.68 Favored Glycine 0 N--CA 1.451 -0.327 0 N-CA-C 111.062 -0.815 . . . . 0.53000000000000003 111.062 -173.41 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 64.3 ttt180 -106.61 137.85 43.87 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.457 -0.372 . . . . 3.1899999999999999 110.59 -173.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.5 m -91.44 114.36 26.87 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.942 -0.572 . . . . 1.23 110.709 -179.03 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 1.014 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 19.1 m-85 -97.17 121.83 39.49 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.747 -0.835 . . . . 0.46999999999999997 108.747 173.702 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 34.9 t -82.57 22.0 0.92 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.39 0.614 . . . . 1.51 109.889 178.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.408 ' H ' ' C ' ' A' ' 13' ' ' PHE . 11.7 m-20 -123.53 96.33 43.76 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.385 -0.825 . . . . 1.9199999999999999 109.806 -178.538 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.0 -43.11 62.62 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.439 2.759 . . . . 0.5 113.938 -173.431 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 94.6 m -82.01 -34.3 29.66 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.145 0.498 . . . . 1.1200000000000001 110.996 -177.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.3 m -77.95 -31.1 50.71 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.667 -0.413 . . . . 1.1699999999999999 110.909 -177.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.76 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 8.8 tmtt? -69.17 -22.17 63.93 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 109.098 -0.704 . . . . 1.21 109.098 171.143 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -77.32 -53.53 7.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.407 -0.815 . . . . 1.6899999999999999 109.525 -174.562 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -67.71 -28.58 67.78 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.661 -0.7 . . . . 4.1500000000000004 110.343 177.642 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 62.6 t60 -60.62 -46.09 91.57 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.052 0.453 . . . . 0.42999999999999999 109.834 172.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -61.7 -46.95 87.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.808 -0.633 . . . . 1.47 110.44 177.563 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -56.44 -31.09 63.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.731 0.301 . . . . 2.46 111.576 178.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 96.2 m -74.26 -57.28 4.05 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 112.649 0.611 . . . . 1.3 112.649 -173.233 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.533 0.317 0 C-N-CA 119.676 -0.81 . . . . 0.97999999999999998 112.163 -171.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.691 ' HB3' ' HD3' ' A' ' 19' ' ' LYS . 83.6 m-85 . . . . . 0 N--CA 1.452 -0.345 0 CA-C-O 121.334 0.587 . . . . 1.0600000000000001 111.011 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.489 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 37.8 tt0 -71.99 146.1 47.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.335 -0.848 . . . . 2.3100000000000001 111.213 -178.617 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.878 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 53.4 t -87.35 123.25 32.11 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.568 -0.901 . . . . 0.45000000000000001 108.568 169.594 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -68.17 -8.57 39.82 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 112.043 0.386 . . . . 2.46 112.043 -175.028 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.581 ' CE2' ' HG ' ' A' ' 23' ' ' LEU . 15.5 m-85 -111.11 -6.08 14.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.048 0.451 . . . . 1.01 109.864 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.878 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 11.0 m -120.08 -36.72 3.2 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.825 0.676 . . . . 0.66000000000000003 112.825 -172.566 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.15 -7.95 72.96 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.699 -0.763 . . . . 0.53000000000000003 111.737 -173.527 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.489 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 63.2 ttt180 -80.53 139.7 36.22 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 120.53 0.205 . . . . 3.1899999999999999 110.632 -177.336 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 p -91.51 117.95 30.15 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.987 -0.551 . . . . 1.23 110.743 176.861 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.749 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 54.5 m-85 -98.69 147.54 24.75 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.69 -0.485 . . . . 0.46999999999999997 109.69 177.783 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 55.4 m -91.59 2.96 56.1 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.392 -0.596 . . . . 1.51 109.392 176.029 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.587 ' O ' ' HB3' ' A' ' 19' ' ' LYS . 25.2 m-20 -120.98 109.34 35.71 Favored Pre-proline 0 CA--C 1.516 -0.33 0 CA-C-N 115.686 -0.688 . . . . 1.9199999999999999 110.689 -176.012 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.46 ' HG3' ' CE1' ' A' ' 4' ' ' TYR . 25.0 Cg_exo -62.56 -43.49 21.65 Favored 'Trans proline' 0 N--CA 1.464 -0.248 0 C-N-CA 122.454 2.103 . . . . 0.5 111.764 177.608 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.9 m -75.75 -40.01 56.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.728 -0.669 . . . . 1.1200000000000001 111.181 -178.386 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.567 ' HB2' ' CB ' ' A' ' 15' ' ' ASP . 70.4 m -79.81 -25.13 40.96 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.675 -0.41 . . . . 1.1699999999999999 111.347 -177.38 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.691 ' HD3' ' HB3' ' A' ' 4' ' ' TYR . 6.4 tttp -68.97 -24.32 64.24 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.213 -0.662 . . . . 1.21 109.213 167.438 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 13.9 tpt -80.12 -53.23 6.89 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.666 -0.697 . . . . 1.6899999999999999 110.131 -171.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -60.52 -33.28 72.4 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 121.272 0.558 . . . . 4.1500000000000004 109.614 176.575 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -63.24 -48.07 79.77 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.272 -0.876 . . . . 0.42999999999999999 110.432 175.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.581 ' HG ' ' CE2' ' A' ' 8' ' ' TYR . 0.6 OUTLIER -64.79 -42.19 95.25 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.365 -0.834 . . . . 1.47 111.053 -175.074 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -80.18 -1.24 39.58 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.963 0.357 . . . . 2.46 111.963 -176.533 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 88.6 m -96.46 -40.1 9.24 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.49 -0.484 . . . . 1.3 111.177 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 p80 . . . . . 0 C--N 1.33 -0.252 0 C-N-CA 119.499 -0.88 . . . . 0.97999999999999998 112.149 -174.86 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.403 ' HB2' ' CD ' ' A' ' 19' ' ' LYS . 49.5 m-85 . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 109.767 -0.456 . . . . 1.0600000000000001 109.767 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.628 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 19.9 pt20 -76.01 160.1 30.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.303 0.573 . . . . 2.3100000000000001 111.68 -174.156 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.741 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 36.5 t -110.15 121.25 44.82 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.098 -0.704 . . . . 0.45000000000000001 109.098 171.356 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.5 -11.54 35.05 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.359 0.503 . . . . 2.46 112.359 -173.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -103.72 -26.51 12.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.769 0.795 . . . . 1.01 109.193 -178.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.741 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 4.1 m -94.65 -41.09 9.48 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.674 -1.148 . . . . 0.66000000000000003 112.041 -173.225 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.35 11.17 85.76 Favored Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 110.559 -1.017 . . . . 0.53000000000000003 110.559 -166.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -109.95 132.03 54.52 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.786 -0.449 . . . . 3.1899999999999999 109.786 -177.193 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.628 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 14.4 m -92.84 118.28 30.94 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.501 -0.772 . . . . 1.23 110.646 -177.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.686 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 44.7 m-85 -99.06 122.88 42.89 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.075 -0.713 . . . . 0.46999999999999997 109.075 177.355 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.7 t -83.17 17.85 1.89 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.182 0.515 . . . . 1.51 109.788 178.323 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -131.06 100.44 17.15 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 109.183 -0.673 . . . . 1.9199999999999999 109.183 -176.637 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.434 ' O ' ' HB2' ' A' ' 20' ' ' MET . 43.8 Cg_exo -55.73 -43.77 54.29 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.191 2.594 . . . . 0.5 112.797 -175.685 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.8 m -65.97 -42.57 89.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.109 -0.496 . . . . 1.1200000000000001 111.24 -178.236 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.9 m -74.85 -37.49 62.21 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.564 -0.289 . . . . 1.1699999999999999 111.197 -178.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.67 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 26.1 tttp -64.31 -20.24 65.96 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.158 0.504 . . . . 1.21 109.717 174.479 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.434 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 12.8 tpt -85.83 -51.44 6.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.492 -0.776 . . . . 1.6899999999999999 109.734 -173.114 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 48.2 mtp180 -63.32 -37.58 87.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.372 -0.831 . . . . 4.1500000000000004 110.29 175.717 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -66.18 -38.4 87.94 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.745 -0.661 . . . . 0.42999999999999999 110.512 178.373 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.492 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 3.2 tp -62.72 -43.7 98.14 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.996 0.426 . . . . 1.47 109.987 178.385 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -57.95 -38.71 76.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.406 -0.816 . . . . 2.46 110.902 177.452 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 16.0 m -77.86 0.25 24.67 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.628 -0.715 . . . . 1.3 111.425 -176.028 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.4 ' HB2' ' O ' ' A' ' 23' ' ' LEU . 12.5 m-70 . . . . . 0 C--O 1.234 0.258 0 O-C-N 121.91 -0.494 . . . . 0.97999999999999998 111.716 176.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 . . . . . 0 N--CA 1.454 -0.229 0 N-CA-C 109.621 -0.511 . . . . 1.0600000000000001 109.621 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.713 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 20.2 pt20 -71.89 141.42 49.53 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.108 -0.497 . . . . 2.3100000000000001 111.251 -178.382 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.756 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 44.4 t -90.6 130.09 36.66 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.834 -0.621 . . . . 0.45000000000000001 109.759 177.478 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -75.22 -2.65 28.95 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 111.65 0.241 . . . . 2.46 111.65 -175.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -101.76 -32.15 10.42 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 122.202 1.001 . . . . 1.01 108.643 177.525 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.756 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 27.7 m -101.28 -37.57 8.45 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 113.618 -1.628 . . . . 0.66000000000000003 112.563 -167.657 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.69 -2.37 88.14 Favored Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.832 -0.699 . . . . 0.53000000000000003 111.584 -173.773 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.444 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 75.0 ttt180 -96.17 139.63 32.05 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.944 -0.391 . . . . 3.1899999999999999 109.944 -176.131 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.713 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 20.0 m -92.73 106.05 18.09 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.028 -0.533 . . . . 1.23 110.457 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.897 ' HB2' ' HB2' ' A' ' 19' ' ' LYS . 50.0 m-85 -88.61 119.78 29.39 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.834 -0.802 . . . . 0.46999999999999997 108.834 177.77 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.2 t -78.76 8.44 5.43 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.777 0.323 . . . . 1.51 110.612 -176.543 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.457 ' HA ' ' HD2' ' A' ' 16' ' ' PRO . 0.7 OUTLIER -121.03 104.64 41.15 Favored Pre-proline 0 C--N 1.328 -0.329 0 N-CA-C 109.807 -0.442 . . . . 1.9199999999999999 109.807 177.251 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.457 ' HD2' ' HA ' ' A' ' 15' ' ' ASP . 18.3 Cg_endo -57.6 -32.9 95.66 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 123.058 2.506 . . . . 0.5 112.728 -175.272 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.0 m -83.07 -31.92 27.09 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.253 -0.431 . . . . 1.1200000000000001 111.195 -178.33 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.0 m -81.18 -32.32 33.64 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.936 0.398 . . . . 1.1699999999999999 110.376 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.897 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 7.6 tmtt? -66.76 -19.12 65.68 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.825 -0.625 . . . . 1.21 109.338 170.396 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.408 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 0.1 OUTLIER -87.77 -51.9 5.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.349 -0.841 . . . . 1.6899999999999999 109.2 -177.692 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.475 ' HA ' ' OE1' ' A' ' 24' ' ' GLU . 55.2 ttp180 -54.01 -39.33 65.99 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.759 -0.655 . . . . 4.1500000000000004 110.275 173.833 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.624 ' HA ' HG22 ' A' ' 25' ' ' THR . 64.7 t60 -69.08 -30.29 68.57 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.451 -0.795 . . . . 0.42999999999999999 110.914 177.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.08 -34.55 75.3 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.471 -0.566 . . . . 1.47 109.471 177.021 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.475 ' OE1' ' HA ' ' A' ' 21' ' ' ARG . 42.4 mt-10 -66.43 -46.67 75.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.667 -0.697 . . . . 2.46 110.691 176.194 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.624 HG22 ' HA ' ' A' ' 22' ' ' HIS . 12.1 t -71.76 -7.34 47.55 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.129 -0.487 . . . . 1.3 111.877 -174.33 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 14.1 m-70 . . . . . 0 C--N 1.33 -0.249 0 N-CA-C 109.671 -0.492 . . . . 0.97999999999999998 109.671 172.733 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.563 ' HE2' ' HG3' ' A' ' 16' ' ' PRO . 90.8 m-85 . . . . . 0 N--CA 1.452 -0.339 0 N-CA-C 109.618 -0.512 . . . . 1.0600000000000001 109.618 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.746 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 4.8 pp0? -88.2 149.94 23.58 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.303 0.573 . . . . 2.3100000000000001 112.234 -170.783 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 1.015 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 48.6 t -95.03 125.29 39.59 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.631 -0.713 . . . . 0.45000000000000001 109.595 175.809 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -63.79 -21.61 66.51 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.325 0.491 . . . . 2.46 112.325 -173.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -95.59 -27.88 15.12 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.967 0.889 . . . . 1.01 108.964 -176.085 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.756 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 6.8 m -95.75 -40.46 9.35 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.224 -1.353 . . . . 0.66000000000000003 112.821 -170.467 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.57 10.41 85.87 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.404 -0.903 . . . . 0.53000000000000003 110.907 -171.161 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -105.44 132.97 50.94 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.686 -0.487 . . . . 3.1899999999999999 109.686 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.746 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 19.6 m -96.5 120.12 36.24 Favored 'General case' 0 C--N 1.32 -0.71 0 O-C-N 123.428 0.455 . . . . 1.23 110.485 179.666 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 1.015 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 24.7 m-85 -95.32 126.95 40.98 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.273 -0.64 . . . . 0.46999999999999997 109.273 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.6 t -77.41 9.95 2.88 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.971 -0.558 . . . . 1.51 111.525 -173.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.42 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 5.0 m-20 -135.31 120.15 13.61 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-O 121.041 0.448 . . . . 1.9199999999999999 110.153 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.563 ' HG3' ' HE2' ' A' ' 4' ' ' TYR . 31.7 Cg_exo -57.2 -53.2 5.14 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 123.574 2.849 . . . . 0.5 112.592 -176.534 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.1 m -55.42 -46.74 76.63 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.354 -0.385 . . . . 1.1200000000000001 111.742 -177.199 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.0 p -84.41 -16.63 42.01 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 120.538 -0.465 . . . . 1.1699999999999999 111.704 -175.747 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.891 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 10.7 tmtt? -77.63 -23.26 49.8 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 108.611 -0.885 . . . . 1.21 108.611 170.041 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.559 ' HG2' ' O ' ' A' ' 16' ' ' PRO . 77.4 mmm -83.58 -52.57 6.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.343 -0.844 . . . . 1.6899999999999999 110.265 -175.395 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 92.9 mtt-85 -59.83 -30.84 69.22 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.282 0.563 . . . . 4.1500000000000004 110.042 176.403 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.41 ' O ' ' HD2' ' A' ' 26' ' ' HIS . 38.5 t60 -68.58 -41.91 79.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.432 -0.804 . . . . 0.42999999999999999 110.596 178.625 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.468 HD21 ' HA ' ' A' ' 6' ' ' CYS . 2.1 mm? -65.54 -38.98 91.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.937 0.398 . . . . 1.47 110.192 176.659 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 20' ' ' MET . 39.0 mm-40 -62.89 -34.3 77.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.656 -0.702 . . . . 2.46 111.166 177.732 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.4 p -84.51 -0.43 53.04 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.261 0.467 . . . . 1.3 112.261 -176.146 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.41 ' HD2' ' O ' ' A' ' 22' ' ' HIS . 17.7 m-70 . . . . . 0 C--N 1.33 -0.244 0 CA-C-O 121.542 0.687 . . . . 0.97999999999999998 109.148 168.778 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 . . . . . 0 N--CA 1.45 -0.44 0 N-CA-C 109.576 -0.527 . . . . 1.0600000000000001 109.576 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.53 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 43.6 mt-30 -77.11 157.55 30.96 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.522 -0.308 . . . . 2.3100000000000001 110.381 -177.404 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.791 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 45.3 t -88.39 127.68 35.5 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 108.535 -0.913 . . . . 0.45000000000000001 108.535 175.727 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -67.01 -13.23 61.71 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.988 0.736 . . . . 2.46 112.988 -168.196 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -103.36 -30.28 10.7 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.884 0.85 . . . . 1.01 108.775 177.087 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.791 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 63.4 m -95.21 -40.37 9.61 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.544 -1.207 . . . . 0.66000000000000003 113.721 -166.664 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.76 -3.65 86.86 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.622 -0.799 . . . . 0.53000000000000003 112.116 -176.196 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.475 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 68.5 ttt180 -76.38 134.35 39.67 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.671 -0.492 . . . . 3.1899999999999999 109.671 176.505 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.53 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 50.2 p -90.96 110.0 21.24 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.051 0.453 . . . . 1.23 110.6 -179.737 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.766 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 69.9 m-85 -88.91 124.76 34.53 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.56 -0.904 . . . . 0.46999999999999997 108.56 174.364 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.0 m -69.43 -6.45 30.29 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.718 -0.674 . . . . 1.51 111.02 -176.061 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -135.7 124.34 15.66 Favored Pre-proline 0 CA--C 1.516 -0.336 0 CA-C-O 120.804 0.335 . . . . 1.9199999999999999 110.539 -173.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.626 ' O ' ' HB2' ' A' ' 20' ' ' MET . 38.0 Cg_endo -67.4 -23.05 44.62 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.599 2.199 . . . . 0.5 111.425 177.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.8 m -67.53 -54.5 19.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.407 -0.815 . . . . 1.1200000000000001 110.917 179.649 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.8 p -80.78 -28.96 36.18 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.541 -0.3 . . . . 1.1699999999999999 111.272 -176.604 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.711 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 0.3 OUTLIER -65.47 -19.59 66.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.188 0.518 . . . . 1.21 109.898 172.668 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.626 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -84.12 -53.85 5.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.902 -0.59 . . . . 1.6899999999999999 109.456 -177.355 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.494 ' HA ' ' OE1' ' A' ' 24' ' ' GLU . 60.2 ttt180 -57.24 -34.06 68.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.1 -0.5 . . . . 4.1500000000000004 109.9 174.728 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -55.94 -47.49 77.46 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.896 -0.593 . . . . 0.42999999999999999 110.684 174.371 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.35 -29.3 68.81 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.277 -0.42 . . . . 1.47 110.678 -179.202 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.494 ' OE1' ' HA ' ' A' ' 21' ' ' ARG . 47.5 mt-10 -68.84 -56.91 6.47 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.176 0.512 . . . . 2.46 111.011 174.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.2 t -78.76 3.62 16.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.908 -0.587 . . . . 1.3 111.739 -174.71 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.467 0.404 0 N-CA-C 113.326 0.862 . . . . 0.97999999999999998 113.326 -171.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.481 1.101 0 CA-C-O 120.884 0.373 . . . . 5.4900000000000002 110.626 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.439 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 62.7 tttp -143.03 117.89 6.38 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 109.299 -0.63 . . . . 4.2800000000000002 109.299 174.035 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 6.1 Cg_exo -79.05 129.78 9.05 Favored 'Trans proline' 0 N--CA 1.446 -1.282 0 C-N-CA 123.014 2.476 . . . . 1.4399999999999999 111.275 -176.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.425 ' CZ ' ' HG3' ' A' ' 16' ' ' PRO . 59.0 m-85 -82.75 74.69 9.69 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.034 -0.985 . . . . 1.0600000000000001 109.332 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.424 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 18.2 pt20 -85.92 154.64 21.36 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.075 -0.966 . . . . 2.3100000000000001 111.401 -175.121 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.765 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 51.6 t -93.08 130.86 38.55 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.185 -0.462 . . . . 0.45000000000000001 110.297 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -61.95 -22.9 66.02 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.723 -0.671 . . . . 2.46 112.69 -173.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -103.69 -23.69 13.42 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.595 0.712 . . . . 1.01 109.462 -174.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.765 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 47.3 m -98.58 -28.86 13.38 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.648 -1.16 . . . . 0.66000000000000003 112.358 -171.238 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.97 3.92 57.39 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.747 -0.74 . . . . 0.53000000000000003 111.796 -175.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.424 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 5.0 tpm_? -90.09 128.35 36.29 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 109.716 -0.476 . . . . 3.1899999999999999 109.716 -177.22 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 3.4 p -85.87 116.83 24.35 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.482 -0.781 . . . . 1.23 110.574 179.193 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.725 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 49.9 m-85 -96.57 127.86 42.96 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.719 -0.845 . . . . 0.46999999999999997 108.719 173.103 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.2 m -82.69 5.58 20.8 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.032 0.444 . . . . 1.51 110.737 -178.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 3.4 t70 -138.15 122.84 12.0 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 115.79 -0.641 . . . . 1.9199999999999999 110.31 -177.408 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.539 ' O ' ' HB2' ' A' ' 20' ' ' MET . 19.7 Cg_exo -65.42 -24.71 56.75 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 123.169 2.579 . . . . 0.5 112.424 -178.033 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -68.67 -54.85 13.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.219 -0.446 . . . . 1.1200000000000001 110.926 -177.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.3 p -73.2 -31.0 63.93 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.391 -0.368 . . . . 1.1699999999999999 111.152 -179.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.655 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 1.5 tmtm? -65.8 -19.34 65.85 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.457 -0.572 . . . . 1.21 109.457 172.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.539 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 11.7 tpt -86.79 -53.59 4.84 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.335 -0.617 . . . . 1.6899999999999999 109.335 -177.314 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.497 HH21 ' CD ' ' A' ' 24' ' ' GLU . 2.8 mmp_? -54.47 -44.75 72.86 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.568 -0.742 . . . . 4.1500000000000004 110.365 175.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 56.0 t60 -62.14 -34.57 76.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.078 -0.51 . . . . 0.42999999999999999 111.187 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -79.5 -33.5 42.07 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.992 -0.283 . . . . 1.47 111.704 -177.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.497 ' CD ' HH21 ' A' ' 21' ' ' ARG . 16.5 pt-20 -85.41 -32.59 22.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.734 0.302 . . . . 2.46 111.163 -178.619 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 32.9 m -84.64 -3.68 58.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.363 0.601 . . . . 1.3 110.45 177.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.93 -29.38 60.04 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 109.028 -0.73 . . . . 0.97999999999999998 109.028 169.094 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -76.18 71.96 2.94 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 114.915 -1.039 . . . . 3.02 110.077 173.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -129.62 48.69 2.34 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.564 -0.743 . . . . 4.4100000000000001 110.205 177.27 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -77.52 -32.48 54.12 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.42 -0.809 . . . . 7.3600000000000003 110.073 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.0 tttp . . . . . 0 C--O 1.249 1.035 0 CA-C-N 115.611 -0.722 . . . . 9.3100000000000005 110.071 177.307 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.559 ' O ' ' HD3' ' A' ' 3' ' ' PRO . 1.6 mpt? . . . . . 0 N--CA 1.483 1.192 0 CA-C-O 120.67 0.271 . . . . 5.4900000000000002 110.86 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 34.8 mmtm -104.99 92.32 5.19 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.518 -0.31 . . . . 4.2800000000000002 110.201 174.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.559 ' HD3' ' O ' ' A' ' 1' ' ' MET . 10.9 Cg_endo -91.25 159.96 3.77 Favored 'Trans proline' 0 N--CA 1.446 -1.315 0 C-N-CA 123.288 2.659 . . . . 1.4399999999999999 111.569 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -101.18 83.41 2.48 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.238 -0.653 . . . . 1.0600000000000001 109.238 177.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.501 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 16.5 pt20 -72.16 159.93 33.29 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.515 -0.766 . . . . 2.3100000000000001 110.827 -177.498 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.971 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 8.6 t -83.11 128.61 34.63 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.238 -1.023 . . . . 0.45000000000000001 108.238 178.176 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.47 ' H ' HD11 ' A' ' 23' ' ' LEU . 12.6 m-20 -66.34 -6.29 13.67 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 112.856 0.688 . . . . 2.46 112.856 -171.592 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -111.72 -13.71 13.7 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.314 0.578 . . . . 1.01 109.982 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.867 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 74.9 m -119.31 -36.56 3.34 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.638 -0.71 . . . . 0.66000000000000003 112.868 -163.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.9 -16.01 39.7 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.432 -0.89 . . . . 0.53000000000000003 112.009 -176.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.501 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 72.6 ttt180 -62.69 135.4 57.35 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.936 -0.394 . . . . 3.1899999999999999 109.936 177.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 p -89.44 113.06 24.35 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.212 0.529 . . . . 1.23 111.994 -174.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.971 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 69.4 m-85 -99.26 131.28 45.39 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.582 -0.895 . . . . 0.46999999999999997 108.582 172.261 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.5 m -79.67 4.33 16.43 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.386 -0.37 . . . . 1.51 110.543 -176.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -131.3 115.83 16.35 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.448 -0.342 . . . . 1.9199999999999999 110.72 -174.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -61.8 -34.92 81.56 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 123.028 2.486 . . . . 0.5 112.069 -178.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.9 p -70.9 -45.79 63.69 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.195 0.521 . . . . 1.1200000000000001 110.474 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.4 m -71.65 -36.72 70.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.059 -0.519 . . . . 1.1699999999999999 111.064 -177.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.724 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 0.2 OUTLIER -65.95 -19.42 65.86 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.82 -0.437 . . . . 1.21 109.82 174.105 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 13.7 tpt -90.6 -46.34 8.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.872 -0.604 . . . . 1.6899999999999999 110.488 -174.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.8 mmm180 -64.05 -36.11 82.92 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.663 -0.495 . . . . 4.1500000000000004 109.663 176.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 44.0 t60 -70.18 -35.52 74.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.896 -0.593 . . . . 0.42999999999999999 110.372 176.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.542 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 5.2 tp -57.87 -58.59 7.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.578 -0.737 . . . . 1.47 110.72 -178.174 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -64.14 -33.49 75.91 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.474 -0.785 . . . . 2.46 111.703 -176.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 25.9 m -74.15 -5.35 41.26 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.882 0.372 . . . . 1.3 111.416 -176.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 13.6 m-70 -65.31 -18.66 65.49 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.865 0.364 . . . . 0.97999999999999998 110.345 173.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.44 ' OD2' ' HB3' ' A' ' 29' ' ' ASP . 35.9 t70 -117.68 96.32 5.33 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.4 -0.593 . . . . 3.02 109.4 175.44 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.3 p -78.09 23.13 0.28 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.89 -0.595 . . . . 4.4100000000000001 112.219 -175.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.44 ' HB3' ' OD2' ' A' ' 27' ' ' ASP . 20.0 t70 -86.39 -21.41 27.17 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.526 0.679 . . . . 7.3600000000000003 109.171 175.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.7 mttp . . . . . 0 C--O 1.247 0.966 0 CA-C-N 115.285 -0.87 . . . . 9.3100000000000005 110.472 -174.607 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.478 0.95 0 CA-C-O 120.818 0.342 . . . . 5.4900000000000002 110.227 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.525 ' HD2' ' HD2' ' A' ' 3' ' ' PRO . 26.9 tptp -83.88 118.49 71.49 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.313 -0.403 . . . . 4.2800000000000002 110.452 179.468 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.569 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 2.2 Cg_endo -83.94 155.13 13.22 Favored 'Trans proline' 0 N--CA 1.449 -1.105 0 C-N-CA 123.068 2.512 . . . . 1.4399999999999999 111.148 176.501 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -108.01 122.2 46.36 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.862 -0.608 . . . . 1.0600000000000001 110.805 -175.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.601 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 8.6 tt0 -73.92 142.29 45.94 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.42 -0.809 . . . . 2.3100000000000001 111.508 -176.166 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.973 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 8.4 t -77.0 122.13 24.48 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 108.341 -0.985 . . . . 0.45000000000000001 108.341 174.33 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -64.47 -8.15 12.59 Favored 'General case' 0 C--N 1.319 -0.744 0 O-C-N 123.802 0.689 . . . . 2.46 112.732 -170.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -111.58 -21.74 11.59 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 121.135 0.493 . . . . 1.01 110.051 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.558 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 63.4 m -114.48 -29.76 6.75 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.312 0.856 . . . . 0.66000000000000003 113.312 -163.071 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.6 -8.66 78.56 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.417 -0.897 . . . . 0.53000000000000003 112.772 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -78.86 135.65 37.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.726 0.263 . . . . 3.1899999999999999 110.719 177.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.601 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 36.9 m -99.59 116.31 31.43 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.855 0.359 . . . . 1.23 110.803 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.973 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 42.3 m-85 -94.62 128.74 41.47 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.29 -0.633 . . . . 0.46999999999999997 109.29 177.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.1 t -84.16 17.4 2.51 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.62 0.724 . . . . 1.51 110.14 -178.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.419 ' HA ' ' HD2' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -125.78 102.79 28.3 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 115.47 -0.786 . . . . 1.9199999999999999 109.78 177.584 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.53 ' O ' ' HB2' ' A' ' 20' ' ' MET . 12.0 Cg_endo -55.35 -38.41 93.85 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 123.496 2.798 . . . . 0.5 112.452 -176.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.5 m -74.97 -36.02 62.05 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.136 -0.483 . . . . 1.1200000000000001 110.918 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.5 t -76.98 -41.9 41.13 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 120.99 -0.284 . . . . 1.1699999999999999 110.385 -176.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.851 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 2.7 tmtm? -63.79 -18.01 63.66 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.415 0.626 . . . . 1.21 109.828 175.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.53 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 0.2 OUTLIER -84.19 -53.56 5.42 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.472 -0.785 . . . . 1.6899999999999999 109.484 -175.286 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 53.2 mtp180 -70.13 -20.53 63.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.918 -0.583 . . . . 4.1500000000000004 110.444 175.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.421 ' HD2' ' SG ' ' A' ' 6' ' ' CYS . 63.1 t60 -66.89 -42.94 84.68 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.033 -0.531 . . . . 0.42999999999999999 109.641 173.306 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.1 -38.08 89.77 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.257 0.551 . . . . 1.47 109.696 174.799 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -60.64 -41.27 94.61 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.099 -0.955 . . . . 2.46 111.207 177.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.0 p -84.37 0.41 49.43 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.545 0.572 . . . . 1.3 112.545 -174.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.8 m-70 -83.62 13.79 4.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.029 0.442 . . . . 0.97999999999999998 110.472 173.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -84.2 -5.98 59.33 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.664 0.745 . . . . 3.02 109.568 175.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 9.8 t -66.39 -13.55 60.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.368 -0.833 . . . . 4.4100000000000001 110.727 177.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -81.72 -4.76 57.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.001 -0.545 . . . . 7.3600000000000003 111.105 178.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.41 ' NZ ' ' HB2' ' A' ' 30' ' ' LYS . 4.2 ttmp? . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.762 -0.637 . . . . 9.3100000000000005 109.874 177.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ptt? . . . . . 0 N--CA 1.48 1.038 0 CA-C-O 120.723 0.297 . . . . 5.4900000000000002 110.596 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.4 ' HB2' ' HE3' ' A' ' 2' ' ' LYS . 14.5 ptmt -170.74 148.75 2.72 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.963 -0.562 . . . . 4.2800000000000002 109.653 175.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.562 ' HB2' ' OG ' ' A' ' 12' ' ' SER . 1.0 OUTLIER -85.21 131.18 4.15 Favored 'Trans proline' 0 N--CA 1.447 -1.232 0 C-N-CA 123.098 2.532 . . . . 1.4399999999999999 110.341 174.373 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.669 ' HB3' ' HD2' ' A' ' 19' ' ' LYS . 80.8 m-85 -95.75 97.19 9.5 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.623 -0.717 . . . . 1.0600000000000001 110.575 -173.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.799 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 36.6 tt0 -76.53 139.4 40.72 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.467 -0.788 . . . . 2.3100000000000001 110.792 -176.318 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 1.029 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 50.0 t -80.44 119.6 23.34 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.923 -0.769 . . . . 0.45000000000000001 108.923 176.516 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -64.12 -6.3 6.28 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.755 1.02 . . . . 2.46 113.755 -170.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -109.09 -33.39 6.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.946 0.879 . . . . 1.01 109.075 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.795 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 7.0 m -85.96 -40.32 15.98 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.388 -1.278 . . . . 0.66000000000000003 112.162 -170.438 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.75 -1.5 88.05 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 110.714 -0.954 . . . . 0.53000000000000003 110.714 -169.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.1 tpt180 -89.5 129.23 36.02 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.067 -0.716 . . . . 3.1899999999999999 109.067 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.799 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 0.8 OUTLIER -98.57 118.0 34.29 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 120.932 0.396 . . . . 1.23 110.665 -175.903 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 1.029 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 24.8 m-85 -97.53 129.22 44.7 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.091 -0.707 . . . . 0.46999999999999997 109.091 178.725 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 59.1 m -78.26 4.46 12.71 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.53 -0.305 . . . . 1.51 111.467 -177.003 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.509 ' HB3' ' HB3' ' A' ' 18' ' ' SER . 11.7 t70 -120.06 113.63 34.09 Favored Pre-proline 0 C--N 1.33 -0.281 0 C-N-CA 120.947 -0.301 . . . . 1.9199999999999999 110.505 -178.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.516 ' O ' ' HB2' ' A' ' 20' ' ' MET . 28.1 Cg_endo -62.51 -32.77 80.07 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 123.201 2.601 . . . . 0.5 113.035 -176.058 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 35.8 m -80.46 -45.08 18.18 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.099 0.476 . . . . 1.1200000000000001 110.652 -178.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.509 ' HB3' ' HB3' ' A' ' 15' ' ' ASP . 40.9 t -70.17 -37.14 75.1 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.002 -0.544 . . . . 1.1699999999999999 110.905 -178.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.886 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 6.8 tmtt? -67.15 -18.86 65.47 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.115 0.483 . . . . 1.21 109.835 174.351 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.516 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 10.6 tpt -86.86 -43.9 12.11 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.375 -0.602 . . . . 1.6899999999999999 109.375 -174.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.0 ttt85 -63.33 -38.37 90.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.601 -0.727 . . . . 4.1500000000000004 109.378 174.079 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -63.34 -38.63 91.89 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.301 -0.863 . . . . 0.42999999999999999 110.81 177.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.03 -36.69 84.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.998 0.428 . . . . 1.47 110.433 176.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -70.37 -29.46 66.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.195 0.522 . . . . 2.46 110.498 175.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.0 m -66.53 -27.18 67.56 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.673 -0.694 . . . . 1.3 110.592 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -72.51 -0.45 12.76 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.057 -0.52 . . . . 0.97999999999999998 112.004 -179.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -76.56 -86.01 0.05 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.916 -0.402 . . . . 3.02 109.916 176.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.6 p -147.03 22.77 1.21 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.037 0.446 . . . . 4.4100000000000001 110.069 177.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -115.48 16.65 16.61 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.174 0.512 . . . . 7.3600000000000003 110.855 -172.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.49 ' HB3' ' NZ ' ' A' ' 30' ' ' LYS . 1.1 ttpm? . . . . . 0 C--O 1.245 0.823 0 CA-C-O 118.935 -0.555 . . . . 9.3100000000000005 109.958 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ptt? . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 110.354 -0.239 . . . . 5.4900000000000002 110.354 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt 59.15 84.61 0.2 Allowed Pre-proline 0 N--CA 1.471 0.62 0 O-C-N 123.844 0.715 . . . . 4.2800000000000002 110.689 177.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -86.82 130.1 3.07 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 123.366 2.711 . . . . 1.4399999999999999 112.859 -174.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.596 ' HB3' ' HE2' ' A' ' 19' ' ' LYS . 64.9 m-85 -127.12 161.22 28.97 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 114.82 -1.082 . . . . 1.0600000000000001 108.522 175.332 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.426 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 9.3 pt20 -116.32 161.1 19.54 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.91 -0.316 . . . . 2.3100000000000001 111.138 -177.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.898 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 43.5 t -88.22 121.18 30.32 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.659 -1.237 . . . . 0.45000000000000001 107.659 172.088 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -65.45 -1.65 2.68 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 113.649 0.981 . . . . 2.46 113.649 -171.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -108.53 -24.14 11.53 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.491 0.662 . . . . 1.01 109.339 174.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.77 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 92.9 m -110.22 -35.15 6.17 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.0 -1.0 . . . . 0.66000000000000003 113.069 -166.112 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.0 -11.44 57.31 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.899 -0.667 . . . . 0.53000000000000003 112.191 -175.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.426 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 9.8 ttp180 -70.07 141.77 52.76 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 110.353 -0.24 . . . . 3.1899999999999999 110.353 -178.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.535 ' HA ' ' O ' ' A' ' 4' ' ' TYR . 31.9 m -90.06 113.62 25.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.122 0.487 . . . . 1.23 111.811 -176.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.898 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 46.1 m-85 -101.29 119.46 38.79 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.099 -1.074 . . . . 0.46999999999999997 108.099 170.498 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.0 p -87.12 21.5 2.34 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.374 0.607 . . . . 1.51 110.41 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -137.36 96.85 10.85 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 115.202 -0.908 . . . . 1.9199999999999999 110.002 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -57.03 -43.39 54.31 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.657 2.905 . . . . 0.5 113.863 -172.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.4 ' O ' ' HB3' ' A' ' 20' ' ' MET . 9.0 t -62.18 -44.35 96.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.261 0.553 . . . . 1.1200000000000001 111.682 -176.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.09 -28.93 39.0 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.284 -0.416 . . . . 1.1699999999999999 111.297 -179.128 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.596 ' HE2' ' HB3' ' A' ' 4' ' ' TYR . 7.9 tttp -65.84 -20.25 66.17 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.411 -0.589 . . . . 1.21 109.411 168.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.4 ' HB3' ' O ' ' A' ' 17' ' ' THR . 1.1 tmt? -82.46 -50.25 9.06 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 109.087 -0.708 . . . . 1.6899999999999999 109.087 -177.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.7 mmm180 -64.66 -29.58 70.58 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.712 -0.676 . . . . 4.1500000000000004 110.081 175.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -64.32 -40.54 96.11 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.734 -0.667 . . . . 0.42999999999999999 110.371 175.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -68.16 -31.53 71.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.011 0.434 . . . . 1.47 110.535 177.102 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -65.48 -50.64 64.57 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.065 -0.516 . . . . 2.46 110.994 176.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 17.2 p -76.6 -5.38 47.49 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.549 0.574 . . . . 1.3 112.549 -174.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -68.41 -25.82 65.23 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.879 -0.415 . . . . 0.97999999999999998 109.879 173.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -86.29 -74.23 0.43 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.092 -0.503 . . . . 3.02 110.264 176.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.0 m -156.28 150.75 25.68 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.297 -0.631 . . . . 4.4100000000000001 109.297 -179.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -79.08 -39.18 34.42 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.449 -0.574 . . . . 7.3600000000000003 109.449 177.495 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.415 ' HG2' ' O ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.128 0 CA-C-N 115.462 -0.79 . . . . 9.3100000000000005 109.896 169.085 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.9 ttp . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 120.696 0.284 . . . . 5.4900000000000002 110.52 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.494 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 36.9 ttmt -83.95 114.0 51.35 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.386 -0.37 . . . . 4.2800000000000002 110.456 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.684 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 2.0 Cg_endo -82.89 179.91 4.92 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 123.607 2.871 . . . . 1.4399999999999999 112.287 -178.566 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -124.8 132.16 53.37 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.214 0.53 . . . . 1.0600000000000001 110.462 -178.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -82.83 141.16 32.49 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.637 -0.711 . . . . 2.3100000000000001 111.939 -172.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.96 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 22.5 t -77.45 133.21 38.67 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.355 -0.98 . . . . 0.45000000000000001 108.355 176.509 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -55.6 -27.65 50.71 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.986 0.736 . . . . 2.46 112.986 -168.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -111.25 -9.27 14.31 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.241 -0.584 . . . . 1.01 110.753 -175.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.882 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 94.9 m -111.32 -37.95 5.13 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 113.929 1.085 . . . . 0.66000000000000003 113.929 -165.212 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.02 -20.15 30.57 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 119.959 -1.115 . . . . 0.53000000000000003 111.879 -174.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.6 ttt180 -64.49 137.2 57.74 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.828 0.347 . . . . 3.1899999999999999 110.411 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.684 ' HB3' ' HB2' ' A' ' 3' ' ' PRO . 11.2 m -95.28 112.16 23.91 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.653 -0.703 . . . . 1.23 111.2 -176.332 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.96 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 60.8 m-85 -97.17 122.8 40.6 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.752 -0.833 . . . . 0.46999999999999997 108.752 174.461 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.6 m -81.96 10.58 6.25 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.129 0.49 . . . . 1.51 110.851 -176.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -133.31 108.48 12.36 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.93 -0.577 . . . . 1.9199999999999999 109.816 178.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.435 ' O ' ' HB2' ' A' ' 20' ' ' MET . 35.4 Cg_endo -65.05 -26.43 58.14 Favored 'Trans proline' 0 CA--C 1.527 0.163 0 C-N-CA 123.004 2.469 . . . . 0.5 113.106 -174.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 16.7 m -76.84 -45.89 26.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.848 0.356 . . . . 1.1200000000000001 111.238 -176.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.0 p -77.51 -31.08 53.29 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.701 -0.399 . . . . 1.1699999999999999 110.941 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 19.9 tttm -66.18 -19.22 65.77 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 121.216 0.532 . . . . 1.21 109.645 171.44 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.435 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 43.5 tpp -78.41 -49.96 12.58 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.309 -0.626 . . . . 1.6899999999999999 109.309 -177.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.3 mmt85 -63.92 -33.53 75.92 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.704 -0.68 . . . . 4.1500000000000004 109.93 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 79.2 t60 -62.01 -43.68 98.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.732 -0.667 . . . . 0.42999999999999999 110.445 175.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.99 -40.95 90.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.17 0.51 . . . . 1.47 109.771 177.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.86 -35.02 79.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.445 -0.798 . . . . 2.46 111.025 177.172 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 59.9 m -67.07 -25.79 66.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 1.3 111.026 -178.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 57.1 m-70 -69.3 -25.28 64.16 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.092 0.472 . . . . 0.97999999999999998 110.429 176.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.13 -14.08 54.31 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.126 -0.488 . . . . 3.02 110.424 178.218 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 9.1 m -70.2 -15.39 62.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.322 0.582 . . . . 4.4100000000000001 110.32 178.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -66.83 -22.36 66.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.641 -0.708 . . . . 7.3600000000000003 110.356 176.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.9 mmtt . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.642 -0.694 . . . . 9.3100000000000005 110.049 -178.966 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.9 ttt . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 120.945 0.402 . . . . 5.4900000000000002 110.643 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.442 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 17.6 tppt? -100.01 121.68 53.17 Favored Pre-proline 0 C--N 1.321 -0.647 0 N-CA-C 109.535 -0.542 . . . . 4.2800000000000002 109.535 177.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.454 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 1.2 Cg_endo -86.32 129.51 3.25 Favored 'Trans proline' 0 N--CA 1.448 -1.153 0 C-N-CA 123.067 2.512 . . . . 1.4399999999999999 111.778 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.607 ' CE1' ' HG3' ' A' ' 16' ' ' PRO . 75.6 m-85 -99.37 105.3 17.26 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 114.886 -1.052 . . . . 1.0600000000000001 109.371 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.4 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 77.5 mt-30 -83.1 150.94 25.97 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.603 -0.726 . . . . 2.3100000000000001 111.725 -173.535 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.764 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 51.1 t -99.56 111.45 23.79 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 115.428 -0.805 . . . . 0.45000000000000001 108.943 174.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.79 0.49 2.37 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.765 0.654 . . . . 2.46 112.765 -175.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -105.06 -21.24 13.31 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.938 -0.764 . . . . 1.01 108.938 175.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.764 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 4.1 m -103.52 -37.35 7.6 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.632 -1.167 . . . . 0.66000000000000003 111.832 -174.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.39 13.54 83.14 Favored Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 111.178 -0.769 . . . . 0.53000000000000003 111.178 -171.304 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.4 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 48.7 ttt180 -107.17 141.58 38.21 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 110.438 -0.208 . . . . 3.1899999999999999 110.438 -175.609 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.454 ' HB3' ' HB2' ' A' ' 3' ' ' PRO . 14.6 m -93.33 115.21 27.78 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 123.382 0.426 . . . . 1.23 110.693 178.153 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.614 ' HB2' ' HB2' ' A' ' 19' ' ' LYS . 11.6 m-85 -95.53 133.82 39.1 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.791 -0.818 . . . . 0.46999999999999997 108.791 175.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.9 t -90.65 6.08 45.39 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.211 0.529 . . . . 1.51 110.011 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -123.83 106.55 31.68 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.939 -0.573 . . . . 1.9199999999999999 110.101 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.607 ' HG3' ' CE1' ' A' ' 4' ' ' TYR . 38.7 Cg_exo -59.56 -42.95 42.96 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 123.184 2.59 . . . . 0.5 112.817 -175.093 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 59.4 m -69.53 -44.3 71.25 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.003 0.43 . . . . 1.1200000000000001 111.317 -176.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 12.9 m -75.0 -32.61 61.69 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.628 -0.429 . . . . 1.1699999999999999 110.879 -178.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 8.7 tmtt? -67.12 -20.58 65.8 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 109.415 -0.587 . . . . 1.21 109.415 173.487 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.422 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 4.1 tmm? -81.08 -53.92 5.99 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.813 -0.81 . . . . 1.6899999999999999 108.813 -175.331 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.2 mmt180 -58.24 -36.11 72.72 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.334 -0.848 . . . . 4.1500000000000004 110.026 174.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -62.6 -43.35 99.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.709 -0.678 . . . . 0.42999999999999999 111.029 177.047 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.1 mp -62.06 -39.53 92.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.905 0.383 . . . . 1.47 110.24 177.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -65.21 -28.2 69.21 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.842 -0.617 . . . . 2.46 110.546 177.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 20.8 m -72.34 -16.87 61.88 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.902 -0.59 . . . . 1.3 110.512 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 34.8 m-70 -75.96 -20.86 57.56 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.096 0.474 . . . . 0.97999999999999998 110.171 175.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -86.22 -49.06 8.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.856 -0.611 . . . . 3.02 109.45 174.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.3 t -133.28 107.18 7.97 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.585 -0.734 . . . . 4.4100000000000001 110.165 175.289 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -80.62 -49.58 11.08 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.612 -0.722 . . . . 7.3600000000000003 110.239 -177.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.7 mttm . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.846 -0.597 . . . . 9.3100000000000005 109.988 175.065 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.4 tpt . . . . . 0 N--CA 1.48 1.055 0 N-CA-C 110.276 -0.268 . . . . 5.4900000000000002 110.276 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 14' ' ' SER . 30.7 mmtp 61.0 82.92 0.22 Allowed Pre-proline 0 C--N 1.329 -0.288 0 O-C-N 123.671 0.607 . . . . 4.2800000000000002 111.371 179.435 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.749 ' HB2' ' HB2' ' A' ' 12' ' ' SER . 36.4 Cg_endo -91.19 128.3 1.21 Allowed 'Trans proline' 0 N--CA 1.44 -1.618 0 C-N-CA 123.046 2.497 . . . . 1.4399999999999999 111.831 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.484 ' HB2' ' HD3' ' A' ' 19' ' ' LYS . 83.0 m-85 -110.98 120.64 43.06 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 115.34 -0.845 . . . . 1.0600000000000001 109.687 179.622 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.501 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 73.7 mt-30 -82.53 137.09 34.7 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.474 0.654 . . . . 2.3100000000000001 112.241 -170.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.942 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 52.6 t -76.66 123.47 26.19 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.475 -0.784 . . . . 0.45000000000000001 108.964 176.086 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -63.17 -12.68 29.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.024 0.75 . . . . 2.46 113.024 -171.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -107.56 -23.69 12.06 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.657 0.741 . . . . 1.01 109.549 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.791 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 11.8 m -98.16 -41.49 7.88 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.83 -1.077 . . . . 0.66000000000000003 112.958 -172.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.31 -10.0 65.3 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 111.017 -0.833 . . . . 0.53000000000000003 111.017 -167.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -79.14 134.43 36.71 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 122.838 0.455 . . . . 3.1899999999999999 110.19 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.749 ' HB2' ' HB2' ' A' ' 3' ' ' PRO . 47.3 p -95.21 122.93 38.41 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.126 -0.488 . . . . 1.23 111.372 -177.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.942 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 19.3 m-85 -104.04 124.03 48.29 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.463 -0.94 . . . . 0.46999999999999997 108.463 173.858 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.403 ' HA ' ' O ' ' A' ' 2' ' ' LYS . 15.0 m -80.49 13.36 2.51 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.113 0.482 . . . . 1.51 111.03 -175.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -136.18 115.53 10.99 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.158 -0.474 . . . . 1.9199999999999999 110.154 -179.113 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.606 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 48.0 Cg_exo -56.62 -40.19 86.15 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.464 2.776 . . . . 0.5 112.673 -177.673 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 m -73.08 -40.25 65.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.94 0.4 . . . . 1.1200000000000001 111.19 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.3 m -73.76 -32.37 63.78 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.085 0.469 . . . . 1.1699999999999999 110.425 -178.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.781 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 15.0 ttpp -69.59 -18.89 63.65 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.688 -0.687 . . . . 1.21 109.683 171.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 43.1 ttm -87.45 -47.95 8.35 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.835 -0.62 . . . . 1.6899999999999999 110.57 -173.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -59.25 -38.94 81.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.347 0.594 . . . . 4.1500000000000004 109.568 172.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -60.04 -48.48 81.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.19 -0.913 . . . . 0.42999999999999999 110.897 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.461 HD23 ' O ' ' A' ' 19' ' ' LYS . 2.7 mm? -64.34 -34.19 77.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.918 0.39 . . . . 1.47 111.006 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -66.76 -21.07 66.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.197 0.523 . . . . 2.46 110.887 178.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.1 m -98.07 0.25 45.8 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.38 0.609 . . . . 1.3 110.71 -178.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -77.96 -30.02 50.12 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.429 -0.351 . . . . 0.97999999999999998 111.775 -178.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -106.01 81.74 1.68 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.095 0.474 . . . . 3.02 110.35 179.219 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.3 p -102.99 16.19 27.35 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.543 0.687 . . . . 4.4100000000000001 110.144 175.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -78.76 -38.87 37.62 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.308 -0.86 . . . . 7.3600000000000003 109.777 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.244 0.795 0 CA-C-N 115.626 -0.715 . . . . 9.3100000000000005 110.392 177.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.4 mtp . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 120.718 0.294 . . . . 5.4900000000000002 110.747 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.471 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 18.4 ptpt -125.08 128.36 24.83 Favored Pre-proline 0 C--N 1.319 -0.738 0 N-CA-C 109.085 -0.709 . . . . 4.2800000000000002 109.085 173.088 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 6.9 Cg_endo -87.86 134.04 3.13 Favored 'Trans proline' 0 N--CA 1.446 -1.298 0 C-N-CA 123.294 2.662 . . . . 1.4399999999999999 112.29 -174.358 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -106.76 109.53 21.46 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 114.742 -1.117 . . . . 1.0600000000000001 110.062 176.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.564 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 0.5 OUTLIER -77.65 152.81 33.63 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.726 -0.67 . . . . 2.3100000000000001 110.335 -179.815 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.991 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 21.5 t -84.13 129.41 34.9 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.201 -1.037 . . . . 0.45000000000000001 108.201 177.309 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.422 ' OD1' HD21 ' A' ' 23' ' ' LEU . 2.3 m-20 -54.98 -23.05 17.34 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 113.431 0.9 . . . . 2.46 113.431 -169.002 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -111.07 -16.58 13.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.361 0.6 . . . . 1.01 110.093 -178.164 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.911 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 83.6 m -105.89 -33.53 7.93 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.459 -0.792 . . . . 0.66000000000000003 112.931 -167.478 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.33 -10.59 35.03 Favored Glycine 0 CA--C 1.517 0.202 0 C-N-CA 120.795 -0.717 . . . . 0.53000000000000003 112.104 -176.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.564 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 30.4 ttm180 -63.46 135.9 57.23 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 122.616 0.367 . . . . 3.1899999999999999 110.416 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.2 m -89.94 103.67 16.31 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 123.369 0.418 . . . . 1.23 111.043 -176.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.991 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 61.8 m-85 -91.43 119.4 31.38 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.334 -0.987 . . . . 0.46999999999999997 108.334 173.563 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.7 p -77.32 12.62 1.44 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.076 -0.511 . . . . 1.51 111.333 -175.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.554 ' HB2' ' HB2' ' A' ' 18' ' ' SER . 8.5 m-20 -131.32 114.94 16.08 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 116.199 -0.455 . . . . 1.9199999999999999 109.946 -176.367 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -57.57 -46.34 27.89 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 123.329 2.686 . . . . 0.5 112.523 -178.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 57.6 m -70.32 -35.92 73.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.746 0.308 . . . . 1.1200000000000001 110.995 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.554 ' HB2' ' HB2' ' A' ' 15' ' ' ASP . 6.3 m -75.8 -35.52 60.03 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.785 -0.366 . . . . 1.1699999999999999 111.324 -176.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.788 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 1.6 tmtm? -67.26 -18.41 65.2 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.207 -0.664 . . . . 1.21 109.207 173.153 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 11.5 tpt -88.43 -48.65 7.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.206 -0.906 . . . . 1.6899999999999999 109.962 -179.033 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.2 ttp180 -57.84 -41.22 81.88 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-O 121.509 0.671 . . . . 4.1500000000000004 109.325 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 75.2 t60 -61.73 -38.39 87.73 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.163 -0.926 . . . . 0.42999999999999999 111.227 178.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.422 HD21 ' OD1' ' A' ' 7' ' ' ASP . 1.2 mp -62.53 -43.57 98.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.929 0.395 . . . . 1.47 110.394 177.766 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -63.67 -32.45 73.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.779 -0.646 . . . . 2.46 110.353 176.359 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 24.1 m -74.46 -14.87 60.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.871 -0.604 . . . . 1.3 111.32 -177.284 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 -76.36 -3.94 39.57 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 120.749 0.309 . . . . 0.97999999999999998 111.33 177.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -64.18 139.08 58.73 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.77 -0.826 . . . . 3.02 108.77 170.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.7 p 49.31 59.15 4.68 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.309 0.576 . . . . 4.4100000000000001 111.238 -171.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -61.92 -40.93 97.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.494 -0.776 . . . . 7.3600000000000003 109.073 175.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.8 tptp . . . . . 0 C--O 1.249 1.071 0 CA-C-N 115.034 -0.984 . . . . 9.3100000000000005 109.283 172.996 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.0 mtp . . . . . 0 N--CA 1.479 1.017 0 N-CA-C 110.045 -0.354 . . . . 5.4900000000000002 110.045 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.475 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 56.1 mtmt -109.36 132.58 21.19 Favored Pre-proline 0 C--N 1.321 -0.67 0 CA-C-N 116.074 -0.512 . . . . 4.2800000000000002 109.943 178.404 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.648 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 2.1 Cg_endo -86.92 152.9 8.49 Favored 'Trans proline' 0 N--CA 1.446 -1.274 0 C-N-CA 123.378 2.718 . . . . 1.4399999999999999 111.832 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -100.13 129.52 46.17 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.593 -0.731 . . . . 1.0600000000000001 109.863 -176.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.499 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 60.6 mt-30 -84.35 148.31 26.7 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.087 0.47 . . . . 2.3100000000000001 112.09 -170.201 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 1.004 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 42.8 t -81.49 123.11 28.33 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.23 -1.026 . . . . 0.45000000000000001 108.23 176.246 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -64.21 -9.53 17.69 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.744 0.646 . . . . 2.46 112.744 -171.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.475 ' HE2' ' HG ' ' A' ' 23' ' ' LEU . 1.2 m-85 -106.88 -17.07 14.3 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 109.205 -0.665 . . . . 1.01 109.205 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.797 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 71.6 m -115.47 -40.5 3.4 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 113.649 0.981 . . . . 0.66000000000000003 113.649 -168.406 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.59 -13.13 64.87 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.558 -0.829 . . . . 0.53000000000000003 111.77 -174.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 64.8 ttt180 -69.58 137.0 52.0 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.94 -0.393 . . . . 3.1899999999999999 109.94 177.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.648 ' HB3' ' HB2' ' A' ' 3' ' ' PRO . 8.8 m -98.19 112.15 24.23 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.168 -0.469 . . . . 1.23 111.178 -175.43 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 1.004 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 50.1 m-85 -95.92 123.94 39.72 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.394 -0.595 . . . . 0.46999999999999997 109.394 176.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.507 ' HA ' ' HA ' ' A' ' 3' ' ' PRO . 32.6 t -80.88 10.25 5.29 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.932 0.396 . . . . 1.51 110.508 -176.727 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.684 ' HB2' ' OG ' ' A' ' 18' ' ' SER . 8.0 m-20 -130.64 110.05 16.01 Favored Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 109.546 -0.539 . . . . 1.9199999999999999 109.546 -177.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.482 ' O ' ' HB2' ' A' ' 20' ' ' MET . 31.2 Cg_exo -59.39 -32.85 97.25 Favored 'Trans proline' 0 C--O 1.225 -0.14 0 C-N-CA 122.731 2.287 . . . . 0.5 112.018 179.538 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.0 p -70.54 -43.08 70.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.84 -0.618 . . . . 1.1200000000000001 111.806 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.684 ' OG ' ' HB2' ' A' ' 15' ' ' ASP . 81.1 p -77.33 -38.48 50.31 Favored 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 120.53 -0.468 . . . . 1.1699999999999999 110.391 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.576 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 23.8 tttm -63.46 -18.81 64.15 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-O 121.067 0.461 . . . . 1.21 110.007 173.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.482 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 14.7 tpt -80.85 -54.26 5.75 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.5 -0.556 . . . . 1.6899999999999999 109.5 -177.277 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 21' ' ' ARG . 52.9 mtm180 -69.49 -20.75 63.73 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.167 0.508 . . . . 4.1500000000000004 110.287 176.707 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 78.4 t60 -71.75 -43.13 66.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.07 -0.514 . . . . 0.42999999999999999 110.541 174.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.475 ' HG ' ' HE2' ' A' ' 8' ' ' TYR . 1.4 mp -63.16 -32.07 73.36 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.777 -0.453 . . . . 1.47 109.777 176.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -67.53 -29.93 69.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.732 -0.667 . . . . 2.46 110.828 172.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 54.4 m -69.81 -24.49 63.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.08 0.467 . . . . 1.3 110.65 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -79.96 -5.83 56.4 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.346 -0.388 . . . . 0.97999999999999998 110.331 177.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.2 t70 71.29 -66.63 0.29 Allowed 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 115.359 -0.837 . . . . 3.02 112.233 174.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.3 m -82.78 117.08 22.43 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.919 0.39 . . . . 4.4100000000000001 110.748 -174.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -89.54 -15.36 33.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.984 -0.553 . . . . 7.3600000000000003 110.598 -178.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.6 -0.714 . . . . 9.3100000000000005 110.383 -179.341 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.1 ttp . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 121.042 0.449 . . . . 5.4900000000000002 110.914 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.457 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 50.1 tttm -88.21 137.22 31.15 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.843 -0.617 . . . . 4.2800000000000002 111.162 -174.192 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 4.2 Cg_exo -81.83 128.92 6.09 Favored 'Trans proline' 0 N--CA 1.449 -1.111 0 C-N-CA 122.942 2.428 . . . . 1.4399999999999999 109.786 171.309 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.672 ' HB3' ' CD ' ' A' ' 19' ' ' LYS . 77.4 m-85 -99.52 104.03 15.82 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 115.461 -0.79 . . . . 1.0600000000000001 111.398 -171.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.464 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 92.4 mt-30 -86.83 160.22 18.83 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.852 -0.613 . . . . 2.3100000000000001 111.318 -176.426 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.993 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 35.9 t -90.1 119.95 30.87 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 107.898 -1.149 . . . . 0.45000000000000001 107.898 174.356 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -69.32 0.07 5.53 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.722 0.638 . . . . 2.46 112.722 -171.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.4 m-30 -103.51 -23.77 13.48 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.951 -0.759 . . . . 1.01 108.951 173.535 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.789 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 88.4 m -114.0 -40.41 3.74 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.876 -1.056 . . . . 0.66000000000000003 113.549 -164.459 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.88 -15.54 61.52 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.769 -0.729 . . . . 0.53000000000000003 112.017 -174.389 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.464 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 61.1 ttt180 -67.42 138.7 56.86 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.184 0.193 . . . . 3.1899999999999999 110.578 -179.489 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.6 m -94.62 122.64 37.43 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.419 -0.355 . . . . 1.23 110.936 -177.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.993 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 84.0 m-85 -101.64 139.63 37.03 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.821 -0.627 . . . . 0.46999999999999997 109.432 176.031 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.7 p -80.79 2.54 25.85 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.621 -0.718 . . . . 1.51 110.828 -176.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.857 ' HB2' ' HB3' ' A' ' 18' ' ' SER . 8.4 m-20 -134.24 118.02 13.77 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.336 -0.393 . . . . 1.9199999999999999 110.216 -174.388 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.466 ' O ' ' HG3' ' A' ' 20' ' ' MET . 18.5 Cg_endo -60.6 -40.82 52.71 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 123.051 2.5 . . . . 0.5 112.605 -178.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 88.7 m -80.51 -31.12 37.21 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.698 0.285 . . . . 1.1200000000000001 110.732 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.857 ' HB3' ' HB2' ' A' ' 15' ' ' ASP . 25.7 t -74.49 -37.5 63.13 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 120.661 -0.416 . . . . 1.1699999999999999 109.906 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.672 ' CD ' ' HB3' ' A' ' 4' ' ' TYR . 8.8 tttp -57.8 -28.64 64.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.077 -0.511 . . . . 1.21 109.686 170.144 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.47 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 61.2 mtp -84.44 -45.69 12.44 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 116.046 -0.525 . . . . 1.6899999999999999 110.335 -173.73 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -62.93 -31.68 72.82 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.54 -0.754 . . . . 4.1500000000000004 109.636 174.439 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 67.5 t60 -63.05 -46.36 87.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.491 -0.777 . . . . 0.42999999999999999 110.626 173.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.458 HD23 ' O ' ' A' ' 19' ' ' LYS . 2.3 mm? -59.27 -38.82 81.04 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.475 -0.33 . . . . 1.47 110.665 178.276 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 20' ' ' MET . 48.4 mt-10 -63.19 -34.14 76.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.237 -0.438 . . . . 2.46 110.281 176.09 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.9 m -76.69 -8.46 57.32 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.822 -0.626 . . . . 1.3 110.838 -178.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -79.6 -28.96 41.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.939 0.399 . . . . 0.97999999999999998 110.249 173.481 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.611 ' O ' ' HB ' ' A' ' 28' ' ' THR . 55.3 m-20 58.14 -87.99 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.148 -0.933 . . . . 3.02 111.567 -179.24 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.611 ' HB ' ' O ' ' A' ' 27' ' ' ASP . 6.7 t 159.65 -20.72 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 123.884 0.874 . . . . 4.4100000000000001 108.791 -178.085 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -78.73 -21.63 47.76 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.135 -0.939 . . . . 7.3600000000000003 111.734 -175.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.841 -0.6 . . . . 9.3100000000000005 110.797 -173.197 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 N--CA 1.482 1.175 0 N-CA-C 110.006 -0.368 . . . . 5.4900000000000002 110.006 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.411 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 18.0 ptpt -108.61 115.59 57.43 Favored Pre-proline 0 C--N 1.323 -0.558 0 N-CA-C 109.171 -0.677 . . . . 4.2800000000000002 109.171 170.626 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.679 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 2.0 Cg_endo -84.14 161.71 13.46 Favored 'Trans proline' 0 N--CA 1.45 -1.069 0 C-N-CA 123.032 2.488 . . . . 1.4399999999999999 111.201 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -88.47 85.2 6.81 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.881 -0.6 . . . . 1.0600000000000001 109.842 -177.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.521 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 4.7 pp0? -72.1 146.45 47.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.492 -0.776 . . . . 2.3100000000000001 110.356 -179.216 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 1.062 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 48.8 t -81.27 122.53 27.54 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.269 -0.641 . . . . 0.45000000000000001 109.269 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -59.91 -17.35 36.73 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.495 0.554 . . . . 2.46 112.495 -172.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -98.79 -25.4 14.66 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.657 0.742 . . . . 1.01 109.527 -178.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.859 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 35.6 m -107.61 -40.92 5.18 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.689 -1.141 . . . . 0.66000000000000003 113.147 -164.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.54 -12.39 65.31 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.641 -0.79 . . . . 0.53000000000000003 111.599 -171.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.437 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 14.2 tpp180 -69.34 129.91 41.11 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 122.534 0.333 . . . . 3.1899999999999999 110.186 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.679 ' HB3' ' HB2' ' A' ' 3' ' ' PRO . 19.6 m -89.8 110.2 21.14 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.086 -0.506 . . . . 1.23 111.174 -178.046 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 1.062 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 25.8 m-85 -94.08 135.12 35.78 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.744 -0.835 . . . . 0.46999999999999997 108.744 173.006 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.3 m -90.06 5.31 47.24 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 121.068 0.461 . . . . 1.51 110.475 -176.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.443 ' HA ' ' HD2' ' A' ' 16' ' ' PRO . 35.2 m-20 -123.51 109.45 30.76 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.941 -0.572 . . . . 1.9199999999999999 110.39 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.474 ' O ' ' HB2' ' A' ' 20' ' ' MET . 19.2 Cg_endo -58.43 -40.95 70.24 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.252 2.635 . . . . 0.5 113.064 -176.615 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.2 m -72.21 -40.58 67.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.24 0.543 . . . . 1.1200000000000001 110.479 -178.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.6 t -74.9 -37.95 61.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.039 -0.528 . . . . 1.1699999999999999 110.187 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.797 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 7.8 tmtt? -63.27 -20.75 65.74 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.283 0.563 . . . . 1.21 109.766 172.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.474 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 9.7 tpt -89.85 -37.57 14.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.832 -0.622 . . . . 1.6899999999999999 109.955 -173.668 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 78.5 mtp180 -69.79 -35.13 74.61 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.854 -0.612 . . . . 4.1500000000000004 109.578 171.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 48.5 t60 -60.53 -43.93 96.6 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.482 -0.781 . . . . 0.42999999999999999 109.735 172.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' A' ' 26' ' ' HIS . 6.4 tp -63.13 -36.95 85.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.076 -0.511 . . . . 1.47 110.293 178.27 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -64.14 -37.27 86.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.402 -0.817 . . . . 2.46 110.418 176.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 6.3 m -78.47 0.47 25.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.895 -0.593 . . . . 1.3 110.818 -178.386 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.794 ' HA ' ' HB2' ' A' ' 29' ' ' ASP . 1.7 m-70 -79.03 -6.12 55.61 Favored 'General case' 0 C--N 1.331 -0.225 0 O-C-N 122.032 -0.417 . . . . 0.97999999999999998 112.057 -178.116 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -62.02 -51.08 69.47 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 108.83 -0.804 . . . . 3.02 108.83 168.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.2 m -109.51 38.98 2.19 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.025 -0.989 . . . . 4.4100000000000001 110.344 -177.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.794 ' HB2' ' HA ' ' A' ' 26' ' ' HIS . 25.0 t70 -82.96 -59.93 2.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.016 -0.538 . . . . 7.3600000000000003 109.741 177.671 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 62.4 pttt . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.272 -0.871 . . . . 9.3100000000000005 109.785 174.61 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.4 mtm . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 121.057 0.456 . . . . 5.4900000000000002 110.078 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.405 ' HB2' ' HE3' ' A' ' 2' ' ' LYS . 33.9 mtmt -139.27 151.39 67.2 Favored Pre-proline 0 C--N 1.324 -0.54 0 CA-C-N 115.832 -0.622 . . . . 4.2800000000000002 109.552 178.342 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -89.99 127.6 1.52 Allowed 'Trans proline' 0 N--CA 1.444 -1.406 0 C-N-CA 122.843 2.362 . . . . 1.4399999999999999 110.4 172.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -105.7 104.07 13.71 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.398 -0.819 . . . . 1.0600000000000001 110.399 -175.653 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.832 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 0.7 OUTLIER -76.38 145.68 39.26 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.098 -0.956 . . . . 2.3100000000000001 110.936 -176.585 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.858 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 53.1 t -84.89 119.39 25.29 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.583 -0.735 . . . . 0.45000000000000001 109.111 177.13 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -66.42 -3.07 5.33 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.437 0.532 . . . . 2.46 112.437 -175.08 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.6 m-85 -108.6 -17.81 13.88 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.239 -0.652 . . . . 1.01 109.239 178.628 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.775 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 15.5 m -111.6 -41.75 4.0 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.299 -0.864 . . . . 0.66000000000000003 112.847 -172.208 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.05 -3.65 84.55 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.722 -0.752 . . . . 0.53000000000000003 111.537 -170.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.5 tpt180 -91.48 131.39 36.96 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 109.949 -0.389 . . . . 3.1899999999999999 109.949 -178.385 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.832 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 44.9 m -92.88 121.54 34.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.014 0.435 . . . . 1.23 111.082 -178.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.858 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 11.1 m-85 -100.87 127.6 47.27 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.469 -0.938 . . . . 0.46999999999999997 108.469 175.257 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 21.3 m -79.4 9.51 4.7 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.807 0.337 . . . . 1.51 111.057 -177.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -122.88 106.22 34.39 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.201 -0.454 . . . . 1.9199999999999999 109.969 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.58 -38.72 88.2 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 123.02 2.48 . . . . 0.5 112.65 -177.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.2 t -71.5 -40.22 70.32 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.993 -0.549 . . . . 1.1200000000000001 110.941 -179.503 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.4 m -76.77 -35.02 57.97 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.406 -0.361 . . . . 1.1699999999999999 110.477 -179.31 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.708 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 8.7 tmtt? -66.42 -18.85 65.6 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.306 -0.628 . . . . 1.21 109.306 172.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 14.7 tpt -84.7 -50.09 7.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.52 -0.764 . . . . 1.6899999999999999 109.039 -178.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.1 ttp180 -59.79 -38.84 83.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.235 -0.893 . . . . 4.1500000000000004 109.629 176.013 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 41.6 t60 -62.27 -43.6 98.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.934 -1.03 . . . . 0.42999999999999999 110.986 178.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.5 mp -66.38 -31.51 72.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.498 -0.319 . . . . 1.47 110.944 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -70.34 -30.03 66.88 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.219 0.533 . . . . 2.46 110.256 175.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.0 m -70.62 -17.87 62.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.926 -0.579 . . . . 1.3 110.208 177.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -77.02 -9.31 58.61 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.949 -0.569 . . . . 0.97999999999999998 111.272 176.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -83.24 93.66 7.73 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.967 -0.753 . . . . 3.02 108.967 172.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 35.1 p -62.06 136.09 57.8 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.365 -0.834 . . . . 4.4100000000000001 111.3 -177.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -64.55 -32.6 74.32 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.513 -0.767 . . . . 7.3600000000000003 109.071 174.047 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 23.6 tptm . . . . . 0 C--O 1.247 0.937 0 CA-C-N 114.724 -1.125 . . . . 9.3100000000000005 108.923 173.877 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 mmt . . . . . 0 N--CA 1.48 1.061 0 N-CA-C 109.959 -0.385 . . . . 5.4900000000000002 109.959 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.448 ' HE3' ' HB2' ' A' ' 2' ' ' LYS . 30.2 ttmt -153.71 108.92 2.54 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-O 120.886 0.374 . . . . 4.2800000000000002 110.549 -178.103 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.559 ' HB2' ' HB2' ' A' ' 12' ' ' SER . 2.1 Cg_endo -82.78 168.16 14.22 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 122.919 2.412 . . . . 1.4399999999999999 111.597 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.474 ' HB3' ' HE2' ' A' ' 19' ' ' LYS . 82.3 m-85 -116.54 107.29 14.55 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.8 -0.636 . . . . 1.0600000000000001 109.923 -177.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.531 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 14.0 pt20 -77.65 159.48 29.15 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.325 0.583 . . . . 2.3100000000000001 112.182 -173.795 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.904 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 33.4 t -98.54 119.49 37.35 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 108.09 -1.078 . . . . 0.45000000000000001 108.09 171.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -62.14 -18.35 60.64 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.579 0.585 . . . . 2.46 112.579 -170.028 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -102.9 -13.66 16.85 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.507 0.67 . . . . 1.01 109.28 -176.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.846 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 32.7 m -113.32 -36.64 4.93 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.203 -0.908 . . . . 0.66000000000000003 112.975 -170.389 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.26 -3.33 84.98 Favored Glycine 0 N--CA 1.453 -0.187 0 N-CA-C 111.181 -0.768 . . . . 0.53000000000000003 111.181 -173.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -80.82 130.07 34.86 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.71 0.404 . . . . 3.1899999999999999 110.374 -178.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.559 ' HB2' ' HB2' ' A' ' 3' ' ' PRO . 5.1 p -93.75 122.02 35.79 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.087 -0.506 . . . . 1.23 111.481 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.904 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 40.8 m-85 -99.84 142.91 30.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.907 -0.588 . . . . 0.46999999999999997 109.731 177.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.5 p -88.87 13.29 13.0 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.942 -0.572 . . . . 1.51 110.368 178.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.441 ' O ' ' HB3' ' A' ' 19' ' ' LYS . 2.1 m-20 -124.87 115.22 26.5 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.464 -0.789 . . . . 1.9199999999999999 110.543 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.416 ' HG3' ' CE1' ' A' ' 4' ' ' TYR . 19.2 Cg_exo -65.1 -46.93 5.24 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 123.003 2.469 . . . . 0.5 112.308 -178.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.8 m -72.69 -39.69 66.84 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.994 -0.548 . . . . 1.1200000000000001 110.499 -178.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.8 m -70.85 -39.21 73.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.436 -0.347 . . . . 1.1699999999999999 111.142 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.552 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 1.2 tmtm? -63.86 -19.14 64.83 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.407 0.622 . . . . 1.21 109.751 174.167 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 33.2 tpp -89.82 -44.73 9.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.591 -0.731 . . . . 1.6899999999999999 110.344 -176.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -67.27 -31.2 71.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.268 0.556 . . . . 4.1500000000000004 109.7 174.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -66.08 -48.27 71.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.339 -0.846 . . . . 0.42999999999999999 111.101 177.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.808 HD11 ' HA ' ' A' ' 6' ' ' CYS . 2.5 mp -67.35 -25.3 65.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.901 0.381 . . . . 1.47 111.018 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -75.63 -35.55 60.44 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.142 -0.481 . . . . 2.46 110.855 177.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.1 p -88.24 1.62 54.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.173 -0.467 . . . . 1.3 111.774 -177.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.73 32.26 0.13 Allowed 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 111.885 0.328 . . . . 0.97999999999999998 111.885 179.294 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -77.99 -154.24 0.07 Allowed 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 109.795 -0.446 . . . . 3.02 109.795 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.4 p -79.22 24.51 0.33 Allowed 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.776 -0.578 . . . . 4.4100000000000001 112.258 -177.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -62.36 -46.39 88.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.297 0.57 . . . . 7.3600000000000003 110.206 176.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 57.6 mttp . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.654 -0.689 . . . . 9.3100000000000005 109.555 173.879 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 70.2 mtm . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 120.932 0.396 . . . . 5.4900000000000002 110.982 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -132.45 153.18 81.1 Favored Pre-proline 0 C--N 1.321 -0.67 0 CA-C-N 115.75 -0.659 . . . . 4.2800000000000002 109.593 176.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.663 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 5.8 Cg_exo -80.62 129.49 7.34 Favored 'Trans proline' 0 N--CA 1.452 -0.962 0 C-N-CA 123.288 2.658 . . . . 1.4399999999999999 111.758 -178.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.527 ' HB3' ' HE3' ' A' ' 19' ' ' LYS . 96.3 m-85 -108.53 129.36 55.3 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 114.705 -1.134 . . . . 1.0600000000000001 111.067 -177.735 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -76.36 133.76 39.86 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.845 -0.428 . . . . 2.3100000000000001 109.845 175.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 1.014 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 44.6 t -82.82 122.96 28.89 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 108.521 -0.918 . . . . 0.45000000000000001 108.521 171.655 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -62.71 -15.24 51.91 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.922 0.712 . . . . 2.46 112.922 -171.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -109.97 -16.77 13.76 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.775 0.798 . . . . 1.01 109.547 -176.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.83 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 12.7 m -99.2 -37.0 9.47 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.882 -1.054 . . . . 0.66000000000000003 111.801 -178.346 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.77 8.57 87.68 Favored Glycine 0 N--CA 1.451 -0.327 0 N-CA-C 111.062 -0.815 . . . . 0.53000000000000003 111.062 -173.41 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 64.3 ttt180 -106.61 137.85 43.87 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.457 -0.372 . . . . 3.1899999999999999 110.59 -173.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.5 m -91.44 114.36 26.87 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.942 -0.572 . . . . 1.23 110.709 -179.03 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 1.014 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 19.1 m-85 -97.17 121.83 39.49 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.747 -0.835 . . . . 0.46999999999999997 108.747 173.702 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.663 ' HA ' ' HA ' ' A' ' 3' ' ' PRO . 34.9 t -82.57 22.0 0.92 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.39 0.614 . . . . 1.51 109.889 178.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.408 ' H ' ' C ' ' A' ' 13' ' ' PHE . 11.7 m-20 -123.53 96.33 43.76 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.385 -0.825 . . . . 1.9199999999999999 109.806 -178.538 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.0 -43.11 62.62 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.439 2.759 . . . . 0.5 113.938 -173.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 94.6 m -82.01 -34.3 29.66 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.145 0.498 . . . . 1.1200000000000001 110.996 -177.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.3 m -77.95 -31.1 50.71 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.667 -0.413 . . . . 1.1699999999999999 110.909 -177.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.76 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 8.8 tmtt? -69.17 -22.17 63.93 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 109.098 -0.704 . . . . 1.21 109.098 171.143 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -77.32 -53.53 7.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.407 -0.815 . . . . 1.6899999999999999 109.525 -174.562 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -67.71 -28.58 67.78 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.661 -0.7 . . . . 4.1500000000000004 110.343 177.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 62.6 t60 -60.62 -46.09 91.57 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.052 0.453 . . . . 0.42999999999999999 109.834 172.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -61.7 -46.95 87.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.808 -0.633 . . . . 1.47 110.44 177.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -56.44 -31.09 63.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.731 0.301 . . . . 2.46 111.576 178.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 96.2 m -74.26 -57.28 4.05 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 112.649 0.611 . . . . 1.3 112.649 -173.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -109.24 25.4 11.85 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 119.676 -0.81 . . . . 0.97999999999999998 112.163 -171.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -97.88 -73.62 0.61 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.325 -0.398 . . . . 3.02 110.065 172.028 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 73.3 p 59.37 142.44 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.527 1.131 . . . . 4.4100000000000001 113.607 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -81.82 -19.33 41.33 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.977 -1.011 . . . . 7.3600000000000003 111.245 -177.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.8 ttpp . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.374 -0.822 . . . . 9.3100000000000005 110.139 -177.41 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.5 mmt . . . . . 0 N--CA 1.482 1.127 0 CA-C-O 121.016 0.436 . . . . 5.4900000000000002 110.755 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.415 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 54.7 pttt -70.39 145.72 93.41 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.602 -0.726 . . . . 4.2800000000000002 110.851 179.326 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 1.2 Cg_endo -85.35 159.31 11.12 Favored 'Trans proline' 0 N--CA 1.45 -1.065 0 C-N-CA 123.392 2.728 . . . . 1.4399999999999999 111.469 -178.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.691 ' HB3' ' HD3' ' A' ' 19' ' ' LYS . 83.6 m-85 -97.58 89.47 4.68 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-O 121.334 0.587 . . . . 1.0600000000000001 111.011 -176.619 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.489 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 37.8 tt0 -71.99 146.1 47.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.335 -0.848 . . . . 2.3100000000000001 111.213 -178.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.878 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 53.4 t -87.35 123.25 32.11 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.568 -0.901 . . . . 0.45000000000000001 108.568 169.594 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -68.17 -8.57 39.82 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 112.043 0.386 . . . . 2.46 112.043 -175.028 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.581 ' CE2' ' HG ' ' A' ' 23' ' ' LEU . 15.5 m-85 -111.11 -6.08 14.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.048 0.451 . . . . 1.01 109.864 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.878 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 11.0 m -120.08 -36.72 3.2 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.825 0.676 . . . . 0.66000000000000003 112.825 -172.566 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.15 -7.95 72.96 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.699 -0.763 . . . . 0.53000000000000003 111.737 -173.527 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.489 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 63.2 ttt180 -80.53 139.7 36.22 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 120.53 0.205 . . . . 3.1899999999999999 110.632 -177.336 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 p -91.51 117.95 30.15 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.987 -0.551 . . . . 1.23 110.743 176.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.749 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 54.5 m-85 -98.69 147.54 24.75 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.69 -0.485 . . . . 0.46999999999999997 109.69 177.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 55.4 m -91.59 2.96 56.1 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.392 -0.596 . . . . 1.51 109.392 176.029 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.587 ' O ' ' HB3' ' A' ' 19' ' ' LYS . 25.2 m-20 -120.98 109.34 35.71 Favored Pre-proline 0 CA--C 1.516 -0.33 0 CA-C-N 115.686 -0.688 . . . . 1.9199999999999999 110.689 -176.012 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.46 ' HG3' ' CE1' ' A' ' 4' ' ' TYR . 25.0 Cg_exo -62.56 -43.49 21.65 Favored 'Trans proline' 0 N--CA 1.464 -0.248 0 C-N-CA 122.454 2.103 . . . . 0.5 111.764 177.608 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.9 m -75.75 -40.01 56.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.728 -0.669 . . . . 1.1200000000000001 111.181 -178.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.567 ' HB2' ' CB ' ' A' ' 15' ' ' ASP . 70.4 m -79.81 -25.13 40.96 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.675 -0.41 . . . . 1.1699999999999999 111.347 -177.38 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.691 ' HD3' ' HB3' ' A' ' 4' ' ' TYR . 6.4 tttp -68.97 -24.32 64.24 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.213 -0.662 . . . . 1.21 109.213 167.438 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 13.9 tpt -80.12 -53.23 6.89 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.666 -0.697 . . . . 1.6899999999999999 110.131 -171.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -60.52 -33.28 72.4 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 121.272 0.558 . . . . 4.1500000000000004 109.614 176.575 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -63.24 -48.07 79.77 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.272 -0.876 . . . . 0.42999999999999999 110.432 175.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.581 ' HG ' ' CE2' ' A' ' 8' ' ' TYR . 0.6 OUTLIER -64.79 -42.19 95.25 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.365 -0.834 . . . . 1.47 111.053 -175.074 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -80.18 -1.24 39.58 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.963 0.357 . . . . 2.46 111.963 -176.533 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 88.6 m -96.46 -40.1 9.24 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.49 -0.484 . . . . 1.3 111.177 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -108.97 14.61 23.98 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 119.499 -0.88 . . . . 0.97999999999999998 112.149 -174.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -67.7 142.22 56.39 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.48 -0.563 . . . . 3.02 109.48 176.313 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 33.6 p -74.7 147.41 41.45 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.228 -0.442 . . . . 4.4100000000000001 111.84 -173.272 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -55.16 -37.84 67.51 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.669 -0.696 . . . . 7.3600000000000003 110.21 173.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 79.1 tttt . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.23 -0.89 . . . . 9.3100000000000005 109.952 177.128 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.1 mmm . . . . . 0 N--CA 1.48 1.054 0 CA-C-O 120.748 0.309 . . . . 5.4900000000000002 110.699 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.786 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 70.2 mmtt -96.71 -59.1 0.17 Allowed Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.392 -0.367 . . . . 4.2800000000000002 111.012 178.706 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.786 ' HD3' ' HB2' ' A' ' 2' ' ' LYS . 7.6 Cg_endo -90.29 140.63 3.26 Favored 'Trans proline' 0 N--CA 1.45 -1.073 0 C-N-CA 122.729 2.286 . . . . 1.4399999999999999 111.835 179.219 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.403 ' HB2' ' CD ' ' A' ' 19' ' ' LYS . 49.5 m-85 -105.37 125.75 51.34 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.55 -0.75 . . . . 1.0600000000000001 109.767 -178.275 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.628 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 19.9 pt20 -76.01 160.1 30.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.303 0.573 . . . . 2.3100000000000001 111.68 -174.156 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.741 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 36.5 t -110.15 121.25 44.82 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.098 -0.704 . . . . 0.45000000000000001 109.098 171.356 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.5 -11.54 35.05 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.359 0.503 . . . . 2.46 112.359 -173.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -103.72 -26.51 12.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.769 0.795 . . . . 1.01 109.193 -178.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.741 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 4.1 m -94.65 -41.09 9.48 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.674 -1.148 . . . . 0.66000000000000003 112.041 -173.225 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.35 11.17 85.76 Favored Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 110.559 -1.017 . . . . 0.53000000000000003 110.559 -166.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -109.95 132.03 54.52 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.786 -0.449 . . . . 3.1899999999999999 109.786 -177.193 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.652 ' HB3' ' HB2' ' A' ' 3' ' ' PRO . 14.4 m -92.84 118.28 30.94 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.501 -0.772 . . . . 1.23 110.646 -177.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.686 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 44.7 m-85 -99.06 122.88 42.89 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.075 -0.713 . . . . 0.46999999999999997 109.075 177.355 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.431 ' HA ' ' HA ' ' A' ' 3' ' ' PRO . 22.7 t -83.17 17.85 1.89 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.182 0.515 . . . . 1.51 109.788 178.323 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -131.06 100.44 17.15 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 109.183 -0.673 . . . . 1.9199999999999999 109.183 -176.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.434 ' O ' ' HB2' ' A' ' 20' ' ' MET . 43.8 Cg_exo -55.73 -43.77 54.29 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.191 2.594 . . . . 0.5 112.797 -175.685 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.8 m -65.97 -42.57 89.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.109 -0.496 . . . . 1.1200000000000001 111.24 -178.236 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.9 m -74.85 -37.49 62.21 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.564 -0.289 . . . . 1.1699999999999999 111.197 -178.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.67 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 26.1 tttp -64.31 -20.24 65.96 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.158 0.504 . . . . 1.21 109.717 174.479 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.434 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 12.8 tpt -85.83 -51.44 6.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.492 -0.776 . . . . 1.6899999999999999 109.734 -173.114 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 48.2 mtp180 -63.32 -37.58 87.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.372 -0.831 . . . . 4.1500000000000004 110.29 175.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -66.18 -38.4 87.94 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.745 -0.661 . . . . 0.42999999999999999 110.512 178.373 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.492 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 3.2 tp -62.72 -43.7 98.14 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.996 0.426 . . . . 1.47 109.987 178.385 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -57.95 -38.71 76.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.406 -0.816 . . . . 2.46 110.902 177.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 16.0 m -77.86 0.25 24.67 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.628 -0.715 . . . . 1.3 111.425 -176.028 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.4 ' HB2' ' O ' ' A' ' 23' ' ' LEU . 12.5 m-70 -78.65 -0.07 28.53 Favored 'General case' 0 C--O 1.234 0.258 0 O-C-N 121.91 -0.494 . . . . 0.97999999999999998 111.716 176.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -82.33 57.01 3.45 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.979 0.895 . . . . 3.02 108.946 172.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 16.2 p -134.52 179.17 6.45 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.867 -1.06 . . . . 4.4100000000000001 110.081 -176.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -97.17 18.11 15.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.219 -0.446 . . . . 7.3600000000000003 110.328 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? . . . . . 0 C--O 1.244 0.809 0 CA-C-N 115.832 -0.622 . . . . 9.3100000000000005 109.809 -178.894 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ttt . . . . . 0 N--CA 1.48 1.048 0 CA-C-O 120.621 0.248 . . . . 5.4900000000000002 111.057 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.47 151.28 58.78 Favored Pre-proline 0 C--N 1.328 -0.354 0 N-CA-C 109.509 -0.552 . . . . 4.2800000000000002 109.509 177.099 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.92 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 7.2 Cg_endo -88.89 137.34 3.25 Favored 'Trans proline' 0 N--CA 1.447 -1.223 0 C-N-CA 123.274 2.649 . . . . 1.4399999999999999 112.165 -176.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -101.42 103.5 14.41 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.044 -0.98 . . . . 1.0600000000000001 109.621 -179.158 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.713 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 20.2 pt20 -71.89 141.42 49.53 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.108 -0.497 . . . . 2.3100000000000001 111.251 -178.382 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.756 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 44.4 t -90.6 130.09 36.66 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.834 -0.621 . . . . 0.45000000000000001 109.759 177.478 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -75.22 -2.65 28.95 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 111.65 0.241 . . . . 2.46 111.65 -175.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -101.76 -32.15 10.42 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 122.202 1.001 . . . . 1.01 108.643 177.525 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.756 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 27.7 m -101.28 -37.57 8.45 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 113.618 -1.628 . . . . 0.66000000000000003 112.563 -167.657 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.69 -2.37 88.14 Favored Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.832 -0.699 . . . . 0.53000000000000003 111.584 -173.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.444 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 75.0 ttt180 -96.17 139.63 32.05 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.944 -0.391 . . . . 3.1899999999999999 109.944 -176.131 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.92 ' HB3' ' HB2' ' A' ' 3' ' ' PRO . 20.0 m -92.73 106.05 18.09 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.028 -0.533 . . . . 1.23 110.457 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.897 ' HB2' ' HB2' ' A' ' 19' ' ' LYS . 50.0 m-85 -88.61 119.78 29.39 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.834 -0.802 . . . . 0.46999999999999997 108.834 177.77 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.573 ' HA ' ' HA ' ' A' ' 3' ' ' PRO . 18.2 t -78.76 8.44 5.43 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.777 0.323 . . . . 1.51 110.612 -176.543 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.457 ' HA ' ' HD2' ' A' ' 16' ' ' PRO . 0.7 OUTLIER -121.03 104.64 41.15 Favored Pre-proline 0 C--N 1.328 -0.329 0 N-CA-C 109.807 -0.442 . . . . 1.9199999999999999 109.807 177.251 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.457 ' HD2' ' HA ' ' A' ' 15' ' ' ASP . 18.3 Cg_endo -57.6 -32.9 95.66 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 123.058 2.506 . . . . 0.5 112.728 -175.272 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.0 m -83.07 -31.92 27.09 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.253 -0.431 . . . . 1.1200000000000001 111.195 -178.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.0 m -81.18 -32.32 33.64 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.936 0.398 . . . . 1.1699999999999999 110.376 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.897 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 7.6 tmtt? -66.76 -19.12 65.68 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.825 -0.625 . . . . 1.21 109.338 170.396 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.408 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 0.1 OUTLIER -87.77 -51.9 5.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.349 -0.841 . . . . 1.6899999999999999 109.2 -177.692 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.475 ' HA ' ' OE1' ' A' ' 24' ' ' GLU . 55.2 ttp180 -54.01 -39.33 65.99 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.759 -0.655 . . . . 4.1500000000000004 110.275 173.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.624 ' HA ' HG22 ' A' ' 25' ' ' THR . 64.7 t60 -69.08 -30.29 68.57 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.451 -0.795 . . . . 0.42999999999999999 110.914 177.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.08 -34.55 75.3 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.471 -0.566 . . . . 1.47 109.471 177.021 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.475 ' OE1' ' HA ' ' A' ' 21' ' ' ARG . 42.4 mt-10 -66.43 -46.67 75.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.667 -0.697 . . . . 2.46 110.691 176.194 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.624 HG22 ' HA ' ' A' ' 22' ' ' HIS . 12.1 t -71.76 -7.34 47.55 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.129 -0.487 . . . . 1.3 111.877 -174.33 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 14.1 m-70 -63.9 -40.45 96.52 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.671 -0.492 . . . . 0.97999999999999998 109.671 172.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -84.74 58.51 4.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.713 -0.676 . . . . 3.02 111.054 -177.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.0 p -129.96 172.63 11.51 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.156 -0.475 . . . . 4.4100000000000001 109.763 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -82.32 37.27 0.5 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.235 0.541 . . . . 7.3600000000000003 110.735 -177.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.0 pttp . . . . . 0 C--O 1.246 0.895 0 CA-C-O 118.071 -0.966 . . . . 9.3100000000000005 110.169 178.352 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.7 ttp . . . . . 0 N--CA 1.482 1.145 0 CA-C-O 120.61 0.243 . . . . 5.4900000000000002 110.641 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.42 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 57.0 mtpt -129.4 115.18 18.39 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 109.962 -0.384 . . . . 4.2800000000000002 109.962 -179.774 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.577 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 11.3 Cg_endo -91.01 133.72 1.66 Allowed 'Trans proline' 0 N--CA 1.448 -1.189 0 C-N-CA 123.618 2.879 . . . . 1.4399999999999999 112.262 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.563 ' HE2' ' HG3' ' A' ' 16' ' ' PRO . 90.8 m-85 -110.64 127.02 55.09 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.208 -0.906 . . . . 1.0600000000000001 109.618 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.746 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 4.8 pp0? -88.2 149.94 23.58 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.303 0.573 . . . . 2.3100000000000001 112.234 -170.783 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 1.015 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 48.6 t -95.03 125.29 39.59 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.631 -0.713 . . . . 0.45000000000000001 109.595 175.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -63.79 -21.61 66.51 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.325 0.491 . . . . 2.46 112.325 -173.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -95.59 -27.88 15.12 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.967 0.889 . . . . 1.01 108.964 -176.085 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.756 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 6.8 m -95.75 -40.46 9.35 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.224 -1.353 . . . . 0.66000000000000003 112.821 -170.467 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.57 10.41 85.87 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.404 -0.903 . . . . 0.53000000000000003 110.907 -171.161 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -105.44 132.97 50.94 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.686 -0.487 . . . . 3.1899999999999999 109.686 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.746 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 19.6 m -96.5 120.12 36.24 Favored 'General case' 0 C--N 1.32 -0.71 0 O-C-N 123.428 0.455 . . . . 1.23 110.485 179.666 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 1.015 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 24.7 m-85 -95.32 126.95 40.98 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.273 -0.64 . . . . 0.46999999999999997 109.273 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.54 ' HA ' ' HA ' ' A' ' 3' ' ' PRO . 28.6 t -77.41 9.95 2.88 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.971 -0.558 . . . . 1.51 111.525 -173.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.42 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 5.0 m-20 -135.31 120.15 13.61 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-O 121.041 0.448 . . . . 1.9199999999999999 110.153 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.563 ' HG3' ' HE2' ' A' ' 4' ' ' TYR . 31.7 Cg_exo -57.2 -53.2 5.14 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 123.574 2.849 . . . . 0.5 112.592 -176.534 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.1 m -55.42 -46.74 76.63 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.354 -0.385 . . . . 1.1200000000000001 111.742 -177.199 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.0 p -84.41 -16.63 42.01 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 120.538 -0.465 . . . . 1.1699999999999999 111.704 -175.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.891 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 10.7 tmtt? -77.63 -23.26 49.8 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 108.611 -0.885 . . . . 1.21 108.611 170.041 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.559 ' HG2' ' O ' ' A' ' 16' ' ' PRO . 77.4 mmm -83.58 -52.57 6.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.343 -0.844 . . . . 1.6899999999999999 110.265 -175.395 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 92.9 mtt-85 -59.83 -30.84 69.22 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.282 0.563 . . . . 4.1500000000000004 110.042 176.403 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.41 ' O ' ' HD2' ' A' ' 26' ' ' HIS . 38.5 t60 -68.58 -41.91 79.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.432 -0.804 . . . . 0.42999999999999999 110.596 178.625 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.468 HD21 ' HA ' ' A' ' 6' ' ' CYS . 2.1 mm? -65.54 -38.98 91.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.937 0.398 . . . . 1.47 110.192 176.659 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 20' ' ' MET . 39.0 mm-40 -62.89 -34.3 77.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.656 -0.702 . . . . 2.46 111.166 177.732 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.4 p -84.51 -0.43 53.04 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.261 0.467 . . . . 1.3 112.261 -176.146 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.41 ' HD2' ' O ' ' A' ' 22' ' ' HIS . 17.7 m-70 -80.5 -25.24 38.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.542 0.687 . . . . 0.97999999999999998 109.148 168.778 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -89.92 80.58 6.41 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.636 -0.875 . . . . 3.02 108.636 172.462 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.5 m -101.01 -65.97 0.94 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.888 -0.596 . . . . 4.4100000000000001 111.381 -172.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -109.47 -63.18 1.39 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.457 0.646 . . . . 7.3600000000000003 110.069 -173.085 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 40.8 pttt . . . . . 0 C--O 1.245 0.849 0 CA-C-N 115.089 -0.959 . . . . 9.3100000000000005 110.111 179.396 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 pmm? . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 120.63 0.252 . . . . 5.4900000000000002 110.687 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.446 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 23.3 tptm -125.87 110.51 24.9 Favored Pre-proline 0 C--N 1.327 -0.4 0 N-CA-C 110.114 -0.328 . . . . 4.2800000000000002 110.114 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 2.1 Cg_endo -86.07 -179.83 3.38 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.359 2.706 . . . . 1.4399999999999999 112.504 -179.032 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -116.88 105.6 12.53 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.413 -0.812 . . . . 1.0600000000000001 109.576 178.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.53 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 43.6 mt-30 -77.11 157.55 30.96 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.522 -0.308 . . . . 2.3100000000000001 110.381 -177.404 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.791 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 45.3 t -88.39 127.68 35.5 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 108.535 -0.913 . . . . 0.45000000000000001 108.535 175.727 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -67.01 -13.23 61.71 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.988 0.736 . . . . 2.46 112.988 -168.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -103.36 -30.28 10.7 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.884 0.85 . . . . 1.01 108.775 177.087 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.791 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 63.4 m -95.21 -40.37 9.61 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.544 -1.207 . . . . 0.66000000000000003 113.721 -166.664 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.76 -3.65 86.86 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.622 -0.799 . . . . 0.53000000000000003 112.116 -176.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.475 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 68.5 ttt180 -76.38 134.35 39.67 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.671 -0.492 . . . . 3.1899999999999999 109.671 176.505 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.53 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 50.2 p -90.96 110.0 21.24 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.051 0.453 . . . . 1.23 110.6 -179.737 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.766 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 69.9 m-85 -88.91 124.76 34.53 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.56 -0.904 . . . . 0.46999999999999997 108.56 174.364 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.0 m -69.43 -6.45 30.29 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.718 -0.674 . . . . 1.51 111.02 -176.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -135.7 124.34 15.66 Favored Pre-proline 0 CA--C 1.516 -0.336 0 CA-C-O 120.804 0.335 . . . . 1.9199999999999999 110.539 -173.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.626 ' O ' ' HB2' ' A' ' 20' ' ' MET . 38.0 Cg_endo -67.4 -23.05 44.62 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.599 2.199 . . . . 0.5 111.425 177.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.8 m -67.53 -54.5 19.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.407 -0.815 . . . . 1.1200000000000001 110.917 179.649 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.8 p -80.78 -28.96 36.18 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.541 -0.3 . . . . 1.1699999999999999 111.272 -176.604 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.711 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 0.3 OUTLIER -65.47 -19.59 66.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.188 0.518 . . . . 1.21 109.898 172.668 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.626 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -84.12 -53.85 5.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.902 -0.59 . . . . 1.6899999999999999 109.456 -177.355 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.494 ' HA ' ' OE1' ' A' ' 24' ' ' GLU . 60.2 ttt180 -57.24 -34.06 68.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.1 -0.5 . . . . 4.1500000000000004 109.9 174.728 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -55.94 -47.49 77.46 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.896 -0.593 . . . . 0.42999999999999999 110.684 174.371 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.35 -29.3 68.81 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.277 -0.42 . . . . 1.47 110.678 -179.202 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.494 ' OE1' ' HA ' ' A' ' 21' ' ' ARG . 47.5 mt-10 -68.84 -56.91 6.47 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.176 0.512 . . . . 2.46 111.011 174.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.2 t -78.76 3.62 16.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.908 -0.587 . . . . 1.3 111.739 -174.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -66.21 4.11 0.76 Allowed 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 113.326 0.862 . . . . 0.97999999999999998 113.326 -171.571 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.4 t70 64.53 39.05 6.99 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.623 0.725 . . . . 3.02 109.687 -179.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.45 119.25 21.5 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.373 -0.83 . . . . 4.4100000000000001 110.778 -178.817 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -85.94 9.14 17.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.635 -0.711 . . . . 7.3600000000000003 111.378 -173.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.7 mttm . . . . . 0 C--O 1.246 0.907 0 CA-C-O 118.906 -0.569 . . . . 9.3100000000000005 110.349 -178.734 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.425 ' CZ ' ' HG3' ' A' ' 16' ' ' PRO . 59.0 m-85 . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 121.53 0.681 . . . . 1.06 109.332 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.424 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 18.2 pt20 -85.92 154.64 21.36 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.075 -0.966 . . . . 2.31 111.401 -175.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.765 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 51.6 t -93.08 130.86 38.55 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.185 -0.462 . . . . 0.45 110.297 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -61.95 -22.9 66.02 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.723 -0.671 . . . . 2.46 112.69 -173.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -103.69 -23.69 13.42 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.595 0.712 . . . . 1.01 109.462 -174.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.765 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 47.3 m -98.58 -28.86 13.38 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.648 -1.16 . . . . 0.66 112.358 -171.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.97 3.92 57.39 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.747 -0.74 . . . . 0.53 111.796 -175.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.424 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 5.0 tpm_? -90.09 128.35 36.29 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 109.716 -0.476 . . . . 3.19 109.716 -177.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 3.4 p -85.87 116.83 24.35 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.482 -0.781 . . . . 1.23 110.574 179.193 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.725 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 49.9 m-85 -96.57 127.86 42.96 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.719 -0.845 . . . . 0.47 108.719 173.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.2 m -82.69 5.58 20.8 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.032 0.444 . . . . 1.51 110.737 -178.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 3.4 t70 -138.15 122.84 12.0 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 115.79 -0.641 . . . . 1.92 110.31 -177.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.539 ' O ' ' HB2' ' A' ' 20' ' ' MET . 19.7 Cg_exo -65.42 -24.71 56.75 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 123.169 2.579 . . . . 0.5 112.424 -178.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -68.67 -54.85 13.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.219 -0.446 . . . . 1.12 110.926 -177.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.3 p -73.2 -31.0 63.93 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.391 -0.368 . . . . 1.17 111.152 -179.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.655 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 1.5 tmtm? -65.8 -19.34 65.85 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.457 -0.572 . . . . 1.21 109.457 172.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.539 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 11.7 tpt -86.79 -53.59 4.84 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.335 -0.617 . . . . 1.69 109.335 -177.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.497 HH21 ' CD ' ' A' ' 24' ' ' GLU . 2.8 mmp_? -54.47 -44.75 72.86 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.568 -0.742 . . . . 4.15 110.365 175.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 56.0 t60 -62.14 -34.57 76.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.078 -0.51 . . . . 0.43 111.187 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -79.5 -33.5 42.07 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.992 -0.283 . . . . 1.47 111.704 -177.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.497 ' CD ' HH21 ' A' ' 21' ' ' ARG . 16.5 pt-20 -85.41 -32.59 22.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.734 0.302 . . . . 2.46 111.163 -178.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 32.9 m -84.64 -3.68 58.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.363 0.601 . . . . 1.3 110.45 177.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.225 0 N-CA-C 109.028 -0.73 . . . . 0.98 109.028 169.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 . . . . . 0 N--CA 1.451 -0.421 0 N-CA-C 109.238 -0.653 . . . . 1.06 109.238 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.501 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 16.5 pt20 -72.16 159.93 33.29 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.515 -0.766 . . . . 2.31 110.827 -177.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.971 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 8.6 t -83.11 128.61 34.63 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.238 -1.023 . . . . 0.45 108.238 178.176 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . 0.47 ' H ' HD11 ' A' ' 23' ' ' LEU . 12.6 m-20 -66.34 -6.29 13.67 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 112.856 0.688 . . . . 2.46 112.856 -171.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -111.72 -13.71 13.7 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.314 0.578 . . . . 1.01 109.982 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.867 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 74.9 m -119.31 -36.56 3.34 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.638 -0.71 . . . . 0.66 112.868 -163.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.9 -16.01 39.7 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.432 -0.89 . . . . 0.53 112.009 -176.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.501 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 72.6 ttt180 -62.69 135.4 57.35 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.936 -0.394 . . . . 3.19 109.936 177.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 p -89.44 113.06 24.35 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.212 0.529 . . . . 1.23 111.994 -174.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.971 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 69.4 m-85 -99.26 131.28 45.39 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.582 -0.895 . . . . 0.47 108.582 172.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.5 m -79.67 4.33 16.43 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.386 -0.37 . . . . 1.51 110.543 -176.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -131.3 115.83 16.35 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.448 -0.342 . . . . 1.92 110.72 -174.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -61.8 -34.92 81.56 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 123.028 2.486 . . . . 0.5 112.069 -178.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.9 p -70.9 -45.79 63.69 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.195 0.521 . . . . 1.12 110.474 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.4 m -71.65 -36.72 70.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.059 -0.519 . . . . 1.17 111.064 -177.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.724 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 0.2 OUTLIER -65.95 -19.42 65.86 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.82 -0.437 . . . . 1.21 109.82 174.105 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 13.7 tpt -90.6 -46.34 8.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.872 -0.604 . . . . 1.69 110.488 -174.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.8 mmm180 -64.05 -36.11 82.92 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.663 -0.495 . . . . 4.15 109.663 176.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 44.0 t60 -70.18 -35.52 74.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.896 -0.593 . . . . 0.43 110.372 176.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.542 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 5.2 tp -57.87 -58.59 7.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.578 -0.737 . . . . 1.47 110.72 -178.174 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -64.14 -33.49 75.91 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.474 -0.785 . . . . 2.46 111.703 -176.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 25.9 m -74.15 -5.35 41.26 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.882 0.372 . . . . 1.3 111.416 -176.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 13.6 m-70 . . . . . 0 N--CA 1.463 0.195 0 CA-C-O 120.865 0.364 . . . . 0.98 110.345 173.285 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 . . . . . 0 N--CA 1.45 -0.458 0 CA-C-O 121.045 0.45 . . . . 1.06 110.805 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.601 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 8.6 tt0 -73.92 142.29 45.94 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.42 -0.809 . . . . 2.31 111.508 -176.166 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.973 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 8.4 t -77.0 122.13 24.48 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 108.341 -0.985 . . . . 0.45 108.341 174.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -64.47 -8.15 12.59 Favored 'General case' 0 C--N 1.319 -0.744 0 O-C-N 123.802 0.689 . . . . 2.46 112.732 -170.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -111.58 -21.74 11.59 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 121.135 0.493 . . . . 1.01 110.051 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.558 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 63.4 m -114.48 -29.76 6.75 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.312 0.856 . . . . 0.66 113.312 -163.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.6 -8.66 78.56 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.417 -0.897 . . . . 0.53 112.772 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -78.86 135.65 37.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.726 0.263 . . . . 3.19 110.719 177.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.601 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 36.9 m -99.59 116.31 31.43 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.855 0.359 . . . . 1.23 110.803 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.973 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 42.3 m-85 -94.62 128.74 41.47 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.29 -0.633 . . . . 0.47 109.29 177.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.1 t -84.16 17.4 2.51 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.62 0.724 . . . . 1.51 110.14 -178.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.419 ' HA ' ' HD2' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -125.78 102.79 28.3 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 115.47 -0.786 . . . . 1.92 109.78 177.584 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.53 ' O ' ' HB2' ' A' ' 20' ' ' MET . 12.0 Cg_endo -55.35 -38.41 93.85 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 123.496 2.798 . . . . 0.5 112.452 -176.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.5 m -74.97 -36.02 62.05 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.136 -0.483 . . . . 1.12 110.918 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.5 t -76.98 -41.9 41.13 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 120.99 -0.284 . . . . 1.17 110.385 -176.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.851 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 2.7 tmtm? -63.79 -18.01 63.66 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.415 0.626 . . . . 1.21 109.828 175.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.53 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 0.2 OUTLIER -84.19 -53.56 5.42 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.472 -0.785 . . . . 1.69 109.484 -175.286 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 53.2 mtp180 -70.13 -20.53 63.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.918 -0.583 . . . . 4.15 110.444 175.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.428 ' CD2' ' SG ' ' A' ' 6' ' ' CYS . 63.1 t60 -66.89 -42.94 84.68 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.033 -0.531 . . . . 0.43 109.641 173.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.1 -38.08 89.77 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.257 0.551 . . . . 1.47 109.696 174.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -60.64 -41.27 94.61 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.099 -0.955 . . . . 2.46 111.207 177.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.0 p -84.37 0.41 49.43 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.545 0.572 . . . . 1.3 112.545 -174.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.8 m-70 . . . . . 0 C--N 1.33 -0.277 0 CA-C-O 121.029 0.442 . . . . 0.98 110.472 173.825 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.669 ' HB3' ' HD2' ' A' ' 19' ' ' LYS . 80.8 m-85 . . . . . 0 N--CA 1.455 -0.19 0 CA-C-O 121.299 0.571 . . . . 1.06 110.575 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.799 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 36.6 tt0 -76.53 139.4 40.72 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.467 -0.788 . . . . 2.31 110.792 -176.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 1.029 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 50.0 t -80.44 119.6 23.34 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.923 -0.769 . . . . 0.45 108.923 176.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -64.12 -6.3 6.28 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.755 1.02 . . . . 2.46 113.755 -170.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -109.09 -33.39 6.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.946 0.879 . . . . 1.01 109.075 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.795 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 7.0 m -85.96 -40.32 15.98 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.388 -1.278 . . . . 0.66 112.162 -170.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.75 -1.5 88.05 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 110.714 -0.954 . . . . 0.53 110.714 -169.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.1 tpt180 -89.5 129.23 36.02 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.067 -0.716 . . . . 3.19 109.067 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.799 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 0.8 OUTLIER -98.57 118.0 34.29 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 120.932 0.396 . . . . 1.23 110.665 -175.903 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 1.029 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 24.8 m-85 -97.53 129.22 44.7 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.091 -0.707 . . . . 0.47 109.091 178.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 59.1 m -78.26 4.46 12.71 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.53 -0.305 . . . . 1.51 111.467 -177.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.509 ' HB3' ' HB3' ' A' ' 18' ' ' SER . 11.7 t70 -120.06 113.63 34.09 Favored Pre-proline 0 C--N 1.33 -0.281 0 C-N-CA 120.947 -0.301 . . . . 1.92 110.505 -178.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.516 ' O ' ' HB2' ' A' ' 20' ' ' MET . 28.1 Cg_endo -62.51 -32.77 80.07 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 123.201 2.601 . . . . 0.5 113.035 -176.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 35.8 m -80.46 -45.08 18.18 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.099 0.476 . . . . 1.12 110.652 -178.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.509 ' HB3' ' HB3' ' A' ' 15' ' ' ASP . 40.9 t -70.17 -37.14 75.1 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.002 -0.544 . . . . 1.17 110.905 -178.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.886 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 6.8 tmtt? -67.15 -18.86 65.47 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.115 0.483 . . . . 1.21 109.835 174.351 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.516 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 10.6 tpt -86.86 -43.9 12.11 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.375 -0.602 . . . . 1.69 109.375 -174.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.0 ttt85 -63.33 -38.37 90.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.601 -0.727 . . . . 4.15 109.378 174.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -63.34 -38.63 91.89 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.301 -0.863 . . . . 0.43 110.81 177.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.03 -36.69 84.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.998 0.428 . . . . 1.47 110.433 176.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -70.37 -29.46 66.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.195 0.522 . . . . 2.46 110.498 175.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.0 m -66.53 -27.18 67.56 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.673 -0.694 . . . . 1.3 110.592 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 . . . . . 0 N--CA 1.464 0.255 0 CA-C-N 116.057 -0.52 . . . . 0.98 112.004 -179.336 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.596 ' HB3' ' HE2' ' A' ' 19' ' ' LYS . 64.9 m-85 . . . . . 0 C--O 1.222 -0.394 0 N-CA-C 108.522 -0.918 . . . . 1.06 108.522 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.426 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 9.3 pt20 -116.32 161.1 19.54 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.91 -0.316 . . . . 2.31 111.138 -177.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.898 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 43.5 t -88.22 121.18 30.32 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.659 -1.237 . . . . 0.45 107.659 172.088 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -65.45 -1.65 2.68 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 113.649 0.981 . . . . 2.46 113.649 -171.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -108.53 -24.14 11.53 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.491 0.662 . . . . 1.01 109.339 174.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.77 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 92.9 m -110.22 -35.15 6.17 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.0 -1.0 . . . . 0.66 113.069 -166.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.0 -11.44 57.31 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.899 -0.667 . . . . 0.53 112.191 -175.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.426 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 9.8 ttp180 -70.07 141.77 52.76 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 110.353 -0.24 . . . . 3.19 110.353 -178.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.535 ' HA ' ' O ' ' A' ' 4' ' ' TYR . 31.9 m -90.06 113.62 25.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.122 0.487 . . . . 1.23 111.811 -176.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.898 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 46.1 m-85 -101.29 119.46 38.79 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.099 -1.074 . . . . 0.47 108.099 170.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.0 p -87.12 21.5 2.34 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.374 0.607 . . . . 1.51 110.41 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -137.36 96.85 10.85 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 115.202 -0.908 . . . . 1.92 110.002 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -57.03 -43.39 54.31 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.657 2.905 . . . . 0.5 113.863 -172.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.4 ' O ' ' HB3' ' A' ' 20' ' ' MET . 9.0 t -62.18 -44.35 96.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.261 0.553 . . . . 1.12 111.682 -176.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.09 -28.93 39.0 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.284 -0.416 . . . . 1.17 111.297 -179.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.596 ' HE2' ' HB3' ' A' ' 4' ' ' TYR . 7.9 tttp -65.84 -20.25 66.17 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.411 -0.589 . . . . 1.21 109.411 168.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.4 ' HB3' ' O ' ' A' ' 17' ' ' THR . 1.1 tmt? -82.46 -50.25 9.06 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 109.087 -0.708 . . . . 1.69 109.087 -177.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.7 mmm180 -64.66 -29.58 70.58 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.712 -0.676 . . . . 4.15 110.081 175.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -64.32 -40.54 96.11 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.734 -0.667 . . . . 0.43 110.371 175.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -68.16 -31.53 71.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.011 0.434 . . . . 1.47 110.535 177.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -65.48 -50.64 64.57 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.065 -0.516 . . . . 2.46 110.994 176.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 17.2 p -76.6 -5.38 47.49 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.549 0.574 . . . . 1.3 112.549 -174.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 . . . . . 0 C--N 1.332 -0.194 0 N-CA-C 109.879 -0.415 . . . . 0.98 109.879 173.164 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 . . . . . 0 N--CA 1.454 -0.238 0 CA-C-O 121.214 0.53 . . . . 1.06 110.462 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -82.83 141.16 32.49 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.637 -0.711 . . . . 2.31 111.939 -172.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.96 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 22.5 t -77.45 133.21 38.67 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.355 -0.98 . . . . 0.45 108.355 176.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -55.6 -27.65 50.71 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.986 0.736 . . . . 2.46 112.986 -168.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -111.25 -9.27 14.31 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.241 -0.584 . . . . 1.01 110.753 -175.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.882 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 94.9 m -111.32 -37.95 5.13 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 113.929 1.085 . . . . 0.66 113.929 -165.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.02 -20.15 30.57 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 119.959 -1.115 . . . . 0.53 111.879 -174.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.6 ttt180 -64.49 137.2 57.74 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.828 0.347 . . . . 3.19 110.411 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 11.2 m -95.28 112.16 23.91 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.653 -0.703 . . . . 1.23 111.2 -176.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.96 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 60.8 m-85 -97.17 122.8 40.6 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.752 -0.833 . . . . 0.47 108.752 174.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.6 m -81.96 10.58 6.25 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.129 0.49 . . . . 1.51 110.851 -176.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -133.31 108.48 12.36 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.93 -0.577 . . . . 1.92 109.816 178.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.435 ' O ' ' HB2' ' A' ' 20' ' ' MET . 35.4 Cg_endo -65.05 -26.43 58.14 Favored 'Trans proline' 0 CA--C 1.527 0.163 0 C-N-CA 123.004 2.469 . . . . 0.5 113.106 -174.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 16.7 m -76.84 -45.89 26.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.848 0.356 . . . . 1.12 111.238 -176.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.0 p -77.51 -31.08 53.29 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.701 -0.399 . . . . 1.17 110.941 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 19.9 tttm -66.18 -19.22 65.77 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 121.216 0.532 . . . . 1.21 109.645 171.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.435 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 43.5 tpp -78.41 -49.96 12.58 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.309 -0.626 . . . . 1.69 109.309 -177.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.3 mmt85 -63.92 -33.53 75.92 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.704 -0.68 . . . . 4.15 109.93 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 79.2 t60 -62.01 -43.68 98.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.732 -0.667 . . . . 0.43 110.445 175.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.99 -40.95 90.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.17 0.51 . . . . 1.47 109.771 177.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.86 -35.02 79.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.445 -0.798 . . . . 2.46 111.025 177.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 59.9 m -67.07 -25.79 66.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 1.3 111.026 -178.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 57.1 m-70 . . . . . 0 C--N 1.325 -0.484 0 CA-C-O 121.092 0.472 . . . . 0.98 110.429 176.498 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.607 ' CE1' ' HG3' ' A' ' 16' ' ' PRO . 75.6 m-85 . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 109.371 -0.603 . . . . 1.06 109.371 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.4 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 25.2 mt-30 -83.1 150.94 25.97 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.603 -0.726 . . . . 2.31 111.725 -173.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.764 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 51.1 t -99.56 111.45 23.79 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 115.428 -0.805 . . . . 0.45 108.943 174.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.79 0.49 2.37 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.765 0.654 . . . . 2.46 112.765 -175.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -105.06 -21.24 13.31 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.938 -0.764 . . . . 1.01 108.938 175.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.764 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 4.1 m -103.52 -37.35 7.6 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.632 -1.167 . . . . 0.66 111.832 -174.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.39 13.54 83.14 Favored Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 111.178 -0.769 . . . . 0.53 111.178 -171.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.4 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 48.7 ttt180 -107.17 141.58 38.21 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 110.438 -0.208 . . . . 3.19 110.438 -175.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.6 m -93.33 115.21 27.78 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 123.382 0.426 . . . . 1.23 110.693 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.614 ' HB2' ' HB2' ' A' ' 19' ' ' LYS . 11.6 m-85 -95.53 133.82 39.1 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.791 -0.818 . . . . 0.47 108.791 175.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.9 t -90.65 6.08 45.39 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.211 0.529 . . . . 1.51 110.011 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -123.83 106.55 31.68 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.939 -0.573 . . . . 1.92 110.101 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.607 ' HG3' ' CE1' ' A' ' 4' ' ' TYR . 38.7 Cg_exo -59.56 -42.95 42.96 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 123.184 2.59 . . . . 0.5 112.817 -175.093 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 59.4 m -69.53 -44.3 71.25 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.003 0.43 . . . . 1.12 111.317 -176.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 12.9 m -75.0 -32.61 61.69 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.628 -0.429 . . . . 1.17 110.879 -178.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 8.7 tmtt? -67.12 -20.58 65.8 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 109.415 -0.587 . . . . 1.21 109.415 173.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.422 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 4.1 tmm? -81.08 -53.92 5.99 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.813 -0.81 . . . . 1.69 108.813 -175.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.2 mmt180 -58.24 -36.11 72.72 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.334 -0.848 . . . . 4.15 110.026 174.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -62.6 -43.35 99.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.709 -0.678 . . . . 0.43 111.029 177.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.1 mp -62.06 -39.53 92.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.905 0.383 . . . . 1.47 110.24 177.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -65.21 -28.2 69.21 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.842 -0.617 . . . . 2.46 110.546 177.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 20.8 m -72.34 -16.87 61.88 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.902 -0.59 . . . . 1.3 110.512 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 34.8 m-70 . . . . . 0 C--O 1.235 0.309 0 CA-C-O 121.096 0.474 . . . . 0.98 110.171 175.036 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.484 ' HB2' ' HD3' ' A' ' 19' ' ' LYS . 83.0 m-85 . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 109.687 -0.486 . . . . 1.06 109.687 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.501 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 73.7 mt-30 -82.53 137.09 34.7 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.474 0.654 . . . . 2.31 112.241 -170.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.942 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 52.6 t -76.66 123.47 26.19 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.475 -0.784 . . . . 0.45 108.964 176.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -63.17 -12.68 29.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.024 0.75 . . . . 2.46 113.024 -171.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -107.56 -23.69 12.06 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.657 0.741 . . . . 1.01 109.549 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.791 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 11.8 m -98.16 -41.49 7.88 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.83 -1.077 . . . . 0.66 112.958 -172.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.31 -10.0 65.3 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 111.017 -0.833 . . . . 0.53 111.017 -167.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -79.14 134.43 36.71 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 122.838 0.455 . . . . 3.19 110.19 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.501 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 47.3 p -95.21 122.93 38.41 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.126 -0.488 . . . . 1.23 111.372 -177.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.942 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 19.3 m-85 -104.04 124.03 48.29 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.463 -0.94 . . . . 0.47 108.463 173.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.0 m -80.49 13.36 2.51 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.113 0.482 . . . . 1.51 111.03 -175.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -136.18 115.53 10.99 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.158 -0.474 . . . . 1.92 110.154 -179.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.606 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 48.0 Cg_exo -56.62 -40.19 86.15 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.464 2.776 . . . . 0.5 112.673 -177.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 m -73.08 -40.25 65.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.94 0.4 . . . . 1.12 111.19 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.3 m -73.76 -32.37 63.78 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.085 0.469 . . . . 1.17 110.425 -178.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.781 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 15.0 ttpp -69.59 -18.89 63.65 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.688 -0.687 . . . . 1.21 109.683 171.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 43.1 ttm -87.45 -47.95 8.35 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.835 -0.62 . . . . 1.69 110.57 -173.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -59.25 -38.94 81.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.347 0.594 . . . . 4.15 109.568 172.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -60.04 -48.48 81.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.19 -0.913 . . . . 0.43 110.897 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.461 HD23 ' O ' ' A' ' 19' ' ' LYS . 2.7 mm? -64.34 -34.19 77.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.918 0.39 . . . . 1.47 111.006 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -66.76 -21.07 66.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.197 0.523 . . . . 2.46 110.887 178.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.1 m -98.07 0.25 45.8 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.38 0.609 . . . . 1.3 110.71 -178.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 . . . . . 0 C--O 1.235 0.294 0 CA-C-N 116.429 -0.351 . . . . 0.98 111.775 -178.692 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 . . . . . 0 N--CA 1.448 -0.572 0 CA-C-O 121.116 0.484 . . . . 1.06 110.062 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.564 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 0.5 OUTLIER -77.65 152.81 33.63 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.726 -0.67 . . . . 2.31 110.335 -179.815 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.991 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 21.5 t -84.13 129.41 34.9 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.201 -1.037 . . . . 0.45 108.201 177.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . 0.422 ' OD1' HD21 ' A' ' 23' ' ' LEU . 2.3 m-20 -54.98 -23.05 17.34 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 113.431 0.9 . . . . 2.46 113.431 -169.002 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -111.07 -16.58 13.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.361 0.6 . . . . 1.01 110.093 -178.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.911 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 83.6 m -105.89 -33.53 7.93 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.459 -0.792 . . . . 0.66 112.931 -167.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.33 -10.59 35.03 Favored Glycine 0 CA--C 1.517 0.202 0 C-N-CA 120.795 -0.717 . . . . 0.53 112.104 -176.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.564 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 30.4 ttm180 -63.46 135.9 57.23 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 122.616 0.367 . . . . 3.19 110.416 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.2 m -89.94 103.67 16.31 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 123.369 0.418 . . . . 1.23 111.043 -176.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.991 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 61.8 m-85 -91.43 119.4 31.38 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.334 -0.987 . . . . 0.47 108.334 173.563 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.7 p -77.32 12.62 1.44 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.076 -0.511 . . . . 1.51 111.333 -175.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.554 ' HB2' ' HB2' ' A' ' 18' ' ' SER . 8.5 m-20 -131.32 114.94 16.08 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 116.199 -0.455 . . . . 1.92 109.946 -176.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -57.57 -46.34 27.89 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 123.329 2.686 . . . . 0.5 112.523 -178.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 57.6 m -70.32 -35.92 73.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.746 0.308 . . . . 1.12 110.995 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.554 ' HB2' ' HB2' ' A' ' 15' ' ' ASP . 6.3 m -75.8 -35.52 60.03 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.785 -0.366 . . . . 1.17 111.324 -176.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.788 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 1.6 tmtm? -67.26 -18.41 65.2 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.207 -0.664 . . . . 1.21 109.207 173.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 11.5 tpt -88.43 -48.65 7.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.206 -0.906 . . . . 1.69 109.962 -179.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.2 ttp180 -57.84 -41.22 81.88 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-O 121.509 0.671 . . . . 4.15 109.325 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 75.2 t60 -61.73 -38.39 87.73 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.163 -0.926 . . . . 0.43 111.227 178.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.422 HD21 ' OD1' ' A' ' 7' ' ' ASP . 1.2 mp -62.53 -43.57 98.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.929 0.395 . . . . 1.47 110.394 177.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -63.67 -32.45 73.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.779 -0.646 . . . . 2.46 110.353 176.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 24.1 m -74.46 -14.87 60.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.871 -0.604 . . . . 1.3 111.32 -177.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 . . . . . 0 CA--C 1.521 -0.166 0 CA-C-O 120.749 0.309 . . . . 0.98 111.33 177.37 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 . . . . . 0 N--CA 1.452 -0.336 0 N-CA-C 109.863 -0.421 . . . . 1.06 109.863 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.499 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 60.6 mt-30 -84.35 148.31 26.7 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.087 0.47 . . . . 2.31 112.09 -170.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 1.004 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 42.8 t -81.49 123.11 28.33 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.23 -1.026 . . . . 0.45 108.23 176.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -64.21 -9.53 17.69 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.744 0.646 . . . . 2.46 112.744 -171.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.475 ' HE2' ' HG ' ' A' ' 23' ' ' LEU . 1.2 m-85 -106.88 -17.07 14.3 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 109.205 -0.665 . . . . 1.01 109.205 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.797 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 71.6 m -115.47 -40.5 3.4 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 113.649 0.981 . . . . 0.66 113.649 -168.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.59 -13.13 64.87 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.558 -0.829 . . . . 0.53 111.77 -174.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 64.8 ttt180 -69.58 137.0 52.0 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.94 -0.393 . . . . 3.19 109.94 177.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.485 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 8.8 m -98.19 112.15 24.23 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.168 -0.469 . . . . 1.23 111.178 -175.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 1.004 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 50.1 m-85 -95.92 123.94 39.72 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.394 -0.595 . . . . 0.47 109.394 176.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.6 t -80.88 10.25 5.29 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.932 0.396 . . . . 1.51 110.508 -176.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.684 ' HB2' ' OG ' ' A' ' 18' ' ' SER . 8.0 m-20 -130.64 110.05 16.01 Favored Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 109.546 -0.539 . . . . 1.92 109.546 -177.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.482 ' O ' ' HB2' ' A' ' 20' ' ' MET . 31.2 Cg_exo -59.39 -32.85 97.25 Favored 'Trans proline' 0 C--O 1.225 -0.14 0 C-N-CA 122.731 2.287 . . . . 0.5 112.018 179.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.0 p -70.54 -43.08 70.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.84 -0.618 . . . . 1.12 111.806 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.684 ' OG ' ' HB2' ' A' ' 15' ' ' ASP . 81.1 p -77.33 -38.48 50.31 Favored 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 120.53 -0.468 . . . . 1.17 110.391 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.576 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 23.8 tttm -63.46 -18.81 64.15 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-O 121.067 0.461 . . . . 1.21 110.007 173.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.482 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 14.7 tpt -80.85 -54.26 5.75 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.5 -0.556 . . . . 1.69 109.5 -177.277 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 21' ' ' ARG . 52.9 mtm180 -69.49 -20.75 63.73 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.167 0.508 . . . . 4.15 110.287 176.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 78.4 t60 -71.75 -43.13 66.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.07 -0.514 . . . . 0.43 110.541 174.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.475 ' HG ' ' HE2' ' A' ' 8' ' ' TYR . 1.4 mp -63.16 -32.07 73.36 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.777 -0.453 . . . . 1.47 109.777 176.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -67.53 -29.93 69.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.732 -0.667 . . . . 2.46 110.828 172.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 54.4 m -69.81 -24.49 63.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.08 0.467 . . . . 1.3 110.65 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 . . . . . 0 C--O 1.235 0.325 0 CA-C-N 116.346 -0.388 . . . . 0.98 110.331 177.31 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.672 ' HB3' ' CD ' ' A' ' 19' ' ' LYS . 77.4 m-85 . . . . . 0 N--CA 1.452 -0.357 0 CA-C-O 121.096 0.474 . . . . 1.06 111.398 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.464 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 22.1 mt-30 -86.83 160.22 18.83 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.852 -0.613 . . . . 2.31 111.318 -176.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.993 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 35.9 t -90.1 119.95 30.87 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 107.898 -1.149 . . . . 0.45 107.898 174.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -69.32 0.07 5.53 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.722 0.638 . . . . 2.46 112.722 -171.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.4 m-30 -103.51 -23.77 13.48 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.951 -0.759 . . . . 1.01 108.951 173.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.789 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 88.4 m -114.0 -40.41 3.74 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.876 -1.056 . . . . 0.66 113.549 -164.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.88 -15.54 61.52 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.769 -0.729 . . . . 0.53 112.017 -174.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.464 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 61.1 ttt180 -67.42 138.7 56.86 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.184 0.193 . . . . 3.19 110.578 -179.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.6 m -94.62 122.64 37.43 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.419 -0.355 . . . . 1.23 110.936 -177.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.993 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 84.0 m-85 -101.64 139.63 37.03 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.821 -0.627 . . . . 0.47 109.432 176.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.7 p -80.79 2.54 25.85 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.621 -0.718 . . . . 1.51 110.828 -176.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.857 ' HB2' ' HB3' ' A' ' 18' ' ' SER . 8.4 m-20 -134.24 118.02 13.77 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.336 -0.393 . . . . 1.92 110.216 -174.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.466 ' O ' ' HG3' ' A' ' 20' ' ' MET . 18.5 Cg_endo -60.6 -40.82 52.71 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 123.051 2.5 . . . . 0.5 112.605 -178.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 88.7 m -80.51 -31.12 37.21 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.698 0.285 . . . . 1.12 110.732 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.857 ' HB3' ' HB2' ' A' ' 15' ' ' ASP . 25.7 t -74.49 -37.5 63.13 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 120.661 -0.416 . . . . 1.17 109.906 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.672 ' CD ' ' HB3' ' A' ' 4' ' ' TYR . 8.8 tttp -57.8 -28.64 64.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.077 -0.511 . . . . 1.21 109.686 170.144 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.47 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 61.2 mtp -84.44 -45.69 12.44 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 116.046 -0.525 . . . . 1.69 110.335 -173.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -62.93 -31.68 72.82 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.54 -0.754 . . . . 4.15 109.636 174.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 67.5 t60 -63.05 -46.36 87.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.491 -0.777 . . . . 0.43 110.626 173.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.458 HD23 ' O ' ' A' ' 19' ' ' LYS . 2.3 mm? -59.27 -38.82 81.04 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.475 -0.33 . . . . 1.47 110.665 178.276 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 20' ' ' MET . 48.4 mt-10 -63.19 -34.14 76.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.237 -0.438 . . . . 2.46 110.281 176.09 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.9 m -76.69 -8.46 57.32 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.822 -0.626 . . . . 1.3 110.838 -178.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 . . . . . 0 C--N 1.329 -0.321 0 CA-C-O 120.939 0.399 . . . . 0.98 110.249 173.481 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 N--CA 1.448 -0.527 0 CA-C-O 121.143 0.497 . . . . 1.06 109.842 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.521 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 4.7 pp0? -72.1 146.45 47.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.492 -0.776 . . . . 2.31 110.356 -179.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 1.062 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 48.8 t -81.27 122.53 27.54 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.269 -0.641 . . . . 0.45 109.269 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -59.91 -17.35 36.73 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.495 0.554 . . . . 2.46 112.495 -172.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -98.79 -25.4 14.66 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.657 0.742 . . . . 1.01 109.527 -178.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.859 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 35.6 m -107.61 -40.92 5.18 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.689 -1.141 . . . . 0.66 113.147 -164.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.54 -12.39 65.31 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.641 -0.79 . . . . 0.53 111.599 -171.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.437 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 14.2 tpp180 -69.34 129.91 41.11 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 122.534 0.333 . . . . 3.19 110.186 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.521 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 19.6 m -89.8 110.2 21.14 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.086 -0.506 . . . . 1.23 111.174 -178.046 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 1.062 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 25.8 m-85 -94.08 135.12 35.78 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.744 -0.835 . . . . 0.47 108.744 173.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.3 m -90.06 5.31 47.24 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 121.068 0.461 . . . . 1.51 110.475 -176.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.443 ' HA ' ' HD2' ' A' ' 16' ' ' PRO . 35.2 m-20 -123.51 109.45 30.76 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.941 -0.572 . . . . 1.92 110.39 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.474 ' O ' ' HB2' ' A' ' 20' ' ' MET . 19.2 Cg_endo -58.43 -40.95 70.24 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.252 2.635 . . . . 0.5 113.064 -176.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.2 m -72.21 -40.58 67.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.24 0.543 . . . . 1.12 110.479 -178.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.6 t -74.9 -37.95 61.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.039 -0.528 . . . . 1.17 110.187 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.797 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 7.8 tmtt? -63.27 -20.75 65.74 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.283 0.563 . . . . 1.21 109.766 172.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.474 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 9.7 tpt -89.85 -37.57 14.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.832 -0.622 . . . . 1.69 109.955 -173.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 78.5 mtp180 -69.79 -35.13 74.61 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.854 -0.612 . . . . 4.15 109.578 171.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 48.5 t60 -60.53 -43.93 96.6 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.482 -0.781 . . . . 0.43 109.735 172.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' A' ' 26' ' ' HIS . 6.4 tp -63.13 -36.95 85.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.076 -0.511 . . . . 1.47 110.293 178.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -64.14 -37.27 86.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.402 -0.817 . . . . 2.46 110.418 176.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 6.3 m -78.47 0.47 25.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.895 -0.593 . . . . 1.3 110.818 -178.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.435 ' HB2' ' O ' ' A' ' 23' ' ' LEU . 1.7 m-70 . . . . . 0 C--N 1.331 -0.225 0 O-C-N 122.032 -0.417 . . . . 0.98 112.057 -178.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 . . . . . 0 N--CA 1.452 -0.342 0 CA-C-O 121.454 0.645 . . . . 1.06 110.399 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.832 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 0.7 OUTLIER -76.38 145.68 39.26 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.098 -0.956 . . . . 2.31 110.936 -176.585 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.858 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 53.1 t -84.89 119.39 25.29 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.583 -0.735 . . . . 0.45 109.111 177.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -66.42 -3.07 5.33 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.437 0.532 . . . . 2.46 112.437 -175.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.6 m-85 -108.6 -17.81 13.88 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.239 -0.652 . . . . 1.01 109.239 178.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.775 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 15.5 m -111.6 -41.75 4.0 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.299 -0.864 . . . . 0.66 112.847 -172.208 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.05 -3.65 84.55 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.722 -0.752 . . . . 0.53 111.537 -170.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.5 tpt180 -91.48 131.39 36.96 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 109.949 -0.389 . . . . 3.19 109.949 -178.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.832 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 44.9 m -92.88 121.54 34.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.014 0.435 . . . . 1.23 111.082 -178.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.858 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 11.1 m-85 -100.87 127.6 47.27 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.469 -0.938 . . . . 0.47 108.469 175.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 21.3 m -79.4 9.51 4.7 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.807 0.337 . . . . 1.51 111.057 -177.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -122.88 106.22 34.39 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.201 -0.454 . . . . 1.92 109.969 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.58 -38.72 88.2 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 123.02 2.48 . . . . 0.5 112.65 -177.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.2 t -71.5 -40.22 70.32 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.993 -0.549 . . . . 1.12 110.941 -179.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.4 m -76.77 -35.02 57.97 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.406 -0.361 . . . . 1.17 110.477 -179.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.708 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 8.7 tmtt? -66.42 -18.85 65.6 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.306 -0.628 . . . . 1.21 109.306 172.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 14.7 tpt -84.7 -50.09 7.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.52 -0.764 . . . . 1.69 109.039 -178.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.1 ttp180 -59.79 -38.84 83.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.235 -0.893 . . . . 4.15 109.629 176.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 41.6 t60 -62.27 -43.6 98.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.934 -1.03 . . . . 0.43 110.986 178.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.5 mp -66.38 -31.51 72.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.498 -0.319 . . . . 1.47 110.944 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -70.34 -30.03 66.88 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.219 0.533 . . . . 2.46 110.256 175.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.0 m -70.62 -17.87 62.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.926 -0.579 . . . . 1.3 110.208 177.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 . . . . . 0 C--N 1.332 -0.156 0 CA-C-N 115.949 -0.569 . . . . 0.98 111.272 176.928 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.474 ' HB3' ' HE2' ' A' ' 19' ' ' LYS . 82.3 m-85 . . . . . 0 N--CA 1.451 -0.389 0 N-CA-C 109.923 -0.399 . . . . 1.06 109.923 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.531 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 4.0 pt20 -77.65 159.48 29.15 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.325 0.583 . . . . 2.31 112.182 -173.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.904 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 33.4 t -98.54 119.49 37.35 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 108.09 -1.078 . . . . 0.45 108.09 171.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -62.14 -18.35 60.64 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.579 0.585 . . . . 2.46 112.579 -170.028 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -102.9 -13.66 16.85 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.507 0.67 . . . . 1.01 109.28 -176.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.846 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 32.7 m -113.32 -36.64 4.93 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.203 -0.908 . . . . 0.66 112.975 -170.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.26 -3.33 84.98 Favored Glycine 0 N--CA 1.453 -0.187 0 N-CA-C 111.181 -0.768 . . . . 0.53 111.181 -173.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -80.82 130.07 34.86 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.71 0.404 . . . . 3.19 110.374 -178.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.531 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 5.1 p -93.75 122.02 35.79 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.087 -0.506 . . . . 1.23 111.481 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.904 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 40.8 m-85 -99.84 142.91 30.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.907 -0.588 . . . . 0.47 109.731 177.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.5 p -88.87 13.29 13.0 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.942 -0.572 . . . . 1.51 110.368 178.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.441 ' O ' ' HB3' ' A' ' 19' ' ' LYS . 2.1 m-20 -124.87 115.22 26.5 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.464 -0.789 . . . . 1.92 110.543 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.416 ' HG3' ' CE1' ' A' ' 4' ' ' TYR . 19.2 Cg_exo -65.1 -46.93 5.24 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 123.003 2.469 . . . . 0.5 112.308 -178.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.8 m -72.69 -39.69 66.84 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.994 -0.548 . . . . 1.12 110.499 -178.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.8 m -70.85 -39.21 73.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.436 -0.347 . . . . 1.17 111.142 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.552 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 1.2 tmtm? -63.86 -19.14 64.83 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.407 0.622 . . . . 1.21 109.751 174.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 33.2 tpp -89.82 -44.73 9.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.591 -0.731 . . . . 1.69 110.344 -176.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -67.27 -31.2 71.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.268 0.556 . . . . 4.15 109.7 174.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -66.08 -48.27 71.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.339 -0.846 . . . . 0.43 111.101 177.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.808 HD11 ' HA ' ' A' ' 6' ' ' CYS . 2.5 mp -67.35 -25.3 65.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.901 0.381 . . . . 1.47 111.018 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -75.63 -35.55 60.44 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.142 -0.481 . . . . 2.46 110.855 177.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.1 p -88.24 1.62 54.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.173 -0.467 . . . . 1.3 111.774 -177.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.467 0.381 0 N-CA-C 111.885 0.328 . . . . 0.98 111.885 179.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.527 ' HB3' ' HE3' ' A' ' 19' ' ' LYS . 96.3 m-85 . . . . . 0 N--CA 1.453 -0.301 0 CA-C-O 120.671 0.272 . . . . 1.06 111.067 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -76.36 133.76 39.86 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.845 -0.428 . . . . 2.31 109.845 175.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 1.014 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 44.6 t -82.82 122.96 28.89 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 108.521 -0.918 . . . . 0.45 108.521 171.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -62.71 -15.24 51.91 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.922 0.712 . . . . 2.46 112.922 -171.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -109.97 -16.77 13.76 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.775 0.798 . . . . 1.01 109.547 -176.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.83 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 12.7 m -99.2 -37.0 9.47 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.882 -1.054 . . . . 0.66 111.801 -178.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.77 8.57 87.68 Favored Glycine 0 N--CA 1.451 -0.327 0 N-CA-C 111.062 -0.815 . . . . 0.53 111.062 -173.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 64.3 ttt180 -106.61 137.85 43.87 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.457 -0.372 . . . . 3.19 110.59 -173.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.5 m -91.44 114.36 26.87 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.942 -0.572 . . . . 1.23 110.709 -179.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 1.014 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 19.1 m-85 -97.17 121.83 39.49 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.747 -0.835 . . . . 0.47 108.747 173.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 34.9 t -82.57 22.0 0.92 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.39 0.614 . . . . 1.51 109.889 178.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.408 ' H ' ' C ' ' A' ' 13' ' ' PHE . 11.7 m-20 -123.53 96.33 43.76 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.385 -0.825 . . . . 1.92 109.806 -178.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.0 -43.11 62.62 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.439 2.759 . . . . 0.5 113.938 -173.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 94.6 m -82.01 -34.3 29.66 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.145 0.498 . . . . 1.12 110.996 -177.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.3 m -77.95 -31.1 50.71 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.667 -0.413 . . . . 1.17 110.909 -177.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.76 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 8.8 tmtt? -69.17 -22.17 63.93 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 109.098 -0.704 . . . . 1.21 109.098 171.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -77.32 -53.53 7.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.407 -0.815 . . . . 1.69 109.525 -174.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -67.71 -28.58 67.78 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.661 -0.7 . . . . 4.15 110.343 177.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 62.6 t60 -60.62 -46.09 91.57 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.052 0.453 . . . . 0.43 109.834 172.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -61.7 -46.95 87.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.808 -0.633 . . . . 1.47 110.44 177.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -56.44 -31.09 63.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.731 0.301 . . . . 2.46 111.576 178.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 96.2 m -74.26 -57.28 4.05 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 112.649 0.611 . . . . 1.3 112.649 -173.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.533 0.317 0 C-N-CA 119.676 -0.81 . . . . 0.98 112.163 -171.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.691 ' HB3' ' HD3' ' A' ' 19' ' ' LYS . 83.6 m-85 . . . . . 0 N--CA 1.452 -0.345 0 CA-C-O 121.334 0.587 . . . . 1.06 111.011 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.489 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 37.8 tt0 -71.99 146.1 47.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.335 -0.848 . . . . 2.31 111.213 -178.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.878 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 53.4 t -87.35 123.25 32.11 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.568 -0.901 . . . . 0.45 108.568 169.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -68.17 -8.57 39.82 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 112.043 0.386 . . . . 2.46 112.043 -175.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.581 ' CE2' ' HG ' ' A' ' 23' ' ' LEU . 15.5 m-85 -111.11 -6.08 14.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.048 0.451 . . . . 1.01 109.864 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.878 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 11.0 m -120.08 -36.72 3.2 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.825 0.676 . . . . 0.66 112.825 -172.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.15 -7.95 72.96 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.699 -0.763 . . . . 0.53 111.737 -173.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.489 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 63.2 ttt180 -80.53 139.7 36.22 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 120.53 0.205 . . . . 3.19 110.632 -177.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 p -91.51 117.95 30.15 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.987 -0.551 . . . . 1.23 110.743 176.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.749 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 54.5 m-85 -98.69 147.54 24.75 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.69 -0.485 . . . . 0.47 109.69 177.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 55.4 m -91.59 2.96 56.1 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.392 -0.596 . . . . 1.51 109.392 176.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.587 ' O ' ' HB3' ' A' ' 19' ' ' LYS . 25.2 m-20 -120.98 109.34 35.71 Favored Pre-proline 0 CA--C 1.516 -0.33 0 CA-C-N 115.686 -0.688 . . . . 1.92 110.689 -176.012 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.46 ' HG3' ' CE1' ' A' ' 4' ' ' TYR . 25.0 Cg_exo -62.56 -43.49 21.65 Favored 'Trans proline' 0 N--CA 1.464 -0.248 0 C-N-CA 122.454 2.103 . . . . 0.5 111.764 177.608 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.9 m -75.75 -40.01 56.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.728 -0.669 . . . . 1.12 111.181 -178.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.567 ' HB2' ' CB ' ' A' ' 15' ' ' ASP . 70.4 m -79.81 -25.13 40.96 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.675 -0.41 . . . . 1.17 111.347 -177.38 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.691 ' HD3' ' HB3' ' A' ' 4' ' ' TYR . 6.4 tttp -68.97 -24.32 64.24 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.213 -0.662 . . . . 1.21 109.213 167.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 13.9 tpt -80.12 -53.23 6.89 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.666 -0.697 . . . . 1.69 110.131 -171.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -60.52 -33.28 72.4 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 121.272 0.558 . . . . 4.15 109.614 176.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -63.24 -48.07 79.77 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.272 -0.876 . . . . 0.43 110.432 175.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.581 ' HG ' ' CE2' ' A' ' 8' ' ' TYR . 0.6 OUTLIER -64.79 -42.19 95.25 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.365 -0.834 . . . . 1.47 111.053 -175.074 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -80.18 -1.24 39.58 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.963 0.357 . . . . 2.46 111.963 -176.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 88.6 m -96.46 -40.1 9.24 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.49 -0.484 . . . . 1.3 111.177 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 p80 . . . . . 0 C--N 1.33 -0.252 0 C-N-CA 119.499 -0.88 . . . . 0.98 112.149 -174.86 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.403 ' HB2' ' CD ' ' A' ' 19' ' ' LYS . 49.5 m-85 . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 109.767 -0.456 . . . . 1.06 109.767 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.628 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 19.9 pt20 -76.01 160.1 30.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.303 0.573 . . . . 2.31 111.68 -174.156 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.741 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 36.5 t -110.15 121.25 44.82 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.098 -0.704 . . . . 0.45 109.098 171.356 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.5 -11.54 35.05 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.359 0.503 . . . . 2.46 112.359 -173.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -103.72 -26.51 12.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.769 0.795 . . . . 1.01 109.193 -178.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.741 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 4.1 m -94.65 -41.09 9.48 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.674 -1.148 . . . . 0.66 112.041 -173.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.35 11.17 85.76 Favored Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 110.559 -1.017 . . . . 0.53 110.559 -166.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -109.95 132.03 54.52 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.786 -0.449 . . . . 3.19 109.786 -177.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.628 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 14.4 m -92.84 118.28 30.94 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.501 -0.772 . . . . 1.23 110.646 -177.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.686 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 44.7 m-85 -99.06 122.88 42.89 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.075 -0.713 . . . . 0.47 109.075 177.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.7 t -83.17 17.85 1.89 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.182 0.515 . . . . 1.51 109.788 178.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -131.06 100.44 17.15 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 109.183 -0.673 . . . . 1.92 109.183 -176.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.434 ' O ' ' HB2' ' A' ' 20' ' ' MET . 43.8 Cg_exo -55.73 -43.77 54.29 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.191 2.594 . . . . 0.5 112.797 -175.685 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.8 m -65.97 -42.57 89.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.109 -0.496 . . . . 1.12 111.24 -178.236 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.9 m -74.85 -37.49 62.21 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.564 -0.289 . . . . 1.17 111.197 -178.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.67 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 26.1 tttp -64.31 -20.24 65.96 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.158 0.504 . . . . 1.21 109.717 174.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.434 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 12.8 tpt -85.83 -51.44 6.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.492 -0.776 . . . . 1.69 109.734 -173.114 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 48.2 mtp180 -63.32 -37.58 87.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.372 -0.831 . . . . 4.15 110.29 175.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -66.18 -38.4 87.94 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.745 -0.661 . . . . 0.43 110.512 178.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.492 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 3.2 tp -62.72 -43.7 98.14 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.996 0.426 . . . . 1.47 109.987 178.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -57.95 -38.71 76.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.406 -0.816 . . . . 2.46 110.902 177.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 16.0 m -77.86 0.25 24.67 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.628 -0.715 . . . . 1.3 111.425 -176.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.4 ' HB2' ' O ' ' A' ' 23' ' ' LEU . 12.5 m-70 . . . . . 0 C--O 1.234 0.258 0 O-C-N 121.91 -0.494 . . . . 0.98 111.716 176.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 . . . . . 0 N--CA 1.454 -0.229 0 N-CA-C 109.621 -0.511 . . . . 1.06 109.621 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.713 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 3.8 pt20 -71.89 141.42 49.53 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.108 -0.497 . . . . 2.31 111.251 -178.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.756 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 44.4 t -90.6 130.09 36.66 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.834 -0.621 . . . . 0.45 109.759 177.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -75.22 -2.65 28.95 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 111.65 0.241 . . . . 2.46 111.65 -175.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -101.76 -32.15 10.42 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 122.202 1.001 . . . . 1.01 108.643 177.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.756 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 27.7 m -101.28 -37.57 8.45 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 113.618 -1.628 . . . . 0.66 112.563 -167.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.69 -2.37 88.14 Favored Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.832 -0.699 . . . . 0.53 111.584 -173.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.444 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 75.0 ttt180 -96.17 139.63 32.05 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.944 -0.391 . . . . 3.19 109.944 -176.131 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.713 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 20.0 m -92.73 106.05 18.09 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.028 -0.533 . . . . 1.23 110.457 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.897 ' HB2' ' HB2' ' A' ' 19' ' ' LYS . 50.0 m-85 -88.61 119.78 29.39 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.834 -0.802 . . . . 0.47 108.834 177.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.2 t -78.76 8.44 5.43 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.777 0.323 . . . . 1.51 110.612 -176.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.457 ' HA ' ' HD2' ' A' ' 16' ' ' PRO . 0.7 OUTLIER -121.03 104.64 41.15 Favored Pre-proline 0 C--N 1.328 -0.329 0 N-CA-C 109.807 -0.442 . . . . 1.92 109.807 177.251 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.457 ' HD2' ' HA ' ' A' ' 15' ' ' ASP . 18.3 Cg_endo -57.6 -32.9 95.66 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 123.058 2.506 . . . . 0.5 112.728 -175.272 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.0 m -83.07 -31.92 27.09 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.253 -0.431 . . . . 1.12 111.195 -178.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.0 m -81.18 -32.32 33.64 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.936 0.398 . . . . 1.17 110.376 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.897 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 7.6 tmtt? -66.76 -19.12 65.68 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.825 -0.625 . . . . 1.21 109.338 170.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.408 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 0.1 OUTLIER -87.77 -51.9 5.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.349 -0.841 . . . . 1.69 109.2 -177.692 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.475 ' HA ' ' OE1' ' A' ' 24' ' ' GLU . 55.2 ttp180 -54.01 -39.33 65.99 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.759 -0.655 . . . . 4.15 110.275 173.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.624 ' HA ' HG22 ' A' ' 25' ' ' THR . 64.7 t60 -69.08 -30.29 68.57 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.451 -0.795 . . . . 0.43 110.914 177.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.08 -34.55 75.3 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.471 -0.566 . . . . 1.47 109.471 177.021 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.475 ' OE1' ' HA ' ' A' ' 21' ' ' ARG . 42.4 mt-10 -66.43 -46.67 75.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.667 -0.697 . . . . 2.46 110.691 176.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.624 HG22 ' HA ' ' A' ' 22' ' ' HIS . 12.1 t -71.76 -7.34 47.55 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.129 -0.487 . . . . 1.3 111.877 -174.33 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 14.1 m-70 . . . . . 0 C--N 1.33 -0.249 0 N-CA-C 109.671 -0.492 . . . . 0.98 109.671 172.733 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.563 ' HE2' ' HG3' ' A' ' 16' ' ' PRO . 90.8 m-85 . . . . . 0 N--CA 1.452 -0.339 0 N-CA-C 109.618 -0.512 . . . . 1.06 109.618 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.746 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 0.0 OUTLIER -88.2 149.94 23.58 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.303 0.573 . . . . 2.31 112.234 -170.783 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 1.015 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 48.6 t -95.03 125.29 39.59 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.631 -0.713 . . . . 0.45 109.595 175.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -63.79 -21.61 66.51 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.325 0.491 . . . . 2.46 112.325 -173.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -95.59 -27.88 15.12 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.967 0.889 . . . . 1.01 108.964 -176.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.756 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 6.8 m -95.75 -40.46 9.35 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.224 -1.353 . . . . 0.66 112.821 -170.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.57 10.41 85.87 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.404 -0.903 . . . . 0.53 110.907 -171.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -105.44 132.97 50.94 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.686 -0.487 . . . . 3.19 109.686 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.746 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 19.6 m -96.5 120.12 36.24 Favored 'General case' 0 C--N 1.32 -0.71 0 O-C-N 123.428 0.455 . . . . 1.23 110.485 179.666 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 1.015 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 24.7 m-85 -95.32 126.95 40.98 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.273 -0.64 . . . . 0.47 109.273 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.6 t -77.41 9.95 2.88 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.971 -0.558 . . . . 1.51 111.525 -173.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.42 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 5.0 m-20 -135.31 120.15 13.61 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-O 121.041 0.448 . . . . 1.92 110.153 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.563 ' HG3' ' HE2' ' A' ' 4' ' ' TYR . 31.7 Cg_exo -57.2 -53.2 5.14 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 123.574 2.849 . . . . 0.5 112.592 -176.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.1 m -55.42 -46.74 76.63 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.354 -0.385 . . . . 1.12 111.742 -177.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.0 p -84.41 -16.63 42.01 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 120.538 -0.465 . . . . 1.17 111.704 -175.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.891 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 10.7 tmtt? -77.63 -23.26 49.8 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 108.611 -0.885 . . . . 1.21 108.611 170.041 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.559 ' HG2' ' O ' ' A' ' 16' ' ' PRO . 77.4 mmm -83.58 -52.57 6.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.343 -0.844 . . . . 1.69 110.265 -175.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 92.9 mtt-85 -59.83 -30.84 69.22 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.282 0.563 . . . . 4.15 110.042 176.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.41 ' O ' ' HD2' ' A' ' 26' ' ' HIS . 38.5 t60 -68.58 -41.91 79.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.432 -0.804 . . . . 0.43 110.596 178.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.468 HD21 ' HA ' ' A' ' 6' ' ' CYS . 2.1 mm? -65.54 -38.98 91.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.937 0.398 . . . . 1.47 110.192 176.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 20' ' ' MET . 39.0 mm-40 -62.89 -34.3 77.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.656 -0.702 . . . . 2.46 111.166 177.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.4 p -84.51 -0.43 53.04 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.261 0.467 . . . . 1.3 112.261 -176.146 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.41 ' HD2' ' O ' ' A' ' 22' ' ' HIS . 17.7 m-70 . . . . . 0 C--N 1.33 -0.244 0 CA-C-O 121.542 0.687 . . . . 0.98 109.148 168.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 . . . . . 0 N--CA 1.45 -0.44 0 N-CA-C 109.576 -0.527 . . . . 1.06 109.576 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.53 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 43.6 mt-30 -77.11 157.55 30.96 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.522 -0.308 . . . . 2.31 110.381 -177.404 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.791 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 45.3 t -88.39 127.68 35.5 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 108.535 -0.913 . . . . 0.45 108.535 175.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -67.01 -13.23 61.71 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.988 0.736 . . . . 2.46 112.988 -168.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -103.36 -30.28 10.7 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.884 0.85 . . . . 1.01 108.775 177.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.791 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 63.4 m -95.21 -40.37 9.61 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.544 -1.207 . . . . 0.66 113.721 -166.664 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.76 -3.65 86.86 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.622 -0.799 . . . . 0.53 112.116 -176.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.475 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 68.5 ttt180 -76.38 134.35 39.67 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.671 -0.492 . . . . 3.19 109.671 176.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.53 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 50.2 p -90.96 110.0 21.24 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.051 0.453 . . . . 1.23 110.6 -179.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.766 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 69.9 m-85 -88.91 124.76 34.53 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.56 -0.904 . . . . 0.47 108.56 174.364 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.0 m -69.43 -6.45 30.29 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.718 -0.674 . . . . 1.51 111.02 -176.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -135.7 124.34 15.66 Favored Pre-proline 0 CA--C 1.516 -0.336 0 CA-C-O 120.804 0.335 . . . . 1.92 110.539 -173.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.626 ' O ' ' HB2' ' A' ' 20' ' ' MET . 38.0 Cg_endo -67.4 -23.05 44.62 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.599 2.199 . . . . 0.5 111.425 177.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.8 m -67.53 -54.5 19.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.407 -0.815 . . . . 1.12 110.917 179.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.8 p -80.78 -28.96 36.18 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.541 -0.3 . . . . 1.17 111.272 -176.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.711 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 0.3 OUTLIER -65.47 -19.59 66.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.188 0.518 . . . . 1.21 109.898 172.668 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.626 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -84.12 -53.85 5.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.902 -0.59 . . . . 1.69 109.456 -177.355 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.494 ' HA ' ' OE1' ' A' ' 24' ' ' GLU . 60.2 ttt180 -57.24 -34.06 68.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.1 -0.5 . . . . 4.15 109.9 174.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -55.94 -47.49 77.46 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.896 -0.593 . . . . 0.43 110.684 174.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.35 -29.3 68.81 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.277 -0.42 . . . . 1.47 110.678 -179.202 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.494 ' OE1' ' HA ' ' A' ' 21' ' ' ARG . 47.5 mt-10 -68.84 -56.91 6.47 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.176 0.512 . . . . 2.46 111.011 174.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.2 t -78.76 3.62 16.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.908 -0.587 . . . . 1.3 111.739 -174.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.467 0.404 0 N-CA-C 113.326 0.862 . . . . 0.98 113.326 -171.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.481 1.101 0 CA-C-O 120.884 0.373 . . . . 5.49 110.626 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.439 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 62.7 tttp -143.03 117.89 6.38 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 109.299 -0.63 . . . . 4.28 109.299 174.035 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 6.1 Cg_exo -79.05 129.78 9.05 Favored 'Trans proline' 0 N--CA 1.446 -1.282 0 C-N-CA 123.014 2.476 . . . . 1.44 111.275 -176.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.425 ' CZ ' ' HG3' ' A' ' 16' ' ' PRO . 59.0 m-85 -82.75 74.69 9.69 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.034 -0.985 . . . . 1.06 109.332 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.424 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 18.2 pt20 -85.92 154.64 21.36 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.075 -0.966 . . . . 2.31 111.401 -175.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.765 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 51.6 t -93.08 130.86 38.55 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.185 -0.462 . . . . 0.45 110.297 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -61.95 -22.9 66.02 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.723 -0.671 . . . . 2.46 112.69 -173.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -103.69 -23.69 13.42 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.595 0.712 . . . . 1.01 109.462 -174.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.765 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 47.3 m -98.58 -28.86 13.38 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.648 -1.16 . . . . 0.66 112.358 -171.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.97 3.92 57.39 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.747 -0.74 . . . . 0.53 111.796 -175.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.424 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 5.0 tpm_? -90.09 128.35 36.29 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 109.716 -0.476 . . . . 3.19 109.716 -177.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 3.4 p -85.87 116.83 24.35 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.482 -0.781 . . . . 1.23 110.574 179.193 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.725 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 49.9 m-85 -96.57 127.86 42.96 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.719 -0.845 . . . . 0.47 108.719 173.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.2 m -82.69 5.58 20.8 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.032 0.444 . . . . 1.51 110.737 -178.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 3.4 t70 -138.15 122.84 12.0 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 115.79 -0.641 . . . . 1.92 110.31 -177.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.539 ' O ' ' HB2' ' A' ' 20' ' ' MET . 19.7 Cg_exo -65.42 -24.71 56.75 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 123.169 2.579 . . . . 0.5 112.424 -178.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -68.67 -54.85 13.78 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.219 -0.446 . . . . 1.12 110.926 -177.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.3 p -73.2 -31.0 63.93 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.391 -0.368 . . . . 1.17 111.152 -179.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.655 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 1.5 tmtm? -65.8 -19.34 65.85 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.457 -0.572 . . . . 1.21 109.457 172.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.539 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 11.7 tpt -86.79 -53.59 4.84 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.335 -0.617 . . . . 1.69 109.335 -177.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.497 HH21 ' CD ' ' A' ' 24' ' ' GLU . 2.8 mmp_? -54.47 -44.75 72.86 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.568 -0.742 . . . . 4.15 110.365 175.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 56.0 t60 -62.14 -34.57 76.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.078 -0.51 . . . . 0.43 111.187 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -79.5 -33.5 42.07 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.992 -0.283 . . . . 1.47 111.704 -177.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.497 ' CD ' HH21 ' A' ' 21' ' ' ARG . 16.5 pt-20 -85.41 -32.59 22.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.734 0.302 . . . . 2.46 111.163 -178.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 32.9 m -84.64 -3.68 58.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.363 0.601 . . . . 1.3 110.45 177.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.93 -29.38 60.04 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 109.028 -0.73 . . . . 0.98 109.028 169.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -76.18 71.96 2.94 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 114.915 -1.039 . . . . 3.02 110.077 173.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -129.62 48.69 2.34 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.564 -0.743 . . . . 4.41 110.205 177.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -77.52 -32.48 54.12 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.42 -0.809 . . . . 7.36 110.073 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.0 tttp . . . . . 0 C--O 1.249 1.035 0 CA-C-N 115.611 -0.722 . . . . 9.31 110.071 177.307 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.559 ' O ' ' HD3' ' A' ' 3' ' ' PRO . 1.6 mpt? . . . . . 0 N--CA 1.483 1.192 0 CA-C-O 120.67 0.271 . . . . 5.49 110.86 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 34.8 mmtm -104.99 92.32 5.19 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.518 -0.31 . . . . 4.28 110.201 174.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.559 ' HD3' ' O ' ' A' ' 1' ' ' MET . 10.9 Cg_endo -91.25 159.96 3.77 Favored 'Trans proline' 0 N--CA 1.446 -1.315 0 C-N-CA 123.288 2.659 . . . . 1.44 111.569 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -101.18 83.41 2.48 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.238 -0.653 . . . . 1.06 109.238 177.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.501 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 16.5 pt20 -72.16 159.93 33.29 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.515 -0.766 . . . . 2.31 110.827 -177.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.971 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 8.6 t -83.11 128.61 34.63 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.238 -1.023 . . . . 0.45 108.238 178.176 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.47 ' H ' HD11 ' A' ' 23' ' ' LEU . 12.6 m-20 -66.34 -6.29 13.67 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 112.856 0.688 . . . . 2.46 112.856 -171.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -111.72 -13.71 13.7 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.314 0.578 . . . . 1.01 109.982 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.867 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 74.9 m -119.31 -36.56 3.34 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.638 -0.71 . . . . 0.66 112.868 -163.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.9 -16.01 39.7 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.432 -0.89 . . . . 0.53 112.009 -176.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.501 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 72.6 ttt180 -62.69 135.4 57.35 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 109.936 -0.394 . . . . 3.19 109.936 177.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 p -89.44 113.06 24.35 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.212 0.529 . . . . 1.23 111.994 -174.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.971 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 69.4 m-85 -99.26 131.28 45.39 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.582 -0.895 . . . . 0.47 108.582 172.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.5 m -79.67 4.33 16.43 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.386 -0.37 . . . . 1.51 110.543 -176.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -131.3 115.83 16.35 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.448 -0.342 . . . . 1.92 110.72 -174.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -61.8 -34.92 81.56 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 123.028 2.486 . . . . 0.5 112.069 -178.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.9 p -70.9 -45.79 63.69 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.195 0.521 . . . . 1.12 110.474 178.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.4 m -71.65 -36.72 70.79 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.059 -0.519 . . . . 1.17 111.064 -177.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.724 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 0.2 OUTLIER -65.95 -19.42 65.86 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.82 -0.437 . . . . 1.21 109.82 174.105 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 13.7 tpt -90.6 -46.34 8.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.872 -0.604 . . . . 1.69 110.488 -174.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.8 mmm180 -64.05 -36.11 82.92 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.663 -0.495 . . . . 4.15 109.663 176.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 44.0 t60 -70.18 -35.52 74.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.896 -0.593 . . . . 0.43 110.372 176.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.542 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 5.2 tp -57.87 -58.59 7.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.578 -0.737 . . . . 1.47 110.72 -178.174 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -64.14 -33.49 75.91 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.474 -0.785 . . . . 2.46 111.703 -176.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 25.9 m -74.15 -5.35 41.26 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.882 0.372 . . . . 1.3 111.416 -176.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 13.6 m-70 -65.31 -18.66 65.49 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.865 0.364 . . . . 0.98 110.345 173.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.44 ' OD2' ' HB3' ' A' ' 29' ' ' ASP . 35.9 t70 -117.68 96.32 5.33 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.4 -0.593 . . . . 3.02 109.4 175.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.3 p -78.09 23.13 0.28 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.89 -0.595 . . . . 4.41 112.219 -175.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.44 ' HB3' ' OD2' ' A' ' 27' ' ' ASP . 20.0 t70 -86.39 -21.41 27.17 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.526 0.679 . . . . 7.36 109.171 175.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 35.7 mttp . . . . . 0 C--O 1.247 0.966 0 CA-C-N 115.285 -0.87 . . . . 9.31 110.472 -174.607 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.478 0.95 0 CA-C-O 120.818 0.342 . . . . 5.49 110.227 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.525 ' HD2' ' HD2' ' A' ' 3' ' ' PRO . 26.9 tptp -83.88 118.49 71.49 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.313 -0.403 . . . . 4.28 110.452 179.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.569 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 2.2 Cg_endo -83.94 155.13 13.22 Favored 'Trans proline' 0 N--CA 1.449 -1.105 0 C-N-CA 123.068 2.512 . . . . 1.44 111.148 176.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -108.01 122.2 46.36 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.862 -0.608 . . . . 1.06 110.805 -175.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.601 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 8.6 tt0 -73.92 142.29 45.94 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.42 -0.809 . . . . 2.31 111.508 -176.166 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.973 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 8.4 t -77.0 122.13 24.48 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 108.341 -0.985 . . . . 0.45 108.341 174.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -64.47 -8.15 12.59 Favored 'General case' 0 C--N 1.319 -0.744 0 O-C-N 123.802 0.689 . . . . 2.46 112.732 -170.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -111.58 -21.74 11.59 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 121.135 0.493 . . . . 1.01 110.051 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.558 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 63.4 m -114.48 -29.76 6.75 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.312 0.856 . . . . 0.66 113.312 -163.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.6 -8.66 78.56 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.417 -0.897 . . . . 0.53 112.772 -179.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 68.2 ttt180 -78.86 135.65 37.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.726 0.263 . . . . 3.19 110.719 177.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.601 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 36.9 m -99.59 116.31 31.43 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.855 0.359 . . . . 1.23 110.803 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.973 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 42.3 m-85 -94.62 128.74 41.47 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.29 -0.633 . . . . 0.47 109.29 177.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.1 t -84.16 17.4 2.51 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.62 0.724 . . . . 1.51 110.14 -178.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.419 ' HA ' ' HD2' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -125.78 102.79 28.3 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 115.47 -0.786 . . . . 1.92 109.78 177.584 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.53 ' O ' ' HB2' ' A' ' 20' ' ' MET . 12.0 Cg_endo -55.35 -38.41 93.85 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 123.496 2.798 . . . . 0.5 112.452 -176.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.5 m -74.97 -36.02 62.05 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.136 -0.483 . . . . 1.12 110.918 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 14.5 t -76.98 -41.9 41.13 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 120.99 -0.284 . . . . 1.17 110.385 -176.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.851 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 2.7 tmtm? -63.79 -18.01 63.66 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.415 0.626 . . . . 1.21 109.828 175.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.53 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 0.2 OUTLIER -84.19 -53.56 5.42 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.472 -0.785 . . . . 1.69 109.484 -175.286 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 53.2 mtp180 -70.13 -20.53 63.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.918 -0.583 . . . . 4.15 110.444 175.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.421 ' HD2' ' SG ' ' A' ' 6' ' ' CYS . 63.1 t60 -66.89 -42.94 84.68 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.033 -0.531 . . . . 0.43 109.641 173.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.1 -38.08 89.77 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.257 0.551 . . . . 1.47 109.696 174.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -60.64 -41.27 94.61 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.099 -0.955 . . . . 2.46 111.207 177.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.0 p -84.37 0.41 49.43 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.545 0.572 . . . . 1.3 112.545 -174.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.8 m-70 -83.62 13.79 4.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.029 0.442 . . . . 0.98 110.472 173.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -84.2 -5.98 59.33 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.664 0.745 . . . . 3.02 109.568 175.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 9.8 t -66.39 -13.55 60.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.368 -0.833 . . . . 4.41 110.727 177.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -81.72 -4.76 57.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.001 -0.545 . . . . 7.36 111.105 178.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.41 ' NZ ' ' HB2' ' A' ' 30' ' ' LYS . 4.2 ttmp? . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.762 -0.637 . . . . 9.31 109.874 177.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ptt? . . . . . 0 N--CA 1.48 1.038 0 CA-C-O 120.723 0.297 . . . . 5.49 110.596 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.4 ' HB2' ' HE3' ' A' ' 2' ' ' LYS . 14.5 ptmt -170.74 148.75 2.72 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.963 -0.562 . . . . 4.28 109.653 175.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.562 ' HB2' ' OG ' ' A' ' 12' ' ' SER . 1.0 OUTLIER -85.21 131.18 4.15 Favored 'Trans proline' 0 N--CA 1.447 -1.232 0 C-N-CA 123.098 2.532 . . . . 1.44 110.341 174.373 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.669 ' HB3' ' HD2' ' A' ' 19' ' ' LYS . 80.8 m-85 -95.75 97.19 9.5 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.623 -0.717 . . . . 1.06 110.575 -173.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.799 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 36.6 tt0 -76.53 139.4 40.72 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.467 -0.788 . . . . 2.31 110.792 -176.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 1.029 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 50.0 t -80.44 119.6 23.34 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.923 -0.769 . . . . 0.45 108.923 176.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -64.12 -6.3 6.28 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.755 1.02 . . . . 2.46 113.755 -170.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -109.09 -33.39 6.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.946 0.879 . . . . 1.01 109.075 176.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.795 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 7.0 m -85.96 -40.32 15.98 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.388 -1.278 . . . . 0.66 112.162 -170.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.75 -1.5 88.05 Favored Glycine 0 N--CA 1.447 -0.606 0 N-CA-C 110.714 -0.954 . . . . 0.53 110.714 -169.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.1 tpt180 -89.5 129.23 36.02 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.067 -0.716 . . . . 3.19 109.067 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.799 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 0.8 OUTLIER -98.57 118.0 34.29 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 120.932 0.396 . . . . 1.23 110.665 -175.903 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 1.029 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 24.8 m-85 -97.53 129.22 44.7 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.091 -0.707 . . . . 0.47 109.091 178.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 59.1 m -78.26 4.46 12.71 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.53 -0.305 . . . . 1.51 111.467 -177.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.509 ' HB3' ' HB3' ' A' ' 18' ' ' SER . 11.7 t70 -120.06 113.63 34.09 Favored Pre-proline 0 C--N 1.33 -0.281 0 C-N-CA 120.947 -0.301 . . . . 1.92 110.505 -178.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.516 ' O ' ' HB2' ' A' ' 20' ' ' MET . 28.1 Cg_endo -62.51 -32.77 80.07 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 123.201 2.601 . . . . 0.5 113.035 -176.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 35.8 m -80.46 -45.08 18.18 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.099 0.476 . . . . 1.12 110.652 -178.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.509 ' HB3' ' HB3' ' A' ' 15' ' ' ASP . 40.9 t -70.17 -37.14 75.1 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.002 -0.544 . . . . 1.17 110.905 -178.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.886 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 6.8 tmtt? -67.15 -18.86 65.47 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.115 0.483 . . . . 1.21 109.835 174.351 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.516 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 10.6 tpt -86.86 -43.9 12.11 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.375 -0.602 . . . . 1.69 109.375 -174.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.0 ttt85 -63.33 -38.37 90.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.601 -0.727 . . . . 4.15 109.378 174.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -63.34 -38.63 91.89 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.301 -0.863 . . . . 0.43 110.81 177.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.03 -36.69 84.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.998 0.428 . . . . 1.47 110.433 176.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -70.37 -29.46 66.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.195 0.522 . . . . 2.46 110.498 175.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.0 m -66.53 -27.18 67.56 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.673 -0.694 . . . . 1.3 110.592 178.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -72.51 -0.45 12.76 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.057 -0.52 . . . . 0.98 112.004 -179.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -76.56 -86.01 0.05 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.916 -0.402 . . . . 3.02 109.916 176.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.6 p -147.03 22.77 1.21 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.037 0.446 . . . . 4.41 110.069 177.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -115.48 16.65 16.61 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.174 0.512 . . . . 7.36 110.855 -172.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.49 ' NZ ' ' HB3' ' A' ' 30' ' ' LYS . 1.1 ttpm? . . . . . 0 C--O 1.245 0.823 0 CA-C-O 118.935 -0.555 . . . . 9.31 109.958 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ptt? . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 110.354 -0.239 . . . . 5.49 110.354 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt 59.15 84.61 0.2 Allowed Pre-proline 0 N--CA 1.471 0.62 0 O-C-N 123.844 0.715 . . . . 4.28 110.689 177.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -86.82 130.1 3.07 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 123.366 2.711 . . . . 1.44 112.859 -174.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.596 ' HB3' ' HE2' ' A' ' 19' ' ' LYS . 64.9 m-85 -127.12 161.22 28.97 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 114.82 -1.082 . . . . 1.06 108.522 175.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.426 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 9.3 pt20 -116.32 161.1 19.54 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.91 -0.316 . . . . 2.31 111.138 -177.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.898 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 43.5 t -88.22 121.18 30.32 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.659 -1.237 . . . . 0.45 107.659 172.088 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -65.45 -1.65 2.68 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 113.649 0.981 . . . . 2.46 113.649 -171.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -108.53 -24.14 11.53 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.491 0.662 . . . . 1.01 109.339 174.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.77 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 92.9 m -110.22 -35.15 6.17 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.0 -1.0 . . . . 0.66 113.069 -166.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.0 -11.44 57.31 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.899 -0.667 . . . . 0.53 112.191 -175.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.426 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 9.8 ttp180 -70.07 141.77 52.76 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 110.353 -0.24 . . . . 3.19 110.353 -178.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.535 ' HA ' ' O ' ' A' ' 4' ' ' TYR . 31.9 m -90.06 113.62 25.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.122 0.487 . . . . 1.23 111.811 -176.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.898 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 46.1 m-85 -101.29 119.46 38.79 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.099 -1.074 . . . . 0.47 108.099 170.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.0 p -87.12 21.5 2.34 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.374 0.607 . . . . 1.51 110.41 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -137.36 96.85 10.85 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 115.202 -0.908 . . . . 1.92 110.002 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -57.03 -43.39 54.31 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.657 2.905 . . . . 0.5 113.863 -172.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.4 ' O ' ' HB3' ' A' ' 20' ' ' MET . 9.0 t -62.18 -44.35 96.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.261 0.553 . . . . 1.12 111.682 -176.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -80.09 -28.93 39.0 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.284 -0.416 . . . . 1.17 111.297 -179.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.596 ' HE2' ' HB3' ' A' ' 4' ' ' TYR . 7.9 tttp -65.84 -20.25 66.17 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.411 -0.589 . . . . 1.21 109.411 168.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.4 ' HB3' ' O ' ' A' ' 17' ' ' THR . 1.1 tmt? -82.46 -50.25 9.06 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 109.087 -0.708 . . . . 1.69 109.087 -177.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.7 mmm180 -64.66 -29.58 70.58 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.712 -0.676 . . . . 4.15 110.081 175.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -64.32 -40.54 96.11 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.734 -0.667 . . . . 0.43 110.371 175.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -68.16 -31.53 71.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.011 0.434 . . . . 1.47 110.535 177.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -65.48 -50.64 64.57 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.065 -0.516 . . . . 2.46 110.994 176.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 17.2 p -76.6 -5.38 47.49 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.549 0.574 . . . . 1.3 112.549 -174.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -68.41 -25.82 65.23 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.879 -0.415 . . . . 0.98 109.879 173.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -86.29 -74.23 0.43 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.092 -0.503 . . . . 3.02 110.264 176.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.0 m -156.28 150.75 25.68 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.297 -0.631 . . . . 4.41 109.297 -179.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -79.08 -39.18 34.42 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.449 -0.574 . . . . 7.36 109.449 177.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.415 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.128 0 CA-C-N 115.462 -0.79 . . . . 9.31 109.896 169.085 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.9 ttp . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 120.696 0.284 . . . . 5.49 110.52 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.494 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 36.9 ttmt -83.95 114.0 51.35 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.386 -0.37 . . . . 4.28 110.456 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.684 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 2.0 Cg_endo -82.89 179.91 4.92 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 123.607 2.871 . . . . 1.44 112.287 -178.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -124.8 132.16 53.37 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.214 0.53 . . . . 1.06 110.462 -178.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -82.83 141.16 32.49 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.637 -0.711 . . . . 2.31 111.939 -172.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.96 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 22.5 t -77.45 133.21 38.67 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.355 -0.98 . . . . 0.45 108.355 176.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -55.6 -27.65 50.71 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.986 0.736 . . . . 2.46 112.986 -168.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -111.25 -9.27 14.31 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.241 -0.584 . . . . 1.01 110.753 -175.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.882 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 94.9 m -111.32 -37.95 5.13 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 113.929 1.085 . . . . 0.66 113.929 -165.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.02 -20.15 30.57 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 119.959 -1.115 . . . . 0.53 111.879 -174.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.6 ttt180 -64.49 137.2 57.74 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.828 0.347 . . . . 3.19 110.411 179.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.684 ' HB3' ' HB2' ' A' ' 3' ' ' PRO . 11.2 m -95.28 112.16 23.91 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.653 -0.703 . . . . 1.23 111.2 -176.332 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.96 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 60.8 m-85 -97.17 122.8 40.6 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.752 -0.833 . . . . 0.47 108.752 174.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.6 m -81.96 10.58 6.25 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.129 0.49 . . . . 1.51 110.851 -176.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -133.31 108.48 12.36 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.93 -0.577 . . . . 1.92 109.816 178.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.435 ' O ' ' HB2' ' A' ' 20' ' ' MET . 35.4 Cg_endo -65.05 -26.43 58.14 Favored 'Trans proline' 0 CA--C 1.527 0.163 0 C-N-CA 123.004 2.469 . . . . 0.5 113.106 -174.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 16.7 m -76.84 -45.89 26.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.848 0.356 . . . . 1.12 111.238 -176.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.0 p -77.51 -31.08 53.29 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.701 -0.399 . . . . 1.17 110.941 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 19.9 tttm -66.18 -19.22 65.77 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 121.216 0.532 . . . . 1.21 109.645 171.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.435 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 43.5 tpp -78.41 -49.96 12.58 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.309 -0.626 . . . . 1.69 109.309 -177.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.3 mmt85 -63.92 -33.53 75.92 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.704 -0.68 . . . . 4.15 109.93 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 79.2 t60 -62.01 -43.68 98.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.732 -0.667 . . . . 0.43 110.445 175.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.99 -40.95 90.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.17 0.51 . . . . 1.47 109.771 177.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.86 -35.02 79.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.445 -0.798 . . . . 2.46 111.025 177.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 59.9 m -67.07 -25.79 66.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 1.3 111.026 -178.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 57.1 m-70 -69.3 -25.28 64.16 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.092 0.472 . . . . 0.98 110.429 176.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.13 -14.08 54.31 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.126 -0.488 . . . . 3.02 110.424 178.218 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 9.1 m -70.2 -15.39 62.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.322 0.582 . . . . 4.41 110.32 178.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -66.83 -22.36 66.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.641 -0.708 . . . . 7.36 110.356 176.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.9 mmtt . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.642 -0.694 . . . . 9.31 110.049 -178.966 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.9 ttt . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 120.945 0.402 . . . . 5.49 110.643 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.442 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 17.6 tppt? -100.01 121.68 53.17 Favored Pre-proline 0 C--N 1.321 -0.647 0 N-CA-C 109.535 -0.542 . . . . 4.28 109.535 177.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.454 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 1.2 Cg_endo -86.32 129.51 3.25 Favored 'Trans proline' 0 N--CA 1.448 -1.153 0 C-N-CA 123.067 2.512 . . . . 1.44 111.778 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.607 ' CE1' ' HG3' ' A' ' 16' ' ' PRO . 75.6 m-85 -99.37 105.3 17.26 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 114.886 -1.052 . . . . 1.06 109.371 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.4 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 25.2 mt-30 -83.1 150.94 25.97 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.603 -0.726 . . . . 2.31 111.725 -173.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.764 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 51.1 t -99.56 111.45 23.79 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 115.428 -0.805 . . . . 0.45 108.943 174.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.79 0.49 2.37 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.765 0.654 . . . . 2.46 112.765 -175.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -105.06 -21.24 13.31 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.938 -0.764 . . . . 1.01 108.938 175.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.764 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 4.1 m -103.52 -37.35 7.6 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.632 -1.167 . . . . 0.66 111.832 -174.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.39 13.54 83.14 Favored Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 111.178 -0.769 . . . . 0.53 111.178 -171.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.4 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 48.7 ttt180 -107.17 141.58 38.21 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 110.438 -0.208 . . . . 3.19 110.438 -175.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.454 ' HB3' ' HB2' ' A' ' 3' ' ' PRO . 14.6 m -93.33 115.21 27.78 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 123.382 0.426 . . . . 1.23 110.693 178.153 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.614 ' HB2' ' HB2' ' A' ' 19' ' ' LYS . 11.6 m-85 -95.53 133.82 39.1 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.791 -0.818 . . . . 0.47 108.791 175.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.9 t -90.65 6.08 45.39 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.211 0.529 . . . . 1.51 110.011 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -123.83 106.55 31.68 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.939 -0.573 . . . . 1.92 110.101 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.607 ' HG3' ' CE1' ' A' ' 4' ' ' TYR . 38.7 Cg_exo -59.56 -42.95 42.96 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 123.184 2.59 . . . . 0.5 112.817 -175.093 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 59.4 m -69.53 -44.3 71.25 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.003 0.43 . . . . 1.12 111.317 -176.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 12.9 m -75.0 -32.61 61.69 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.628 -0.429 . . . . 1.17 110.879 -178.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 8.7 tmtt? -67.12 -20.58 65.8 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 109.415 -0.587 . . . . 1.21 109.415 173.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.422 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 4.1 tmm? -81.08 -53.92 5.99 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.813 -0.81 . . . . 1.69 108.813 -175.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.2 mmt180 -58.24 -36.11 72.72 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.334 -0.848 . . . . 4.15 110.026 174.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -62.6 -43.35 99.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.709 -0.678 . . . . 0.43 111.029 177.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.1 mp -62.06 -39.53 92.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.905 0.383 . . . . 1.47 110.24 177.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -65.21 -28.2 69.21 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.842 -0.617 . . . . 2.46 110.546 177.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 20.8 m -72.34 -16.87 61.88 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.902 -0.59 . . . . 1.3 110.512 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 34.8 m-70 -75.96 -20.86 57.56 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.096 0.474 . . . . 0.98 110.171 175.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -86.22 -49.06 8.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.856 -0.611 . . . . 3.02 109.45 174.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.3 t -133.28 107.18 7.97 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.585 -0.734 . . . . 4.41 110.165 175.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -80.62 -49.58 11.08 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.612 -0.722 . . . . 7.36 110.239 -177.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.7 mttm . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.846 -0.597 . . . . 9.31 109.988 175.065 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.4 tpt . . . . . 0 N--CA 1.48 1.055 0 N-CA-C 110.276 -0.268 . . . . 5.49 110.276 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 14' ' ' SER . 30.7 mmtp 61.0 82.92 0.22 Allowed Pre-proline 0 C--N 1.329 -0.288 0 O-C-N 123.671 0.607 . . . . 4.28 111.371 179.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.749 ' HB2' ' HB2' ' A' ' 12' ' ' SER . 36.4 Cg_endo -91.19 128.3 1.21 Allowed 'Trans proline' 0 N--CA 1.44 -1.618 0 C-N-CA 123.046 2.497 . . . . 1.44 111.831 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.484 ' HB2' ' HD3' ' A' ' 19' ' ' LYS . 83.0 m-85 -110.98 120.64 43.06 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 115.34 -0.845 . . . . 1.06 109.687 179.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.501 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 73.7 mt-30 -82.53 137.09 34.7 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.474 0.654 . . . . 2.31 112.241 -170.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.942 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 52.6 t -76.66 123.47 26.19 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.475 -0.784 . . . . 0.45 108.964 176.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -63.17 -12.68 29.63 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.024 0.75 . . . . 2.46 113.024 -171.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -107.56 -23.69 12.06 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-O 121.657 0.741 . . . . 1.01 109.549 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.791 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 11.8 m -98.16 -41.49 7.88 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.83 -1.077 . . . . 0.66 112.958 -172.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.31 -10.0 65.3 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 111.017 -0.833 . . . . 0.53 111.017 -167.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -79.14 134.43 36.71 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 122.838 0.455 . . . . 3.19 110.19 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.749 ' HB2' ' HB2' ' A' ' 3' ' ' PRO . 47.3 p -95.21 122.93 38.41 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.126 -0.488 . . . . 1.23 111.372 -177.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.942 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 19.3 m-85 -104.04 124.03 48.29 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.463 -0.94 . . . . 0.47 108.463 173.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.403 ' HA ' ' O ' ' A' ' 2' ' ' LYS . 15.0 m -80.49 13.36 2.51 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.113 0.482 . . . . 1.51 111.03 -175.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -136.18 115.53 10.99 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.158 -0.474 . . . . 1.92 110.154 -179.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.606 ' HA ' ' HE3' ' A' ' 19' ' ' LYS . 48.0 Cg_exo -56.62 -40.19 86.15 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.464 2.776 . . . . 0.5 112.673 -177.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 m -73.08 -40.25 65.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.94 0.4 . . . . 1.12 111.19 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.3 m -73.76 -32.37 63.78 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.085 0.469 . . . . 1.17 110.425 -178.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.781 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 15.0 ttpp -69.59 -18.89 63.65 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.688 -0.687 . . . . 1.21 109.683 171.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 43.1 ttm -87.45 -47.95 8.35 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.835 -0.62 . . . . 1.69 110.57 -173.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -59.25 -38.94 81.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.347 0.594 . . . . 4.15 109.568 172.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 48.6 t60 -60.04 -48.48 81.55 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.19 -0.913 . . . . 0.43 110.897 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.461 HD23 ' O ' ' A' ' 19' ' ' LYS . 2.7 mm? -64.34 -34.19 77.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.918 0.39 . . . . 1.47 111.006 179.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -66.76 -21.07 66.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.197 0.523 . . . . 2.46 110.887 178.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.1 m -98.07 0.25 45.8 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.38 0.609 . . . . 1.3 110.71 -178.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -77.96 -30.02 50.12 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.429 -0.351 . . . . 0.98 111.775 -178.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -106.01 81.74 1.68 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.095 0.474 . . . . 3.02 110.35 179.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.3 p -102.99 16.19 27.35 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.543 0.687 . . . . 4.41 110.144 175.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -78.76 -38.87 37.62 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.308 -0.86 . . . . 7.36 109.777 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.244 0.795 0 CA-C-N 115.626 -0.715 . . . . 9.31 110.392 177.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.4 mtp . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 120.718 0.294 . . . . 5.49 110.747 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.471 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 18.4 ptpt -125.08 128.36 24.83 Favored Pre-proline 0 C--N 1.319 -0.738 0 N-CA-C 109.085 -0.709 . . . . 4.28 109.085 173.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 6.9 Cg_endo -87.86 134.04 3.13 Favored 'Trans proline' 0 N--CA 1.446 -1.298 0 C-N-CA 123.294 2.662 . . . . 1.44 112.29 -174.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -106.76 109.53 21.46 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 114.742 -1.117 . . . . 1.06 110.062 176.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.564 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 0.5 OUTLIER -77.65 152.81 33.63 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.726 -0.67 . . . . 2.31 110.335 -179.815 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.991 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 21.5 t -84.13 129.41 34.9 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.201 -1.037 . . . . 0.45 108.201 177.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.422 ' OD1' HD21 ' A' ' 23' ' ' LEU . 2.3 m-20 -54.98 -23.05 17.34 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 113.431 0.9 . . . . 2.46 113.431 -169.002 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -111.07 -16.58 13.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.361 0.6 . . . . 1.01 110.093 -178.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.911 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 83.6 m -105.89 -33.53 7.93 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.459 -0.792 . . . . 0.66 112.931 -167.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.33 -10.59 35.03 Favored Glycine 0 CA--C 1.517 0.202 0 C-N-CA 120.795 -0.717 . . . . 0.53 112.104 -176.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.564 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 30.4 ttm180 -63.46 135.9 57.23 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 122.616 0.367 . . . . 3.19 110.416 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.2 m -89.94 103.67 16.31 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 123.369 0.418 . . . . 1.23 111.043 -176.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.991 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 61.8 m-85 -91.43 119.4 31.38 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.334 -0.987 . . . . 0.47 108.334 173.563 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.7 p -77.32 12.62 1.44 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.076 -0.511 . . . . 1.51 111.333 -175.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.554 ' HB2' ' HB2' ' A' ' 18' ' ' SER . 8.5 m-20 -131.32 114.94 16.08 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 116.199 -0.455 . . . . 1.92 109.946 -176.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -57.57 -46.34 27.89 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 123.329 2.686 . . . . 0.5 112.523 -178.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 57.6 m -70.32 -35.92 73.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.746 0.308 . . . . 1.12 110.995 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.554 ' HB2' ' HB2' ' A' ' 15' ' ' ASP . 6.3 m -75.8 -35.52 60.03 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.785 -0.366 . . . . 1.17 111.324 -176.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.788 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 1.6 tmtm? -67.26 -18.41 65.2 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.207 -0.664 . . . . 1.21 109.207 173.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 11.5 tpt -88.43 -48.65 7.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.206 -0.906 . . . . 1.69 109.962 -179.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.2 ttp180 -57.84 -41.22 81.88 Favored 'General case' 0 C--N 1.334 -0.092 0 CA-C-O 121.509 0.671 . . . . 4.15 109.325 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 75.2 t60 -61.73 -38.39 87.73 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.163 -0.926 . . . . 0.43 111.227 178.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.422 HD21 ' OD1' ' A' ' 7' ' ' ASP . 1.2 mp -62.53 -43.57 98.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.929 0.395 . . . . 1.47 110.394 177.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -63.67 -32.45 73.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.779 -0.646 . . . . 2.46 110.353 176.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 24.1 m -74.46 -14.87 60.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.871 -0.604 . . . . 1.3 111.32 -177.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 -76.36 -3.94 39.57 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 120.749 0.309 . . . . 0.98 111.33 177.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -64.18 139.08 58.73 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.77 -0.826 . . . . 3.02 108.77 170.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.7 p 49.31 59.15 4.68 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.309 0.576 . . . . 4.41 111.238 -171.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -61.92 -40.93 97.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.494 -0.776 . . . . 7.36 109.073 175.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.8 tptp . . . . . 0 C--O 1.249 1.071 0 CA-C-N 115.034 -0.984 . . . . 9.31 109.283 172.996 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.0 mtp . . . . . 0 N--CA 1.479 1.017 0 N-CA-C 110.045 -0.354 . . . . 5.49 110.045 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.475 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 56.1 mtmt -109.36 132.58 21.19 Favored Pre-proline 0 C--N 1.321 -0.67 0 CA-C-N 116.074 -0.512 . . . . 4.28 109.943 178.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.648 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 2.1 Cg_endo -86.92 152.9 8.49 Favored 'Trans proline' 0 N--CA 1.446 -1.274 0 C-N-CA 123.378 2.718 . . . . 1.44 111.832 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -100.13 129.52 46.17 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.593 -0.731 . . . . 1.06 109.863 -176.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.499 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 60.6 mt-30 -84.35 148.31 26.7 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.087 0.47 . . . . 2.31 112.09 -170.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 1.004 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 42.8 t -81.49 123.11 28.33 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.23 -1.026 . . . . 0.45 108.23 176.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -64.21 -9.53 17.69 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.744 0.646 . . . . 2.46 112.744 -171.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.475 ' HE2' ' HG ' ' A' ' 23' ' ' LEU . 1.2 m-85 -106.88 -17.07 14.3 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 109.205 -0.665 . . . . 1.01 109.205 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.797 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 71.6 m -115.47 -40.5 3.4 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 113.649 0.981 . . . . 0.66 113.649 -168.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.59 -13.13 64.87 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.558 -0.829 . . . . 0.53 111.77 -174.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 64.8 ttt180 -69.58 137.0 52.0 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.94 -0.393 . . . . 3.19 109.94 177.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.648 ' HB3' ' HB2' ' A' ' 3' ' ' PRO . 8.8 m -98.19 112.15 24.23 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.168 -0.469 . . . . 1.23 111.178 -175.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 1.004 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 50.1 m-85 -95.92 123.94 39.72 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.394 -0.595 . . . . 0.47 109.394 176.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.507 ' HA ' ' HA ' ' A' ' 3' ' ' PRO . 32.6 t -80.88 10.25 5.29 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.932 0.396 . . . . 1.51 110.508 -176.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.684 ' HB2' ' OG ' ' A' ' 18' ' ' SER . 8.0 m-20 -130.64 110.05 16.01 Favored Pre-proline 0 C--N 1.326 -0.417 0 N-CA-C 109.546 -0.539 . . . . 1.92 109.546 -177.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.482 ' O ' ' HB2' ' A' ' 20' ' ' MET . 31.2 Cg_exo -59.39 -32.85 97.25 Favored 'Trans proline' 0 C--O 1.225 -0.14 0 C-N-CA 122.731 2.287 . . . . 0.5 112.018 179.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.0 p -70.54 -43.08 70.29 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.84 -0.618 . . . . 1.12 111.806 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.684 ' OG ' ' HB2' ' A' ' 15' ' ' ASP . 81.1 p -77.33 -38.48 50.31 Favored 'General case' 0 CA--C 1.511 -0.543 0 C-N-CA 120.53 -0.468 . . . . 1.17 110.391 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.576 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 23.8 tttm -63.46 -18.81 64.15 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-O 121.067 0.461 . . . . 1.21 110.007 173.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.482 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 14.7 tpt -80.85 -54.26 5.75 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.5 -0.556 . . . . 1.69 109.5 -177.277 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 21' ' ' ARG . 52.9 mtm180 -69.49 -20.75 63.73 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.167 0.508 . . . . 4.15 110.287 176.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 78.4 t60 -71.75 -43.13 66.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.07 -0.514 . . . . 0.43 110.541 174.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.475 ' HG ' ' HE2' ' A' ' 8' ' ' TYR . 1.4 mp -63.16 -32.07 73.36 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.777 -0.453 . . . . 1.47 109.777 176.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -67.53 -29.93 69.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.732 -0.667 . . . . 2.46 110.828 172.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 54.4 m -69.81 -24.49 63.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.08 0.467 . . . . 1.3 110.65 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -79.96 -5.83 56.4 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.346 -0.388 . . . . 0.98 110.331 177.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.2 t70 71.29 -66.63 0.29 Allowed 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 115.359 -0.837 . . . . 3.02 112.233 174.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.3 m -82.78 117.08 22.43 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.919 0.39 . . . . 4.41 110.748 -174.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -89.54 -15.36 33.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.984 -0.553 . . . . 7.36 110.598 -178.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.6 -0.714 . . . . 9.31 110.383 -179.341 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.1 ttp . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 121.042 0.449 . . . . 5.49 110.914 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.457 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 50.1 tttm -88.21 137.22 31.15 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.843 -0.617 . . . . 4.28 111.162 -174.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 4.2 Cg_exo -81.83 128.92 6.09 Favored 'Trans proline' 0 N--CA 1.449 -1.111 0 C-N-CA 122.942 2.428 . . . . 1.44 109.786 171.309 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.672 ' HB3' ' CD ' ' A' ' 19' ' ' LYS . 77.4 m-85 -99.52 104.03 15.82 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 115.461 -0.79 . . . . 1.06 111.398 -171.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.464 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 22.1 mt-30 -86.83 160.22 18.83 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.852 -0.613 . . . . 2.31 111.318 -176.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.993 ' HB2' ' HE1' ' A' ' 13' ' ' PHE . 35.9 t -90.1 119.95 30.87 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 107.898 -1.149 . . . . 0.45 107.898 174.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -69.32 0.07 5.53 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.722 0.638 . . . . 2.46 112.722 -171.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.4 m-30 -103.51 -23.77 13.48 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.951 -0.759 . . . . 1.01 108.951 173.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.789 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 88.4 m -114.0 -40.41 3.74 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.876 -1.056 . . . . 0.66 113.549 -164.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.88 -15.54 61.52 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.769 -0.729 . . . . 0.53 112.017 -174.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.464 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 61.1 ttt180 -67.42 138.7 56.86 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 122.184 0.193 . . . . 3.19 110.578 -179.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.6 m -94.62 122.64 37.43 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.419 -0.355 . . . . 1.23 110.936 -177.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.993 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 84.0 m-85 -101.64 139.63 37.03 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.821 -0.627 . . . . 0.47 109.432 176.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.7 p -80.79 2.54 25.85 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.621 -0.718 . . . . 1.51 110.828 -176.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.857 ' HB2' ' HB3' ' A' ' 18' ' ' SER . 8.4 m-20 -134.24 118.02 13.77 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.336 -0.393 . . . . 1.92 110.216 -174.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.466 ' O ' ' HG3' ' A' ' 20' ' ' MET . 18.5 Cg_endo -60.6 -40.82 52.71 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 123.051 2.5 . . . . 0.5 112.605 -178.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 88.7 m -80.51 -31.12 37.21 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.698 0.285 . . . . 1.12 110.732 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.857 ' HB3' ' HB2' ' A' ' 15' ' ' ASP . 25.7 t -74.49 -37.5 63.13 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 120.661 -0.416 . . . . 1.17 109.906 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.672 ' CD ' ' HB3' ' A' ' 4' ' ' TYR . 8.8 tttp -57.8 -28.64 64.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.077 -0.511 . . . . 1.21 109.686 170.144 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.47 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 61.2 mtp -84.44 -45.69 12.44 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 116.046 -0.525 . . . . 1.69 110.335 -173.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -62.93 -31.68 72.82 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.54 -0.754 . . . . 4.15 109.636 174.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 67.5 t60 -63.05 -46.36 87.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.491 -0.777 . . . . 0.43 110.626 173.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.458 HD23 ' O ' ' A' ' 19' ' ' LYS . 2.3 mm? -59.27 -38.82 81.04 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.475 -0.33 . . . . 1.47 110.665 178.276 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 20' ' ' MET . 48.4 mt-10 -63.19 -34.14 76.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.237 -0.438 . . . . 2.46 110.281 176.09 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.9 m -76.69 -8.46 57.32 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.822 -0.626 . . . . 1.3 110.838 -178.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -79.6 -28.96 41.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.939 0.399 . . . . 0.98 110.249 173.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.611 ' O ' ' HB ' ' A' ' 28' ' ' THR . 55.3 m-20 58.14 -87.99 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.148 -0.933 . . . . 3.02 111.567 -179.24 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.611 ' HB ' ' O ' ' A' ' 27' ' ' ASP . 6.7 t 159.65 -20.72 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 123.884 0.874 . . . . 4.41 108.791 -178.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -78.73 -21.63 47.76 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.135 -0.939 . . . . 7.36 111.734 -175.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.841 -0.6 . . . . 9.31 110.797 -173.197 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 N--CA 1.482 1.175 0 N-CA-C 110.006 -0.368 . . . . 5.49 110.006 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.411 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 18.0 ptpt -108.61 115.59 57.43 Favored Pre-proline 0 C--N 1.323 -0.558 0 N-CA-C 109.171 -0.677 . . . . 4.28 109.171 170.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.679 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 2.0 Cg_endo -84.14 161.71 13.46 Favored 'Trans proline' 0 N--CA 1.45 -1.069 0 C-N-CA 123.032 2.488 . . . . 1.44 111.201 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -88.47 85.2 6.81 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.881 -0.6 . . . . 1.06 109.842 -177.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.521 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 4.7 pp0? -72.1 146.45 47.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.492 -0.776 . . . . 2.31 110.356 -179.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 1.062 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 48.8 t -81.27 122.53 27.54 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.269 -0.641 . . . . 0.45 109.269 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -59.91 -17.35 36.73 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.495 0.554 . . . . 2.46 112.495 -172.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -98.79 -25.4 14.66 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.657 0.742 . . . . 1.01 109.527 -178.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.859 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 35.6 m -107.61 -40.92 5.18 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.689 -1.141 . . . . 0.66 113.147 -164.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.54 -12.39 65.31 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.641 -0.79 . . . . 0.53 111.599 -171.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.437 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 14.2 tpp180 -69.34 129.91 41.11 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 122.534 0.333 . . . . 3.19 110.186 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.679 ' HB3' ' HB2' ' A' ' 3' ' ' PRO . 19.6 m -89.8 110.2 21.14 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.086 -0.506 . . . . 1.23 111.174 -178.046 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 1.062 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 25.8 m-85 -94.08 135.12 35.78 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.744 -0.835 . . . . 0.47 108.744 173.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.3 m -90.06 5.31 47.24 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 121.068 0.461 . . . . 1.51 110.475 -176.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.443 ' HA ' ' HD2' ' A' ' 16' ' ' PRO . 35.2 m-20 -123.51 109.45 30.76 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.941 -0.572 . . . . 1.92 110.39 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.474 ' O ' ' HB2' ' A' ' 20' ' ' MET . 19.2 Cg_endo -58.43 -40.95 70.24 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.252 2.635 . . . . 0.5 113.064 -176.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.2 m -72.21 -40.58 67.72 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.24 0.543 . . . . 1.12 110.479 -178.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.6 t -74.9 -37.95 61.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.039 -0.528 . . . . 1.17 110.187 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.797 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 7.8 tmtt? -63.27 -20.75 65.74 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.283 0.563 . . . . 1.21 109.766 172.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.474 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 9.7 tpt -89.85 -37.57 14.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.832 -0.622 . . . . 1.69 109.955 -173.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 78.5 mtp180 -69.79 -35.13 74.61 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.854 -0.612 . . . . 4.15 109.578 171.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 48.5 t60 -60.53 -43.93 96.6 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.482 -0.781 . . . . 0.43 109.735 172.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' A' ' 26' ' ' HIS . 6.4 tp -63.13 -36.95 85.31 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.076 -0.511 . . . . 1.47 110.293 178.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -64.14 -37.27 86.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.402 -0.817 . . . . 2.46 110.418 176.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 6.3 m -78.47 0.47 25.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.895 -0.593 . . . . 1.3 110.818 -178.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.794 ' HA ' ' HB2' ' A' ' 29' ' ' ASP . 1.7 m-70 -79.03 -6.12 55.61 Favored 'General case' 0 C--N 1.331 -0.225 0 O-C-N 122.032 -0.417 . . . . 0.98 112.057 -178.116 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -62.02 -51.08 69.47 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 108.83 -0.804 . . . . 3.02 108.83 168.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.2 m -109.51 38.98 2.19 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.025 -0.989 . . . . 4.41 110.344 -177.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.794 ' HB2' ' HA ' ' A' ' 26' ' ' HIS . 25.0 t70 -82.96 -59.93 2.33 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.016 -0.538 . . . . 7.36 109.741 177.671 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 62.4 pttt . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.272 -0.871 . . . . 9.31 109.785 174.61 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.4 mtm . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 121.057 0.456 . . . . 5.49 110.078 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.405 ' HB2' ' HE3' ' A' ' 2' ' ' LYS . 33.9 mtmt -139.27 151.39 67.2 Favored Pre-proline 0 C--N 1.324 -0.54 0 CA-C-N 115.832 -0.622 . . . . 4.28 109.552 178.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -89.99 127.6 1.52 Allowed 'Trans proline' 0 N--CA 1.444 -1.406 0 C-N-CA 122.843 2.362 . . . . 1.44 110.4 172.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -105.7 104.07 13.71 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.398 -0.819 . . . . 1.06 110.399 -175.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.832 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 0.7 OUTLIER -76.38 145.68 39.26 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.098 -0.956 . . . . 2.31 110.936 -176.585 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.858 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 53.1 t -84.89 119.39 25.29 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.583 -0.735 . . . . 0.45 109.111 177.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -66.42 -3.07 5.33 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.437 0.532 . . . . 2.46 112.437 -175.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.6 m-85 -108.6 -17.81 13.88 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.239 -0.652 . . . . 1.01 109.239 178.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.775 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 15.5 m -111.6 -41.75 4.0 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.299 -0.864 . . . . 0.66 112.847 -172.208 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 89.05 -3.65 84.55 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.722 -0.752 . . . . 0.53 111.537 -170.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 20.5 tpt180 -91.48 131.39 36.96 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 109.949 -0.389 . . . . 3.19 109.949 -178.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.832 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 44.9 m -92.88 121.54 34.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.014 0.435 . . . . 1.23 111.082 -178.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.858 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 11.1 m-85 -100.87 127.6 47.27 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.469 -0.938 . . . . 0.47 108.469 175.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 21.3 m -79.4 9.51 4.7 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.807 0.337 . . . . 1.51 111.057 -177.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -122.88 106.22 34.39 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.201 -0.454 . . . . 1.92 109.969 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -58.58 -38.72 88.2 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 123.02 2.48 . . . . 0.5 112.65 -177.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.2 t -71.5 -40.22 70.32 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.993 -0.549 . . . . 1.12 110.941 -179.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.4 m -76.77 -35.02 57.97 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.406 -0.361 . . . . 1.17 110.477 -179.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.708 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 8.7 tmtt? -66.42 -18.85 65.6 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.306 -0.628 . . . . 1.21 109.306 172.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 14.7 tpt -84.7 -50.09 7.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.52 -0.764 . . . . 1.69 109.039 -178.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 26.1 ttp180 -59.79 -38.84 83.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.235 -0.893 . . . . 4.15 109.629 176.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 41.6 t60 -62.27 -43.6 98.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.934 -1.03 . . . . 0.43 110.986 178.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.5 mp -66.38 -31.51 72.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.498 -0.319 . . . . 1.47 110.944 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -70.34 -30.03 66.88 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.219 0.533 . . . . 2.46 110.256 175.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.0 m -70.62 -17.87 62.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.926 -0.579 . . . . 1.3 110.208 177.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -77.02 -9.31 58.61 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.949 -0.569 . . . . 0.98 111.272 176.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -83.24 93.66 7.73 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.967 -0.753 . . . . 3.02 108.967 172.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 35.1 p -62.06 136.09 57.8 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.365 -0.834 . . . . 4.41 111.3 -177.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -64.55 -32.6 74.32 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.513 -0.767 . . . . 7.36 109.071 174.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 23.6 tptm . . . . . 0 C--O 1.247 0.937 0 CA-C-N 114.724 -1.125 . . . . 9.31 108.923 173.877 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 mmt . . . . . 0 N--CA 1.48 1.061 0 N-CA-C 109.959 -0.385 . . . . 5.49 109.959 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.448 ' HB2' ' HE3' ' A' ' 2' ' ' LYS . 30.2 ttmt -153.71 108.92 2.54 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-O 120.886 0.374 . . . . 4.28 110.549 -178.103 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.559 ' HB2' ' HB2' ' A' ' 12' ' ' SER . 2.1 Cg_endo -82.78 168.16 14.22 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 122.919 2.412 . . . . 1.44 111.597 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.474 ' HB3' ' HE2' ' A' ' 19' ' ' LYS . 82.3 m-85 -116.54 107.29 14.55 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.8 -0.636 . . . . 1.06 109.923 -177.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.531 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 4.0 pt20 -77.65 159.48 29.15 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.325 0.583 . . . . 2.31 112.182 -173.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.904 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 33.4 t -98.54 119.49 37.35 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 108.09 -1.078 . . . . 0.45 108.09 171.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -62.14 -18.35 60.64 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.579 0.585 . . . . 2.46 112.579 -170.028 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -102.9 -13.66 16.85 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.507 0.67 . . . . 1.01 109.28 -176.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.846 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 32.7 m -113.32 -36.64 4.93 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.203 -0.908 . . . . 0.66 112.975 -170.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.26 -3.33 84.98 Favored Glycine 0 N--CA 1.453 -0.187 0 N-CA-C 111.181 -0.768 . . . . 0.53 111.181 -173.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.0 tpt180 -80.82 130.07 34.86 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.71 0.404 . . . . 3.19 110.374 -178.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.559 ' HB2' ' HB2' ' A' ' 3' ' ' PRO . 5.1 p -93.75 122.02 35.79 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.087 -0.506 . . . . 1.23 111.481 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.904 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 40.8 m-85 -99.84 142.91 30.69 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.907 -0.588 . . . . 0.47 109.731 177.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.5 p -88.87 13.29 13.0 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.942 -0.572 . . . . 1.51 110.368 178.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.441 ' O ' ' HB3' ' A' ' 19' ' ' LYS . 2.1 m-20 -124.87 115.22 26.5 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.464 -0.789 . . . . 1.92 110.543 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.416 ' HG3' ' CE1' ' A' ' 4' ' ' TYR . 19.2 Cg_exo -65.1 -46.93 5.24 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 123.003 2.469 . . . . 0.5 112.308 -178.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.8 m -72.69 -39.69 66.84 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.994 -0.548 . . . . 1.12 110.499 -178.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.8 m -70.85 -39.21 73.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.436 -0.347 . . . . 1.17 111.142 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.552 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 1.2 tmtm? -63.86 -19.14 64.83 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.407 0.622 . . . . 1.21 109.751 174.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 33.2 tpp -89.82 -44.73 9.76 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.591 -0.731 . . . . 1.69 110.344 -176.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -67.27 -31.2 71.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.268 0.556 . . . . 4.15 109.7 174.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -66.08 -48.27 71.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.339 -0.846 . . . . 0.43 111.101 177.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.808 HD11 ' HA ' ' A' ' 6' ' ' CYS . 2.5 mp -67.35 -25.3 65.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.901 0.381 . . . . 1.47 111.018 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -75.63 -35.55 60.44 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.142 -0.481 . . . . 2.46 110.855 177.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.1 p -88.24 1.62 54.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.173 -0.467 . . . . 1.3 111.774 -177.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.73 32.26 0.13 Allowed 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 111.885 0.328 . . . . 0.98 111.885 179.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -77.99 -154.24 0.07 Allowed 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 109.795 -0.446 . . . . 3.02 109.795 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.4 p -79.22 24.51 0.33 Allowed 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.776 -0.578 . . . . 4.41 112.258 -177.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -62.36 -46.39 88.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.297 0.57 . . . . 7.36 110.206 176.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 57.6 mttp . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.654 -0.689 . . . . 9.31 109.555 173.879 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 70.2 mtm . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 120.932 0.396 . . . . 5.49 110.982 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -132.45 153.18 81.1 Favored Pre-proline 0 C--N 1.321 -0.67 0 CA-C-N 115.75 -0.659 . . . . 4.28 109.593 176.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.663 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 5.8 Cg_exo -80.62 129.49 7.34 Favored 'Trans proline' 0 N--CA 1.452 -0.962 0 C-N-CA 123.288 2.658 . . . . 1.44 111.758 -178.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.527 ' HB3' ' HE3' ' A' ' 19' ' ' LYS . 96.3 m-85 -108.53 129.36 55.3 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 114.705 -1.134 . . . . 1.06 111.067 -177.735 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -76.36 133.76 39.86 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.845 -0.428 . . . . 2.31 109.845 175.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 1.014 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 44.6 t -82.82 122.96 28.89 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 108.521 -0.918 . . . . 0.45 108.521 171.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -62.71 -15.24 51.91 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.922 0.712 . . . . 2.46 112.922 -171.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -109.97 -16.77 13.76 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.775 0.798 . . . . 1.01 109.547 -176.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.83 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 12.7 m -99.2 -37.0 9.47 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.882 -1.054 . . . . 0.66 111.801 -178.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 78.77 8.57 87.68 Favored Glycine 0 N--CA 1.451 -0.327 0 N-CA-C 111.062 -0.815 . . . . 0.53 111.062 -173.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 64.3 ttt180 -106.61 137.85 43.87 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.457 -0.372 . . . . 3.19 110.59 -173.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.5 m -91.44 114.36 26.87 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.942 -0.572 . . . . 1.23 110.709 -179.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 1.014 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 19.1 m-85 -97.17 121.83 39.49 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.747 -0.835 . . . . 0.47 108.747 173.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.663 ' HA ' ' HA ' ' A' ' 3' ' ' PRO . 34.9 t -82.57 22.0 0.92 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.39 0.614 . . . . 1.51 109.889 178.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.408 ' H ' ' C ' ' A' ' 13' ' ' PHE . 11.7 m-20 -123.53 96.33 43.76 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.385 -0.825 . . . . 1.92 109.806 -178.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.0 -43.11 62.62 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 123.439 2.759 . . . . 0.5 113.938 -173.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 94.6 m -82.01 -34.3 29.66 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.145 0.498 . . . . 1.12 110.996 -177.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.3 m -77.95 -31.1 50.71 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.667 -0.413 . . . . 1.17 110.909 -177.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.76 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 8.8 tmtt? -69.17 -22.17 63.93 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 109.098 -0.704 . . . . 1.21 109.098 171.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -77.32 -53.53 7.58 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.407 -0.815 . . . . 1.69 109.525 -174.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -67.71 -28.58 67.78 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.661 -0.7 . . . . 4.15 110.343 177.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 62.6 t60 -60.62 -46.09 91.57 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.052 0.453 . . . . 0.43 109.834 172.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -61.7 -46.95 87.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.808 -0.633 . . . . 1.47 110.44 177.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -56.44 -31.09 63.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.731 0.301 . . . . 2.46 111.576 178.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 96.2 m -74.26 -57.28 4.05 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 112.649 0.611 . . . . 1.3 112.649 -173.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -109.24 25.4 11.85 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 119.676 -0.81 . . . . 0.98 112.163 -171.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -97.88 -73.62 0.61 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.325 -0.398 . . . . 3.02 110.065 172.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 73.3 p 59.37 142.44 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.527 1.131 . . . . 4.41 113.607 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -81.82 -19.33 41.33 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.977 -1.011 . . . . 7.36 111.245 -177.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.8 ttpp . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.374 -0.822 . . . . 9.31 110.139 -177.41 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.5 mmt . . . . . 0 N--CA 1.482 1.127 0 CA-C-O 121.016 0.436 . . . . 5.49 110.755 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.415 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 54.7 pttt -70.39 145.72 93.41 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.602 -0.726 . . . . 4.28 110.851 179.326 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 1.2 Cg_endo -85.35 159.31 11.12 Favored 'Trans proline' 0 N--CA 1.45 -1.065 0 C-N-CA 123.392 2.728 . . . . 1.44 111.469 -178.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.691 ' HB3' ' HD3' ' A' ' 19' ' ' LYS . 83.6 m-85 -97.58 89.47 4.68 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-O 121.334 0.587 . . . . 1.06 111.011 -176.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.489 ' HA ' ' O ' ' A' ' 11' ' ' ARG . 37.8 tt0 -71.99 146.1 47.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.335 -0.848 . . . . 2.31 111.213 -178.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.878 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 53.4 t -87.35 123.25 32.11 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.568 -0.901 . . . . 0.45 108.568 169.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -68.17 -8.57 39.82 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 112.043 0.386 . . . . 2.46 112.043 -175.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.581 ' CE2' ' HG ' ' A' ' 23' ' ' LEU . 15.5 m-85 -111.11 -6.08 14.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.048 0.451 . . . . 1.01 109.864 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.878 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 11.0 m -120.08 -36.72 3.2 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.825 0.676 . . . . 0.66 112.825 -172.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 85.15 -7.95 72.96 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.699 -0.763 . . . . 0.53 111.737 -173.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.489 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 63.2 ttt180 -80.53 139.7 36.22 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 120.53 0.205 . . . . 3.19 110.632 -177.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 p -91.51 117.95 30.15 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.987 -0.551 . . . . 1.23 110.743 176.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.749 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 54.5 m-85 -98.69 147.54 24.75 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.69 -0.485 . . . . 0.47 109.69 177.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 55.4 m -91.59 2.96 56.1 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.392 -0.596 . . . . 1.51 109.392 176.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.587 ' O ' ' HB3' ' A' ' 19' ' ' LYS . 25.2 m-20 -120.98 109.34 35.71 Favored Pre-proline 0 CA--C 1.516 -0.33 0 CA-C-N 115.686 -0.688 . . . . 1.92 110.689 -176.012 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.46 ' HG3' ' CE1' ' A' ' 4' ' ' TYR . 25.0 Cg_exo -62.56 -43.49 21.65 Favored 'Trans proline' 0 N--CA 1.464 -0.248 0 C-N-CA 122.454 2.103 . . . . 0.5 111.764 177.608 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.9 m -75.75 -40.01 56.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.728 -0.669 . . . . 1.12 111.181 -178.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.567 ' HB2' ' CB ' ' A' ' 15' ' ' ASP . 70.4 m -79.81 -25.13 40.96 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.675 -0.41 . . . . 1.17 111.347 -177.38 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.691 ' HD3' ' HB3' ' A' ' 4' ' ' TYR . 6.4 tttp -68.97 -24.32 64.24 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.213 -0.662 . . . . 1.21 109.213 167.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 13.9 tpt -80.12 -53.23 6.89 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.666 -0.697 . . . . 1.69 110.131 -171.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -60.52 -33.28 72.4 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 121.272 0.558 . . . . 4.15 109.614 176.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -63.24 -48.07 79.77 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.272 -0.876 . . . . 0.43 110.432 175.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.581 ' HG ' ' CE2' ' A' ' 8' ' ' TYR . 0.6 OUTLIER -64.79 -42.19 95.25 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.365 -0.834 . . . . 1.47 111.053 -175.074 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -80.18 -1.24 39.58 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.963 0.357 . . . . 2.46 111.963 -176.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 88.6 m -96.46 -40.1 9.24 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.49 -0.484 . . . . 1.3 111.177 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -108.97 14.61 23.98 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 119.499 -0.88 . . . . 0.98 112.149 -174.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -67.7 142.22 56.39 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.48 -0.563 . . . . 3.02 109.48 176.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 33.6 p -74.7 147.41 41.45 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.228 -0.442 . . . . 4.41 111.84 -173.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -55.16 -37.84 67.51 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.669 -0.696 . . . . 7.36 110.21 173.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 79.1 tttt . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.23 -0.89 . . . . 9.31 109.952 177.128 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.1 mmm . . . . . 0 N--CA 1.48 1.054 0 CA-C-O 120.748 0.309 . . . . 5.49 110.699 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.786 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 70.2 mmtt -96.71 -59.1 0.17 Allowed Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.392 -0.367 . . . . 4.28 111.012 178.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.786 ' HD3' ' HB2' ' A' ' 2' ' ' LYS . 7.6 Cg_endo -90.29 140.63 3.26 Favored 'Trans proline' 0 N--CA 1.45 -1.073 0 C-N-CA 122.729 2.286 . . . . 1.44 111.835 179.219 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.403 ' HB2' ' CD ' ' A' ' 19' ' ' LYS . 49.5 m-85 -105.37 125.75 51.34 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.55 -0.75 . . . . 1.06 109.767 -178.275 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.628 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 19.9 pt20 -76.01 160.1 30.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.303 0.573 . . . . 2.31 111.68 -174.156 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.741 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 36.5 t -110.15 121.25 44.82 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.098 -0.704 . . . . 0.45 109.098 171.356 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.5 -11.54 35.05 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.359 0.503 . . . . 2.46 112.359 -173.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -103.72 -26.51 12.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.769 0.795 . . . . 1.01 109.193 -178.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.741 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 4.1 m -94.65 -41.09 9.48 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.674 -1.148 . . . . 0.66 112.041 -173.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 77.35 11.17 85.76 Favored Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 110.559 -1.017 . . . . 0.53 110.559 -166.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -109.95 132.03 54.52 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 109.786 -0.449 . . . . 3.19 109.786 -177.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.652 ' HB3' ' HB2' ' A' ' 3' ' ' PRO . 14.4 m -92.84 118.28 30.94 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.501 -0.772 . . . . 1.23 110.646 -177.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.686 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 44.7 m-85 -99.06 122.88 42.89 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.075 -0.713 . . . . 0.47 109.075 177.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.431 ' HA ' ' HA ' ' A' ' 3' ' ' PRO . 22.7 t -83.17 17.85 1.89 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.182 0.515 . . . . 1.51 109.788 178.323 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -131.06 100.44 17.15 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 109.183 -0.673 . . . . 1.92 109.183 -176.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.434 ' O ' ' HB2' ' A' ' 20' ' ' MET . 43.8 Cg_exo -55.73 -43.77 54.29 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 123.191 2.594 . . . . 0.5 112.797 -175.685 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.8 m -65.97 -42.57 89.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.109 -0.496 . . . . 1.12 111.24 -178.236 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.9 m -74.85 -37.49 62.21 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 116.564 -0.289 . . . . 1.17 111.197 -178.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.67 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 26.1 tttp -64.31 -20.24 65.96 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.158 0.504 . . . . 1.21 109.717 174.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.434 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 12.8 tpt -85.83 -51.44 6.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.492 -0.776 . . . . 1.69 109.734 -173.114 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 48.2 mtp180 -63.32 -37.58 87.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.372 -0.831 . . . . 4.15 110.29 175.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -66.18 -38.4 87.94 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.745 -0.661 . . . . 0.43 110.512 178.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.492 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 3.2 tp -62.72 -43.7 98.14 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.996 0.426 . . . . 1.47 109.987 178.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -57.95 -38.71 76.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.406 -0.816 . . . . 2.46 110.902 177.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 16.0 m -77.86 0.25 24.67 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.628 -0.715 . . . . 1.3 111.425 -176.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.4 ' HB2' ' O ' ' A' ' 23' ' ' LEU . 12.5 m-70 -78.65 -0.07 28.53 Favored 'General case' 0 C--O 1.234 0.258 0 O-C-N 121.91 -0.494 . . . . 0.98 111.716 176.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -82.33 57.01 3.45 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.979 0.895 . . . . 3.02 108.946 172.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 16.2 p -134.52 179.17 6.45 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.867 -1.06 . . . . 4.41 110.081 -176.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -97.17 18.11 15.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.219 -0.446 . . . . 7.36 110.328 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? . . . . . 0 C--O 1.244 0.809 0 CA-C-N 115.832 -0.622 . . . . 9.31 109.809 -178.894 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ttt . . . . . 0 N--CA 1.48 1.048 0 CA-C-O 120.621 0.248 . . . . 5.49 111.057 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.47 151.28 58.78 Favored Pre-proline 0 C--N 1.328 -0.354 0 N-CA-C 109.509 -0.552 . . . . 4.28 109.509 177.099 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.92 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 7.2 Cg_endo -88.89 137.34 3.25 Favored 'Trans proline' 0 N--CA 1.447 -1.223 0 C-N-CA 123.274 2.649 . . . . 1.44 112.165 -176.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -101.42 103.5 14.41 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.044 -0.98 . . . . 1.06 109.621 -179.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.713 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 3.8 pt20 -71.89 141.42 49.53 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.108 -0.497 . . . . 2.31 111.251 -178.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.756 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 44.4 t -90.6 130.09 36.66 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.834 -0.621 . . . . 0.45 109.759 177.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -75.22 -2.65 28.95 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 111.65 0.241 . . . . 2.46 111.65 -175.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -101.76 -32.15 10.42 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 122.202 1.001 . . . . 1.01 108.643 177.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.756 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 27.7 m -101.28 -37.57 8.45 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 113.618 -1.628 . . . . 0.66 112.563 -167.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.69 -2.37 88.14 Favored Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.832 -0.699 . . . . 0.53 111.584 -173.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.444 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 75.0 ttt180 -96.17 139.63 32.05 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.944 -0.391 . . . . 3.19 109.944 -176.131 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.92 ' HB3' ' HB2' ' A' ' 3' ' ' PRO . 20.0 m -92.73 106.05 18.09 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.028 -0.533 . . . . 1.23 110.457 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.897 ' HB2' ' HB2' ' A' ' 19' ' ' LYS . 50.0 m-85 -88.61 119.78 29.39 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.834 -0.802 . . . . 0.47 108.834 177.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.573 ' HA ' ' HA ' ' A' ' 3' ' ' PRO . 18.2 t -78.76 8.44 5.43 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.777 0.323 . . . . 1.51 110.612 -176.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.457 ' HA ' ' HD2' ' A' ' 16' ' ' PRO . 0.7 OUTLIER -121.03 104.64 41.15 Favored Pre-proline 0 C--N 1.328 -0.329 0 N-CA-C 109.807 -0.442 . . . . 1.92 109.807 177.251 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.457 ' HD2' ' HA ' ' A' ' 15' ' ' ASP . 18.3 Cg_endo -57.6 -32.9 95.66 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 123.058 2.506 . . . . 0.5 112.728 -175.272 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.0 m -83.07 -31.92 27.09 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.253 -0.431 . . . . 1.12 111.195 -178.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.0 m -81.18 -32.32 33.64 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.936 0.398 . . . . 1.17 110.376 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.897 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 7.6 tmtt? -66.76 -19.12 65.68 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.825 -0.625 . . . . 1.21 109.338 170.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.408 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 0.1 OUTLIER -87.77 -51.9 5.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.349 -0.841 . . . . 1.69 109.2 -177.692 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.475 ' HA ' ' OE1' ' A' ' 24' ' ' GLU . 55.2 ttp180 -54.01 -39.33 65.99 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.759 -0.655 . . . . 4.15 110.275 173.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.624 ' HA ' HG22 ' A' ' 25' ' ' THR . 64.7 t60 -69.08 -30.29 68.57 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.451 -0.795 . . . . 0.43 110.914 177.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.08 -34.55 75.3 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.471 -0.566 . . . . 1.47 109.471 177.021 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.475 ' OE1' ' HA ' ' A' ' 21' ' ' ARG . 42.4 mt-10 -66.43 -46.67 75.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.667 -0.697 . . . . 2.46 110.691 176.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.624 HG22 ' HA ' ' A' ' 22' ' ' HIS . 12.1 t -71.76 -7.34 47.55 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.129 -0.487 . . . . 1.3 111.877 -174.33 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 14.1 m-70 -63.9 -40.45 96.52 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.671 -0.492 . . . . 0.98 109.671 172.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -84.74 58.51 4.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.713 -0.676 . . . . 3.02 111.054 -177.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.0 p -129.96 172.63 11.51 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.156 -0.475 . . . . 4.41 109.763 176.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -82.32 37.27 0.5 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.235 0.541 . . . . 7.36 110.735 -177.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 21.0 pttp . . . . . 0 C--O 1.246 0.895 0 CA-C-O 118.071 -0.966 . . . . 9.31 110.169 178.352 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.7 ttp . . . . . 0 N--CA 1.482 1.145 0 CA-C-O 120.61 0.243 . . . . 5.49 110.641 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.42 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 57.0 mtpt -129.4 115.18 18.39 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 109.962 -0.384 . . . . 4.28 109.962 -179.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.577 ' HB2' ' HB3' ' A' ' 12' ' ' SER . 11.3 Cg_endo -91.01 133.72 1.66 Allowed 'Trans proline' 0 N--CA 1.448 -1.189 0 C-N-CA 123.618 2.879 . . . . 1.44 112.262 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.563 ' HE2' ' HG3' ' A' ' 16' ' ' PRO . 90.8 m-85 -110.64 127.02 55.09 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.208 -0.906 . . . . 1.06 109.618 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.746 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 0.0 OUTLIER -88.2 149.94 23.58 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.303 0.573 . . . . 2.31 112.234 -170.783 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 1.015 ' HB2' ' HE2' ' A' ' 13' ' ' PHE . 48.6 t -95.03 125.29 39.59 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.631 -0.713 . . . . 0.45 109.595 175.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -63.79 -21.61 66.51 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.325 0.491 . . . . 2.46 112.325 -173.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -95.59 -27.88 15.12 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.967 0.889 . . . . 1.01 108.964 -176.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.756 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 6.8 m -95.75 -40.46 9.35 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 114.224 -1.353 . . . . 0.66 112.821 -170.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 79.57 10.41 85.87 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.404 -0.903 . . . . 0.53 110.907 -171.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.8 tpp180 -105.44 132.97 50.94 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.686 -0.487 . . . . 3.19 109.686 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.746 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 19.6 m -96.5 120.12 36.24 Favored 'General case' 0 C--N 1.32 -0.71 0 O-C-N 123.428 0.455 . . . . 1.23 110.485 179.666 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 1.015 ' HE2' ' HB2' ' A' ' 6' ' ' CYS . 24.7 m-85 -95.32 126.95 40.98 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.273 -0.64 . . . . 0.47 109.273 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.54 ' HA ' ' HA ' ' A' ' 3' ' ' PRO . 28.6 t -77.41 9.95 2.88 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.971 -0.558 . . . . 1.51 111.525 -173.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.42 ' HA ' ' HD3' ' A' ' 16' ' ' PRO . 5.0 m-20 -135.31 120.15 13.61 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-O 121.041 0.448 . . . . 1.92 110.153 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.563 ' HG3' ' HE2' ' A' ' 4' ' ' TYR . 31.7 Cg_exo -57.2 -53.2 5.14 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 123.574 2.849 . . . . 0.5 112.592 -176.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.1 m -55.42 -46.74 76.63 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.354 -0.385 . . . . 1.12 111.742 -177.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.0 p -84.41 -16.63 42.01 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 120.538 -0.465 . . . . 1.17 111.704 -175.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.891 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 10.7 tmtt? -77.63 -23.26 49.8 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 108.611 -0.885 . . . . 1.21 108.611 170.041 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.559 ' HG2' ' O ' ' A' ' 16' ' ' PRO . 77.4 mmm -83.58 -52.57 6.36 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.343 -0.844 . . . . 1.69 110.265 -175.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 92.9 mtt-85 -59.83 -30.84 69.22 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.282 0.563 . . . . 4.15 110.042 176.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.41 ' O ' ' HD2' ' A' ' 26' ' ' HIS . 38.5 t60 -68.58 -41.91 79.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.432 -0.804 . . . . 0.43 110.596 178.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.468 HD21 ' HA ' ' A' ' 6' ' ' CYS . 2.1 mm? -65.54 -38.98 91.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.937 0.398 . . . . 1.47 110.192 176.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 20' ' ' MET . 39.0 mm-40 -62.89 -34.3 77.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.656 -0.702 . . . . 2.46 111.166 177.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.4 p -84.51 -0.43 53.04 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.261 0.467 . . . . 1.3 112.261 -176.146 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.41 ' HD2' ' O ' ' A' ' 22' ' ' HIS . 17.7 m-70 -80.5 -25.24 38.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.542 0.687 . . . . 0.98 109.148 168.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -89.92 80.58 6.41 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.636 -0.875 . . . . 3.02 108.636 172.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.5 m -101.01 -65.97 0.94 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.888 -0.596 . . . . 4.41 111.381 -172.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -109.47 -63.18 1.39 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.457 0.646 . . . . 7.36 110.069 -173.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 40.8 pttt . . . . . 0 C--O 1.245 0.849 0 CA-C-N 115.089 -0.959 . . . . 9.31 110.111 179.396 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 pmm? . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 120.63 0.252 . . . . 5.49 110.687 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.446 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 23.3 tptm -125.87 110.51 24.9 Favored Pre-proline 0 C--N 1.327 -0.4 0 N-CA-C 110.114 -0.328 . . . . 4.28 110.114 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 2' ' ' LYS . 2.1 Cg_endo -86.07 -179.83 3.38 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.359 2.706 . . . . 1.44 112.504 -179.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -116.88 105.6 12.53 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.413 -0.812 . . . . 1.06 109.576 178.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.53 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 43.6 mt-30 -77.11 157.55 30.96 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.522 -0.308 . . . . 2.31 110.381 -177.404 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.791 ' HB3' ' HB2' ' A' ' 9' ' ' CYS . 45.3 t -88.39 127.68 35.5 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 108.535 -0.913 . . . . 0.45 108.535 175.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -67.01 -13.23 61.71 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.988 0.736 . . . . 2.46 112.988 -168.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -103.36 -30.28 10.7 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.884 0.85 . . . . 1.01 108.775 177.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.791 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 63.4 m -95.21 -40.37 9.61 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.544 -1.207 . . . . 0.66 113.721 -166.664 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 86.76 -3.65 86.86 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.622 -0.799 . . . . 0.53 112.116 -176.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.475 ' O ' ' HA ' ' A' ' 5' ' ' GLN . 68.5 ttt180 -76.38 134.35 39.67 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.671 -0.492 . . . . 3.19 109.671 176.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.53 ' HA ' ' HA ' ' A' ' 5' ' ' GLN . 50.2 p -90.96 110.0 21.24 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.051 0.453 . . . . 1.23 110.6 -179.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.766 ' HE1' ' HB2' ' A' ' 6' ' ' CYS . 69.9 m-85 -88.91 124.76 34.53 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.56 -0.904 . . . . 0.47 108.56 174.364 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.0 m -69.43 -6.45 30.29 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.718 -0.674 . . . . 1.51 111.02 -176.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -135.7 124.34 15.66 Favored Pre-proline 0 CA--C 1.516 -0.336 0 CA-C-O 120.804 0.335 . . . . 1.92 110.539 -173.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.626 ' O ' ' HB2' ' A' ' 20' ' ' MET . 38.0 Cg_endo -67.4 -23.05 44.62 Favored 'Trans proline' 0 N--CA 1.463 -0.317 0 C-N-CA 122.599 2.199 . . . . 0.5 111.425 177.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.8 m -67.53 -54.5 19.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.407 -0.815 . . . . 1.12 110.917 179.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.8 p -80.78 -28.96 36.18 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.541 -0.3 . . . . 1.17 111.272 -176.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.711 ' HB2' ' HB2' ' A' ' 13' ' ' PHE . 0.3 OUTLIER -65.47 -19.59 66.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.188 0.518 . . . . 1.21 109.898 172.668 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.626 ' HB2' ' O ' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -84.12 -53.85 5.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.902 -0.59 . . . . 1.69 109.456 -177.355 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.494 ' HA ' ' OE1' ' A' ' 24' ' ' GLU . 60.2 ttt180 -57.24 -34.06 68.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.1 -0.5 . . . . 4.15 109.9 174.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -55.94 -47.49 77.46 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.896 -0.593 . . . . 0.43 110.684 174.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.35 -29.3 68.81 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.277 -0.42 . . . . 1.47 110.678 -179.202 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.494 ' OE1' ' HA ' ' A' ' 21' ' ' ARG . 47.5 mt-10 -68.84 -56.91 6.47 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.176 0.512 . . . . 2.46 111.011 174.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.2 t -78.76 3.62 16.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.908 -0.587 . . . . 1.3 111.739 -174.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -66.21 4.11 0.76 Allowed 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 113.326 0.862 . . . . 0.98 113.326 -171.571 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.4 t70 64.53 39.05 6.99 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.623 0.725 . . . . 3.02 109.687 -179.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.45 119.25 21.5 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.373 -0.83 . . . . 4.41 110.778 -178.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -85.94 9.14 17.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.635 -0.711 . . . . 7.36 111.378 -173.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.7 mttm . . . . . 0 C--O 1.246 0.907 0 CA-C-O 118.906 -0.569 . . . . 9.31 110.349 -178.734 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_