data_1imw_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 1imw _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo . . . . . 0 N--CA 1.454 -0.8 0 CA-C-O 118.87 -0.554 . . . . 0.0 112.458 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 88.9 mt -112.69 1.44 15.7 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-O 118.288 -0.863 . . . . 0.0 112.704 -178.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -55.2 -54.72 39.75 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 119.76 1.164 . . . . 0.0 111.596 -173.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 45.7 p-90 -49.99 -44.03 50.79 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.052 1.341 . . . . 0.0 111.652 174.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.0 -49.08 66.45 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.004 1.322 . . . . 0.0 109.245 -174.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 77.3 m -61.09 -44.94 96.59 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.343 1.057 . . . . 0.0 111.338 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -65.84 -50.6 64.01 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.867 0.303 . . . . 0.0 111.114 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -68.11 -52.25 37.04 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.773 0.429 . . . . 0.0 111.673 -172.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -89.69 -55.44 3.64 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 123.519 0.728 . . . . 0.0 110.972 -175.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.9 m-30 . . . . . 0 CA--C 1.537 0.466 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -169.759 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo . . . . . 0 N--CA 1.459 -0.529 0 N-CA-C 114.25 0.827 . . . . 0.0 114.25 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 50.2 mt -102.41 15.91 27.83 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.246 0.618 . . . . 0.0 111.969 -172.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 30.0 tp60 -57.28 -47.56 81.14 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 118.984 0.811 . . . . 0.0 111.319 -174.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 34.5 p-90 -54.61 -46.49 73.85 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.449 1.1 . . . . 0.0 111.456 176.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.0 mt -59.25 -42.64 91.61 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.807 0.843 . . . . 0.0 111.164 175.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.5 m -58.74 -54.31 48.48 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 117.902 0.319 . . . . 0.0 110.669 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -69.18 -37.65 78.26 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.04 0.536 . . . . 0.0 112.249 -175.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -89.78 -56.19 3.34 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.152 0.581 . . . . 0.0 111.52 -170.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -89.43 -49.26 6.8 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 123.313 0.645 . . . . 0.0 111.28 -173.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 . . . . . 0 CA--C 1.531 0.24 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 -169.566 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo . . . . . 0 N--CA 1.457 -0.637 0 N-CA-C 113.618 0.584 . . . . 0.0 113.618 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 89.5 mt -119.38 -3.64 10.47 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 124.18 0.992 . . . . 0.0 112.586 -176.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -49.78 -47.9 50.8 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-N 119.521 1.055 . . . . 0.0 111.565 -178.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 28.7 p-90 -52.91 -52.14 58.78 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.62 0.768 . . . . 0.0 111.286 176.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.9 mt -58.04 -49.27 77.46 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.585 0.754 . . . . 0.0 111.456 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.9 m -56.65 -44.1 80.98 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.166 0.986 . . . . 0.0 111.43 -175.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -75.39 -59.9 2.54 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.164 0.586 . . . . 0.0 110.982 177.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -63.71 -58.86 5.57 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.642 1.577 . . . . 0.0 112.095 -169.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -89.49 -51.43 5.54 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 123.358 0.663 . . . . 0.0 110.356 -172.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 . . . . . 0 CA--C 1.535 0.392 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 -171.505 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo . . . . . 0 N--CA 1.456 -0.716 0 N-CA-C 113.754 0.636 . . . . 0.0 113.754 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 29.7 mt -103.52 29.36 5.73 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.999 0.919 . . . . 0.0 112.201 -175.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -62.46 -60.62 3.28 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 119.103 0.865 . . . . 0.0 109.516 175.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.6 p-90 -51.26 -43.31 61.51 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.051 1.34 . . . . 0.0 111.383 177.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -67.52 -51.97 44.55 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.241 1.016 . . . . 0.0 108.865 -174.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 53.0 t -59.03 -42.79 91.03 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.601 0.76 . . . . 0.0 111.89 179.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -63.79 -55.05 25.94 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 117.891 0.314 . . . . 0.0 110.926 177.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -64.87 -49.22 71.4 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.254 0.621 . . . . 0.0 111.766 -172.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -89.73 -59.4 2.22 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 123.492 0.717 . . . . 0.0 110.796 -176.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 . . . . . 0 CA--C 1.536 0.44 0 C-N-CA 123.043 0.537 . . . . 0.0 112.254 -169.561 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo . . . . . 0 N--CA 1.457 -0.637 0 CA-C-O 119.878 -0.134 . . . . 0.0 111.872 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 56.1 mt -100.13 37.96 1.56 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.938 0.895 . . . . 0.0 109.945 -178.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -67.05 -60.36 2.69 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 123.48 0.712 . . . . 0.0 109.519 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 53.6 p-90 -46.37 -44.56 17.09 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.775 1.23 . . . . 0.0 111.038 174.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tt -67.24 -56.39 10.03 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.541 1.136 . . . . 0.0 109.45 -173.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.9 p -62.28 -40.73 97.21 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -176.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -65.47 -48.2 73.47 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 118.185 0.448 . . . . 0.0 110.879 178.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -68.77 -49.91 54.8 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.904 0.482 . . . . 0.0 112.015 -174.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -89.67 -51.86 5.3 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.26 0.624 . . . . 0.0 111.829 -171.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 . . . . . 0 CA--C 1.532 0.278 0 CA-C-N 117.946 0.339 . . . . 0.0 111.441 -169.516 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo . . . . . 0 N--CA 1.457 -0.619 0 CA-C-O 120.309 0.045 . . . . 0.0 112.171 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 28.8 mt -99.59 37.55 1.58 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.145 0.978 . . . . 0.0 110.528 -178.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -61.79 -62.24 1.94 Allowed 'General case' 0 C--N 1.343 0.285 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 174.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.4 p-90 -51.64 -45.14 63.22 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.051 1.34 . . . . 0.0 111.673 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -67.17 -51.97 47.12 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.455 1.102 . . . . 0.0 108.733 -173.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.5 t -58.67 -49.92 75.79 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.369 0.668 . . . . 0.0 111.021 178.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -54.87 -51.92 64.46 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.926 0.89 . . . . 0.0 111.148 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -71.05 -50.75 30.55 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 122.884 0.473 . . . . 0.0 111.623 -172.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -91.31 -52.28 4.88 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -171.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 . . . . . 0 CA--C 1.533 0.322 0 CA-C-N 118.142 0.428 . . . . 0.0 111.11 -169.028 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo . . . . . 0 CA--C 1.539 0.728 0 CA-C-O 120.959 0.316 . . . . 0.0 111.382 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.4 tp -140.05 -24.77 0.81 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.677 1.991 . . . . 0.0 109.945 177.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -42.0 -56.31 2.84 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 126.176 1.79 . . . . 0.0 111.555 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 49.4 p-90 -48.07 -48.04 33.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.135 1.774 . . . . 0.0 111.957 177.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.1 tt -66.43 -48.21 70.73 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.368 1.467 . . . . 0.0 109.085 -176.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 49.1 t -61.61 -49.44 76.58 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 122.647 0.379 . . . . 0.0 111.466 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -62.12 -41.36 98.16 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 122.584 0.354 . . . . 0.0 111.726 -178.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.0 mtmt -66.31 -57.77 6.78 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 117.962 0.346 . . . . 0.0 111.606 176.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -95.6 -60.18 1.71 Allowed 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.657 0.783 . . . . 0.0 111.914 -169.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 . . . . . 0 CA--C 1.536 0.432 0 C-N-CA 123.17 0.588 . . . . 0.0 111.953 -169.924 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo . . . . . 0 N--CA 1.457 -0.671 0 CA-C-O 119.211 -0.412 . . . . 0.0 112.156 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.0 mp -100.32 26.28 6.75 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.546 1.138 . . . . 0.0 111.285 178.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -64.0 -49.77 71.15 Favored 'General case' 0 C--N 1.341 0.236 0 O-C-N 121.395 -0.816 . . . . 0.0 110.831 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 53.0 p-90 -53.51 -43.1 68.03 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.077 0.551 . . . . 0.0 110.5 172.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tt -66.77 -51.07 60.03 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.484 1.114 . . . . 0.0 110.115 -171.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.0 p -61.06 -39.71 90.87 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -67.7 -50.33 58.14 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.445 0.566 . . . . 0.0 110.633 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -60.44 -59.33 5.57 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.094 1.357 . . . . 0.0 111.432 -175.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -89.53 -55.63 3.57 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.648 0.779 . . . . 0.0 110.875 -173.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 CA--C 1.535 0.401 0 C-N-CA 122.778 0.431 . . . . 0.0 110.409 -169.797 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo . . . . . 0 N--CA 1.456 -0.678 0 N-CA-C 114.332 0.858 . . . . 0.0 114.332 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 94.0 mt -127.06 3.09 6.5 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.972 0.909 . . . . 0.0 113.302 -174.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -57.98 -57.1 14.31 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 119.623 1.101 . . . . 0.0 110.013 -178.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 46.0 p-90 -49.69 -44.86 48.27 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.2 1.4 . . . . 0.0 111.534 176.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tt -66.32 -51.32 58.5 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 124.453 1.101 . . . . 0.0 108.866 -173.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.1 m -61.1 -49.65 76.44 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 122.884 0.473 . . . . 0.0 111.284 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -54.76 -51.96 64.07 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.768 0.427 . . . . 0.0 111.165 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -68.7 -53.69 20.64 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.308 0.643 . . . . 0.0 111.926 -171.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -89.56 -45.59 9.28 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.252 0.621 . . . . 0.0 112.083 -170.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 5.0 m-30 . . . . . 0 CA--C 1.53 0.18 0 CA-C-N 118.318 0.508 . . . . 0.0 110.088 -169.601 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo . . . . . 0 N--CA 1.457 -0.646 0 N-CA-C 113.32 0.469 . . . . 0.0 113.32 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 39.0 mt -107.89 29.99 6.75 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.485 1.114 . . . . 0.0 111.809 -173.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -65.19 -50.7 64.92 Favored 'General case' 0 C--N 1.344 0.336 0 CA-C-N 119.33 0.968 . . . . 0.0 110.376 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.2 p-90 -49.99 -43.98 50.77 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.559 1.144 . . . . 0.0 111.047 174.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.56 -49.71 67.84 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.703 1.201 . . . . 0.0 108.925 -177.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.7 t -54.89 -54.63 40.12 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.681 1.192 . . . . 0.0 111.106 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -57.37 -55.5 33.92 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.142 0.977 . . . . 0.0 111.108 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -67.6 -51.45 50.2 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.176 0.59 . . . . 0.0 112.2 -169.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -89.36 -48.65 7.2 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 122.809 0.444 . . . . 0.0 111.724 -171.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 . . . . . 0 CA--C 1.53 0.209 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 -169.468 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 N--CA 1.456 -0.727 0 N-CA-C 111.033 -0.41 . . . . 0.0 111.033 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 55.6 mt -105.32 34.0 3.44 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.414 1.086 . . . . 0.0 110.257 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -62.87 -42.3 99.71 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 123.359 0.663 . . . . 0.0 110.279 177.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 60.7 p-90 -60.13 -36.31 77.22 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.69 0.796 . . . . 0.0 111.104 174.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.66 -42.65 77.63 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 179.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 t -59.26 -53.12 61.89 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.431 0.692 . . . . 0.0 112.241 173.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.72 -25.71 66.64 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.104 0.411 . . . . 0.0 112.023 -172.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -90.05 -58.49 2.49 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.761 0.825 . . . . 0.0 111.035 176.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -89.55 -59.29 2.25 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 123.72 0.808 . . . . 0.0 111.794 -171.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 . . . . . 0 CA--C 1.531 0.243 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 -169.779 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo . . . . . 0 N--CA 1.456 -0.723 0 N-CA-C 111.191 -0.35 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.8 mp -103.48 31.28 4.45 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.567 1.147 . . . . 0.0 110.186 176.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -57.73 -55.46 34.55 Favored 'General case' 0 C--N 1.343 0.289 0 O-C-N 121.41 -0.806 . . . . 0.0 109.417 174.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 45.7 p-90 -57.18 -41.39 79.21 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.889 1.276 . . . . 0.0 111.732 176.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.6 -49.72 65.39 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -174.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 95.2 m -55.03 -55.51 30.09 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.168 0.987 . . . . 0.0 110.91 172.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.11 -33.32 75.2 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.333 0.653 . . . . 0.0 112.149 -171.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -87.13 -53.6 4.78 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.664 0.785 . . . . 0.0 111.38 -174.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -89.52 -53.4 4.55 Favored 'General case' 0 C--N 1.34 0.179 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -169.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 . . . . . 0 CA--C 1.529 0.144 0 C-N-CA 122.347 0.259 . . . . 0.0 111.194 -168.656 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo . . . . . 0 N--CA 1.454 -0.812 0 N-CA-C 111.071 -0.396 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.2 mp -101.48 19.98 16.87 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.34 1.056 . . . . 0.0 110.758 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -56.27 -49.54 73.91 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 120.027 1.285 . . . . 0.0 111.92 -174.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.6 p-90 -54.06 -38.56 65.39 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.154 1.382 . . . . 0.0 111.662 172.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.64 -45.47 75.24 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.225 1.01 . . . . 0.0 109.14 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 11.1 m -57.32 -50.45 72.89 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 124.097 0.959 . . . . 0.0 110.017 176.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.48 -43.22 73.63 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.927 0.491 . . . . 0.0 111.345 -172.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -77.82 -50.88 11.42 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.641 0.776 . . . . 0.0 111.351 -171.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -89.37 -57.55 2.85 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -175.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 . . . . . 0 CA--C 1.534 0.36 0 C-N-CA 122.875 0.47 . . . . 0.0 110.243 -170.915 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo . . . . . 0 N--CA 1.458 -0.578 0 N-CA-C 113.999 0.73 . . . . 0.0 113.999 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.9 mt -99.93 22.67 10.85 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.34 1.056 . . . . 0.0 111.879 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -61.21 -55.74 28.63 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 118.778 0.717 . . . . 0.0 110.236 178.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 35.2 p-90 -52.03 -42.69 63.29 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.923 0.889 . . . . 0.0 111.411 177.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -64.16 -53.62 46.59 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 122.864 0.465 . . . . 0.0 111.71 178.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 18.6 p -61.64 -38.51 87.94 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -174.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -74.32 -55.42 6.03 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.045 0.538 . . . . 0.0 111.019 178.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -74.6 -53.61 9.04 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.334 0.654 . . . . 0.0 111.954 -169.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 69.6 m-85 -89.53 -54.91 3.87 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 123.381 0.672 . . . . 0.0 110.086 -172.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 . . . . . 0 CA--C 1.536 0.42 0 CA-C-N 117.887 0.312 . . . . 0.0 110.597 -173.405 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo . . . . . 0 N--CA 1.456 -0.722 0 N-CA-C 111.225 -0.337 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.5 tp -101.02 12.89 36.84 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.825 1.25 . . . . 0.0 111.432 -178.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -59.84 -56.42 22.03 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 123.589 0.755 . . . . 0.0 110.783 -174.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 50.3 p-90 -51.57 -39.58 58.13 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.927 1.291 . . . . 0.0 112.037 177.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.19 -45.51 84.52 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.012 0.925 . . . . 0.0 108.798 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 12.8 t -59.4 -46.59 88.27 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.33 0.652 . . . . 0.0 111.434 176.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -57.58 -55.38 35.63 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 123.705 0.802 . . . . 0.0 111.039 178.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -73.85 -52.34 13.33 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.722 0.809 . . . . 0.0 112.093 -169.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -89.91 -57.92 2.69 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.134 0.574 . . . . 0.0 111.065 -174.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 . . . . . 0 CA--C 1.532 0.255 0 C-N-CA 122.828 0.451 . . . . 0.0 110.948 -169.14 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo . . . . . 0 N--CA 1.454 -0.798 0 CA-C-O 119.556 -0.268 . . . . 0.0 111.672 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 36.3 mt -107.34 23.8 13.85 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.937 0.895 . . . . 0.0 111.091 -177.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -60.53 -56.04 26.13 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.651 0.66 . . . . 0.0 110.486 -175.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 57.7 p-90 -47.16 -42.18 19.21 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.55 1.54 . . . . 0.0 111.658 172.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -64.44 -47.84 77.56 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 125.218 1.407 . . . . 0.0 108.993 -176.051 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 57.5 m -56.43 -51.15 69.48 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.957 0.503 . . . . 0.0 110.93 176.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -60.04 -46.63 88.88 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 122.244 0.217 . . . . 0.0 111.483 -177.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.1 ttmm -67.7 -56.5 9.08 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.6 0.36 . . . . 0.0 111.7 -176.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -89.77 -50.08 6.26 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.399 0.68 . . . . 0.0 112.327 -169.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 . . . . . 0 CA--C 1.535 0.372 0 C-N-CA 122.636 0.374 . . . . 0.0 111.829 -169.635 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo . . . . . 0 N--CA 1.456 -0.678 0 CA-C-O 119.323 -0.365 . . . . 0.0 112.119 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 48.8 mt -102.48 26.4 7.91 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.327 1.051 . . . . 0.0 111.57 177.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -60.84 -53.74 53.62 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 118.972 0.805 . . . . 0.0 109.916 176.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 55.4 p-90 -50.57 -46.18 57.55 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.385 1.074 . . . . 0.0 110.753 177.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -64.67 -49.27 71.64 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.851 1.26 . . . . 0.0 109.053 -175.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 20.9 t -56.14 -55.25 35.32 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.123 0.969 . . . . 0.0 110.967 179.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -59.71 -48.42 81.75 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.583 0.753 . . . . 0.0 111.324 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -61.73 -60.13 4.13 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.645 1.178 . . . . 0.0 111.812 -175.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -89.69 -44.83 9.75 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 122.991 0.517 . . . . 0.0 112.019 -169.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 . . . . . 0 CA--C 1.531 0.232 0 CA-C-N 118.241 0.473 . . . . 0.0 110.111 -169.801 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo . . . . . 0 N--CA 1.457 -0.662 0 N-CA-C 113.399 0.5 . . . . 0.0 113.399 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.5 mt -99.94 31.83 3.14 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.42 0.688 . . . . 0.0 110.662 -173.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -71.78 -50.31 31.07 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.391 1.077 . . . . 0.0 109.301 -178.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.6 p-90 -58.99 -40.42 84.8 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.666 0.786 . . . . 0.0 110.922 172.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.7 -39.87 88.24 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.573 0.749 . . . . 0.0 109.285 -176.309 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 51.9 t -66.67 -51.99 49.89 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 122.694 0.398 . . . . 0.0 111.36 174.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.21 -27.17 68.24 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 117.962 0.346 . . . . 0.0 111.569 -177.205 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.5 tttp -83.88 -65.72 0.98 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.698 1.199 . . . . 0.0 110.815 178.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -90.3 -55.63 3.53 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 124.155 0.982 . . . . 0.0 111.978 -170.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 . . . . . 0 CA--C 1.531 0.234 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 -169.972 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo . . . . . 0 N--CA 1.456 -0.686 0 CA-C-O 118.97 -0.513 . . . . 0.0 112.767 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 60.0 mt -109.56 15.57 22.81 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.795 1.238 . . . . 0.0 111.496 176.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -61.46 -50.98 70.6 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 118.996 0.816 . . . . 0.0 110.597 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 34.6 p-90 -54.17 -43.45 70.64 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.532 1.133 . . . . 0.0 111.401 178.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 12.7 mt -63.75 -49.84 71.45 Favored 'General case' 0 C--N 1.339 0.121 0 C-N-CA 122.96 0.504 . . . . 0.0 110.889 175.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 18.1 t -55.79 -44.67 77.98 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.729 0.811 . . . . 0.0 111.584 -177.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -75.86 -58.87 3.02 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.784 0.834 . . . . 0.0 111.013 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -71.76 -54.86 8.89 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.773 0.829 . . . . 0.0 112.944 -169.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -89.12 -45.36 9.65 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 123.19 0.596 . . . . 0.0 111.16 -169.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 . . . . . 0 CA--C 1.531 0.215 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 -169.767 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo . . . . . 0 N--CA 1.458 -0.612 0 N-CA-C 113.003 0.347 . . . . 0.0 113.003 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.2 mt -99.82 27.97 5.08 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.588 1.155 . . . . 0.0 111.446 -177.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -58.68 -54.89 42.02 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 123.691 0.796 . . . . 0.0 110.447 177.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 57.3 p-90 -55.32 -39.52 70.06 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.996 1.318 . . . . 0.0 111.283 176.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -66.17 -49.96 65.57 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 -176.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.4 t -57.6 -52.69 64.37 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.138 0.575 . . . . 0.0 111.287 176.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.13 -41.39 96.64 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.697 0.399 . . . . 0.0 111.043 -174.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -76.14 -53.38 8.38 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.729 0.812 . . . . 0.0 111.338 -174.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -89.31 -45.82 9.22 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 122.872 0.469 . . . . 0.0 112.025 -170.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 . . . . . 0 CA--C 1.531 0.222 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -169.407 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 47.5 t . . . . . 0 N--CA 1.473 0.715 0 N-CA-C 111.385 0.143 . . . . 0.0 111.385 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 71.5 mtm180 -73.02 105.22 4.39 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 170.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.39 68.49 2.08 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.006 1.322 . . . . 0.0 110.938 -176.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 179.72 -78.18 0.06 OUTLIER Glycine 0 CA--C 1.527 0.814 0 N-CA-C 109.011 -1.635 . . . . 0.0 109.011 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -69.23 -32.7 20.21 Favored 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 123.502 2.801 . . . . 0.0 112.458 -176.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 88.9 mt -112.69 1.44 15.7 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-O 118.288 -0.863 . . . . 0.0 112.704 -178.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -55.2 -54.72 39.75 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 119.76 1.164 . . . . 0.0 111.596 -173.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 45.7 p-90 -49.99 -44.03 50.79 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.052 1.341 . . . . 0.0 111.652 174.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.0 -49.08 66.45 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.004 1.322 . . . . 0.0 109.245 -174.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 77.3 m -61.09 -44.94 96.59 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.343 1.057 . . . . 0.0 111.338 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -65.84 -50.6 64.01 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.867 0.303 . . . . 0.0 111.114 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -68.11 -52.25 37.04 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.773 0.429 . . . . 0.0 111.673 -172.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -89.69 -55.44 3.64 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 123.519 0.728 . . . . 0.0 110.972 -175.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.9 m-30 -89.45 21.73 3.25 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -169.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.26 -56.85 4.88 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 123.677 0.656 . . . . 0.0 112.129 178.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.074 0 O-C-N 122.115 -0.638 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 41.6 t . . . . . 0 N--CA 1.473 0.716 0 CA-C-O 119.564 -0.255 . . . . 0.0 111.4 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -81.08 82.41 7.03 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 170.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.06 141.79 38.85 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.357 1.063 . . . . 0.0 110.681 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 97.34 -93.4 1.43 Allowed Glycine 0 CA--C 1.533 1.16 0 N-CA-C 108.996 -1.642 . . . . 0.0 108.996 -169.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -54.96 -53.49 5.91 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 123.424 2.75 . . . . 0.0 114.25 -175.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 50.2 mt -102.41 15.91 27.83 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.246 0.618 . . . . 0.0 111.969 -172.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 30.0 tp60 -57.28 -47.56 81.14 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 118.984 0.811 . . . . 0.0 111.319 -174.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 34.5 p-90 -54.61 -46.49 73.85 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.449 1.1 . . . . 0.0 111.456 176.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.0 mt -59.25 -42.64 91.61 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.807 0.843 . . . . 0.0 111.164 175.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.5 m -58.74 -54.31 48.48 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 117.902 0.319 . . . . 0.0 110.669 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -69.18 -37.65 78.26 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.04 0.536 . . . . 0.0 112.249 -175.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -89.78 -56.19 3.34 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.152 0.581 . . . . 0.0 111.52 -170.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -89.43 -49.26 6.8 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 123.313 0.645 . . . . 0.0 111.28 -173.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -88.87 62.88 6.57 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 -169.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.22 55.97 4.16 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 109.189 -1.564 . . . . 0.0 109.189 -169.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.049 0 O-C-N 122.564 -0.374 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 47.3 t . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 111.375 0.139 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 28.4 mmm180 -70.77 106.56 3.61 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 172.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.29 72.53 1.79 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.042 1.337 . . . . 0.0 111.712 -170.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 154.0 -68.67 0.3 Allowed Glycine 0 CA--C 1.527 0.813 0 N-CA-C 108.158 -1.977 . . . . 0.0 108.158 177.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -50.87 -45.17 37.47 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 124.377 3.385 . . . . 0.0 113.618 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 89.5 mt -119.38 -3.64 10.47 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 124.18 0.992 . . . . 0.0 112.586 -176.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -49.78 -47.9 50.8 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-N 119.521 1.055 . . . . 0.0 111.565 -178.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 28.7 p-90 -52.91 -52.14 58.78 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.62 0.768 . . . . 0.0 111.286 176.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.9 mt -58.04 -49.27 77.46 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.585 0.754 . . . . 0.0 111.456 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.9 m -56.65 -44.1 80.98 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.166 0.986 . . . . 0.0 111.43 -175.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -75.39 -59.9 2.54 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.164 0.586 . . . . 0.0 110.982 177.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -63.71 -58.86 5.57 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.642 1.577 . . . . 0.0 112.095 -169.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -89.49 -51.43 5.54 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 123.358 0.663 . . . . 0.0 110.356 -172.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -89.43 46.22 1.35 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 -171.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 177.7 -65.48 0.08 OUTLIER Glycine 0 C--N 1.338 0.681 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -176.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.05 0 O-C-N 122.373 -0.487 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.4 m . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -67.15 116.16 7.64 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.372 0.669 . . . . 0.0 109.209 175.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -76.32 91.15 3.22 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 169.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -168.63 -154.12 8.71 Favored Glycine 0 CA--C 1.528 0.89 0 N-CA-C 109.1 -1.6 . . . . 0.0 109.1 -177.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -48.82 -39.14 39.04 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 124.49 3.46 . . . . 0.0 113.754 179.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 29.7 mt -103.52 29.36 5.73 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.999 0.919 . . . . 0.0 112.201 -175.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -62.46 -60.62 3.28 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 119.103 0.865 . . . . 0.0 109.516 175.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.6 p-90 -51.26 -43.31 61.51 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.051 1.34 . . . . 0.0 111.383 177.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -67.52 -51.97 44.55 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.241 1.016 . . . . 0.0 108.865 -174.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 53.0 t -59.03 -42.79 91.03 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.601 0.76 . . . . 0.0 111.89 179.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -63.79 -55.05 25.94 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 117.891 0.314 . . . . 0.0 110.926 177.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -64.87 -49.22 71.4 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.254 0.621 . . . . 0.0 111.766 -172.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -89.73 -59.4 2.22 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 123.492 0.717 . . . . 0.0 110.796 -176.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -89.72 28.31 1.35 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.043 0.537 . . . . 0.0 112.254 -169.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 80.42 -57.05 4.7 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 123.827 0.727 . . . . 0.0 112.587 176.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.097 0 O-C-N 121.937 -0.743 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 30.5 t . . . . . 0 N--CA 1.474 0.757 0 N-CA-C 111.679 0.252 . . . . 0.0 111.679 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.21 101.27 2.26 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 169.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -70.53 87.93 0.66 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.233 1.013 . . . . 0.0 109.876 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -159.55 -94.62 0.1 Allowed Glycine 0 CA--C 1.53 1.027 0 N-CA-C 110.157 -1.177 . . . . 0.0 110.157 173.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -69.55 -55.53 0.18 Allowed 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.222 2.615 . . . . 0.0 111.872 -172.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 56.1 mt -100.13 37.96 1.56 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.938 0.895 . . . . 0.0 109.945 -178.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -67.05 -60.36 2.69 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 123.48 0.712 . . . . 0.0 109.519 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 53.6 p-90 -46.37 -44.56 17.09 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.775 1.23 . . . . 0.0 111.038 174.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tt -67.24 -56.39 10.03 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.541 1.136 . . . . 0.0 109.45 -173.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.9 p -62.28 -40.73 97.21 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -176.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -65.47 -48.2 73.47 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 118.185 0.448 . . . . 0.0 110.879 178.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -68.77 -49.91 54.8 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.904 0.482 . . . . 0.0 112.015 -174.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -89.67 -51.86 5.3 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.26 0.624 . . . . 0.0 111.829 -171.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -89.35 -29.67 18.95 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.946 0.339 . . . . 0.0 111.441 -169.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.24 45.86 5.47 Favored Glycine 0 CA--C 1.528 0.859 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 -174.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 0.017 0 O-C-N 122.288 -0.536 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 56.1 m . . . . . 0 N--CA 1.475 0.806 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -80.46 159.33 25.64 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 173.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.8 157.36 34.94 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.271 0.628 . . . . 0.0 112.223 -177.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.58 -175.99 36.39 Favored Glycine 0 CA--C 1.531 1.059 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -177.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -51.26 -45.67 35.7 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 124.364 3.376 . . . . 0.0 112.171 176.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 28.8 mt -99.59 37.55 1.58 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.145 0.978 . . . . 0.0 110.528 -178.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -61.79 -62.24 1.94 Allowed 'General case' 0 C--N 1.343 0.285 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 174.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.4 p-90 -51.64 -45.14 63.22 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.051 1.34 . . . . 0.0 111.673 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -67.17 -51.97 47.12 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.455 1.102 . . . . 0.0 108.733 -173.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.5 t -58.67 -49.92 75.79 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.369 0.668 . . . . 0.0 111.021 178.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -54.87 -51.92 64.46 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.926 0.89 . . . . 0.0 111.148 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -71.05 -50.75 30.55 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 122.884 0.473 . . . . 0.0 111.623 -172.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -91.31 -52.28 4.88 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -171.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -89.47 -78.48 0.36 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.142 0.428 . . . . 0.0 111.11 -169.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -92.48 63.31 2.31 Favored Glycine 0 C--N 1.338 0.694 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 178.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.046 0 CA-C-N 116.633 0.217 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.475 0.807 0 CA-C-O 119.663 -0.208 . . . . 0.0 111.341 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -49.04 134.06 17.67 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.894 1.277 . . . . 0.0 111.565 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -84.75 -166.68 1.54 Allowed 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.436 1.095 . . . . 0.0 111.715 -174.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 89.21 -163.68 31.71 Favored Glycine 0 CA--C 1.531 1.069 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 -177.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -80.08 44.34 1.7 Allowed 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 123.907 3.072 . . . . 0.0 111.382 -177.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.4 tp -140.05 -24.77 0.81 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.677 1.991 . . . . 0.0 109.945 177.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -42.0 -56.31 2.84 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 126.176 1.79 . . . . 0.0 111.555 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 49.4 p-90 -48.07 -48.04 33.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.135 1.774 . . . . 0.0 111.957 177.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.1 tt -66.43 -48.21 70.73 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.368 1.467 . . . . 0.0 109.085 -176.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 49.1 t -61.61 -49.44 76.58 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 122.647 0.379 . . . . 0.0 111.466 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -62.12 -41.36 98.16 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 122.584 0.354 . . . . 0.0 111.726 -178.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.0 mtmt -66.31 -57.77 6.78 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 117.962 0.346 . . . . 0.0 111.606 176.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -95.6 -60.18 1.71 Allowed 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.657 0.783 . . . . 0.0 111.914 -169.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -89.67 41.03 1.02 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.17 0.588 . . . . 0.0 111.953 -169.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 79.0 -63.01 3.91 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 123.681 0.658 . . . . 0.0 112.157 178.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.067 0 CA-C-N 117.501 0.651 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 42.7 t . . . . . 0 N--CA 1.474 0.744 0 CA-C-O 120.12 0.01 . . . . 0.0 110.977 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -69.51 161.77 28.85 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.113 0.565 . . . . 0.0 110.358 175.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.87 160.95 27.4 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -173.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 164.75 -176.7 40.53 Favored Glycine 0 CA--C 1.531 1.037 0 N-CA-C 108.984 -1.647 . . . . 0.0 108.984 -172.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -63.07 -31.02 76.23 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 123.217 2.611 . . . . 0.0 112.156 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.0 mp -100.32 26.28 6.75 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.546 1.138 . . . . 0.0 111.285 178.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -64.0 -49.77 71.15 Favored 'General case' 0 C--N 1.341 0.236 0 O-C-N 121.395 -0.816 . . . . 0.0 110.831 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 53.0 p-90 -53.51 -43.1 68.03 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.077 0.551 . . . . 0.0 110.5 172.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tt -66.77 -51.07 60.03 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.484 1.114 . . . . 0.0 110.115 -171.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.0 p -61.06 -39.71 90.87 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -67.7 -50.33 58.14 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.445 0.566 . . . . 0.0 110.633 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -60.44 -59.33 5.57 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.094 1.357 . . . . 0.0 111.432 -175.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -89.53 -55.63 3.57 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.648 0.779 . . . . 0.0 110.875 -173.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -89.49 48.34 1.59 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 122.778 0.431 . . . . 0.0 110.409 -169.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -179.89 -65.94 0.07 OUTLIER Glycine 0 C--N 1.339 0.728 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -176.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.046 0 CA-C-N 116.964 0.382 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 90.5 m . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 55.4 ttt85 -63.4 102.03 0.37 Allowed 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 176.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.3 98.37 0.62 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.593 1.157 . . . . 0.0 112.301 -169.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 131.39 -72.91 0.47 Allowed Glycine 0 CA--C 1.525 0.71 0 N-CA-C 108.098 -2.001 . . . . 0.0 108.098 176.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo -49.49 -40.79 45.18 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 124.599 3.533 . . . . 0.0 114.332 175.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 94.0 mt -127.06 3.09 6.5 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.972 0.909 . . . . 0.0 113.302 -174.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -57.98 -57.1 14.31 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 119.623 1.101 . . . . 0.0 110.013 -178.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 46.0 p-90 -49.69 -44.86 48.27 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.2 1.4 . . . . 0.0 111.534 176.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tt -66.32 -51.32 58.5 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 124.453 1.101 . . . . 0.0 108.866 -173.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.1 m -61.1 -49.65 76.44 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 122.884 0.473 . . . . 0.0 111.284 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -54.76 -51.96 64.07 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.768 0.427 . . . . 0.0 111.165 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -68.7 -53.69 20.64 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.308 0.643 . . . . 0.0 111.926 -171.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -89.56 -45.59 9.28 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.252 0.621 . . . . 0.0 112.083 -170.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 5.0 m-30 -88.87 -41.95 12.15 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.318 0.508 . . . . 0.0 110.088 -169.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.17 -58.49 6.08 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 170.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.041 0 O-C-N 122.426 -0.455 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 40.8 t . . . . . 0 N--CA 1.473 0.711 0 CA-C-O 119.773 -0.156 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 19.6 tpp180 -57.0 130.65 47.01 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 123.629 0.772 . . . . 0.0 109.336 179.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -68.6 163.92 22.59 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -169.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 163.32 -175.35 39.61 Favored Glycine 0 CA--C 1.53 1.015 0 N-CA-C 108.369 -1.892 . . . . 0.0 108.369 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -51.18 -34.77 49.7 Favored 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 123.916 3.077 . . . . 0.0 113.32 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 39.0 mt -107.89 29.99 6.75 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.485 1.114 . . . . 0.0 111.809 -173.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -65.19 -50.7 64.92 Favored 'General case' 0 C--N 1.344 0.336 0 CA-C-N 119.33 0.968 . . . . 0.0 110.376 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.2 p-90 -49.99 -43.98 50.77 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.559 1.144 . . . . 0.0 111.047 174.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.56 -49.71 67.84 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.703 1.201 . . . . 0.0 108.925 -177.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.7 t -54.89 -54.63 40.12 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.681 1.192 . . . . 0.0 111.106 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -57.37 -55.5 33.92 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.142 0.977 . . . . 0.0 111.108 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -67.6 -51.45 50.2 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.176 0.59 . . . . 0.0 112.2 -169.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -89.36 -48.65 7.2 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 122.809 0.444 . . . . 0.0 111.724 -171.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -89.01 -37.78 14.92 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 -169.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.94 -61.81 3.61 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 173.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.046 0 O-C-N 122.448 -0.442 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 45.8 t . . . . . 0 N--CA 1.474 0.743 0 N-CA-C 111.048 0.018 . . . . 0.0 111.048 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -82.15 71.59 9.2 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 177.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.58 78.93 1.98 Allowed 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.07 1.348 . . . . 0.0 112.11 -169.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -179.79 -93.71 0.09 OUTLIER Glycine 0 CA--C 1.527 0.829 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 169.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -65.37 -42.52 12.89 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 123.293 2.662 . . . . 0.0 111.033 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 55.6 mt -105.32 34.0 3.44 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.414 1.086 . . . . 0.0 110.257 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -62.87 -42.3 99.71 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 123.359 0.663 . . . . 0.0 110.279 177.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 60.7 p-90 -60.13 -36.31 77.22 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.69 0.796 . . . . 0.0 111.104 174.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.66 -42.65 77.63 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 179.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 t -59.26 -53.12 61.89 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.431 0.692 . . . . 0.0 112.241 173.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.72 -25.71 66.64 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.104 0.411 . . . . 0.0 112.023 -172.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -90.05 -58.49 2.49 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.761 0.825 . . . . 0.0 111.035 176.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -89.55 -59.29 2.25 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 123.72 0.808 . . . . 0.0 111.794 -171.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -88.64 64.22 7.28 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 -169.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 82.11 57.35 2.68 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 -170.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.054 0 O-C-N 122.585 -0.362 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 54.0 t . . . . . 0 N--CA 1.473 0.704 0 CA-C-O 119.616 -0.23 . . . . 0.0 110.799 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -169.03 82.83 0.14 Allowed 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 107.675 -1.232 . . . . 0.0 107.675 175.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.38 78.08 5.9 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.796 0.839 . . . . 0.0 109.938 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -177.05 -98.82 0.11 Allowed Glycine 0 CA--C 1.529 0.929 0 N-CA-C 110.095 -1.202 . . . . 0.0 110.095 172.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -63.94 -41.56 22.81 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.249 2.633 . . . . 0.0 111.191 -177.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.8 mp -103.48 31.28 4.45 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.567 1.147 . . . . 0.0 110.186 176.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -57.73 -55.46 34.55 Favored 'General case' 0 C--N 1.343 0.289 0 O-C-N 121.41 -0.806 . . . . 0.0 109.417 174.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 45.7 p-90 -57.18 -41.39 79.21 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.889 1.276 . . . . 0.0 111.732 176.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.6 -49.72 65.39 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -174.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 95.2 m -55.03 -55.51 30.09 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.168 0.987 . . . . 0.0 110.91 172.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.11 -33.32 75.2 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.333 0.653 . . . . 0.0 112.149 -171.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -87.13 -53.6 4.78 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.664 0.785 . . . . 0.0 111.38 -174.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -89.52 -53.4 4.55 Favored 'General case' 0 C--N 1.34 0.179 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -169.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -89.21 -68.09 0.8 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 122.347 0.259 . . . . 0.0 111.194 -168.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -104.32 51.07 0.82 Allowed Glycine 0 CA--C 1.525 0.679 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 174.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.048 0 CA-C-N 117.113 0.457 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 50.1 t . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 111.223 0.082 . . . . 0.0 111.223 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 88.9 mtm180 -72.84 100.68 2.95 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.658 0.783 . . . . 0.0 109.782 -175.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -77.53 60.75 2.17 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.009 1.324 . . . . 0.0 111.177 -179.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -159.26 -80.11 0.03 OUTLIER Glycine 0 CA--C 1.527 0.795 0 N-CA-C 108.483 -1.847 . . . . 0.0 108.483 174.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -65.93 -43.01 10.08 Favored 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 123.32 2.68 . . . . 0.0 111.071 177.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.2 mp -101.48 19.98 16.87 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.34 1.056 . . . . 0.0 110.758 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -56.27 -49.54 73.91 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 120.027 1.285 . . . . 0.0 111.92 -174.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.6 p-90 -54.06 -38.56 65.39 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.154 1.382 . . . . 0.0 111.662 172.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.64 -45.47 75.24 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.225 1.01 . . . . 0.0 109.14 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 11.1 m -57.32 -50.45 72.89 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 124.097 0.959 . . . . 0.0 110.017 176.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.48 -43.22 73.63 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.927 0.491 . . . . 0.0 111.345 -172.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -77.82 -50.88 11.42 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.641 0.776 . . . . 0.0 111.351 -171.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -89.37 -57.55 2.85 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -175.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -89.73 47.25 1.44 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 122.875 0.47 . . . . 0.0 110.243 -170.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -80.44 67.9 3.42 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 124.098 0.856 . . . . 0.0 111.054 -174.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.089 0 O-C-N 122.404 -0.468 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 39.9 t . . . . . 0 N--CA 1.474 0.749 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 20.6 tpp85 -74.2 122.76 23.31 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 174.033 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.19 116.89 5.84 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.455 0.702 . . . . 0.0 109.829 176.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -167.53 -159.38 13.01 Favored Glycine 0 CA--C 1.531 1.084 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 -178.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -50.71 -34.75 45.14 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 124.62 3.546 . . . . 0.0 113.999 179.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.9 mt -99.93 22.67 10.85 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.34 1.056 . . . . 0.0 111.879 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -61.21 -55.74 28.63 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 118.778 0.717 . . . . 0.0 110.236 178.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 35.2 p-90 -52.03 -42.69 63.29 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.923 0.889 . . . . 0.0 111.411 177.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -64.16 -53.62 46.59 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 122.864 0.465 . . . . 0.0 111.71 178.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 18.6 p -61.64 -38.51 87.94 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -174.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -74.32 -55.42 6.03 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.045 0.538 . . . . 0.0 111.019 178.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -74.6 -53.61 9.04 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.334 0.654 . . . . 0.0 111.954 -169.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 69.6 m-85 -89.53 -54.91 3.87 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 123.381 0.672 . . . . 0.0 110.086 -172.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -89.71 37.49 0.88 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 117.887 0.312 . . . . 0.0 110.597 -173.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 173.36 -164.8 36.68 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 -174.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.065 0 O-C-N 122.392 -0.475 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 97.7 m . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 111.62 0.23 . . . . 0.0 111.62 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -80.94 73.4 7.96 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 169.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -69.27 79.85 0.36 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.644 1.578 . . . . 0.0 112.369 -169.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -171.81 -81.91 0.05 OUTLIER Glycine 0 CA--C 1.526 0.777 0 N-CA-C 107.561 -2.216 . . . . 0.0 107.561 172.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -65.56 -34.94 40.41 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 123.342 2.695 . . . . 0.0 111.225 172.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.5 tp -101.02 12.89 36.84 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.825 1.25 . . . . 0.0 111.432 -178.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -59.84 -56.42 22.03 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 123.589 0.755 . . . . 0.0 110.783 -174.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 50.3 p-90 -51.57 -39.58 58.13 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.927 1.291 . . . . 0.0 112.037 177.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.19 -45.51 84.52 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.012 0.925 . . . . 0.0 108.798 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 12.8 t -59.4 -46.59 88.27 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.33 0.652 . . . . 0.0 111.434 176.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -57.58 -55.38 35.63 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 123.705 0.802 . . . . 0.0 111.039 178.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -73.85 -52.34 13.33 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.722 0.809 . . . . 0.0 112.093 -169.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -89.91 -57.92 2.69 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.134 0.574 . . . . 0.0 111.065 -174.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -89.47 61.12 5.46 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.828 0.451 . . . . 0.0 110.948 -169.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 83.08 -61.64 4.75 Favored Glycine 0 CA--C 1.527 0.783 0 C-N-CA 123.967 0.794 . . . . 0.0 111.209 177.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.098 0 O-C-N 122.386 -0.479 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 30.9 t . . . . . 0 N--CA 1.474 0.731 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -83.69 78.31 9.71 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 106.548 -1.649 . . . . 0.0 106.548 169.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -76.54 62.87 1.97 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.335 1.454 . . . . 0.0 112.614 -169.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -161.45 -78.21 0.03 OUTLIER Glycine 0 CA--C 1.527 0.795 0 N-CA-C 108.149 -1.98 . . . . 0.0 108.149 172.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -64.61 -43.35 13.44 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 123.428 2.752 . . . . 0.0 111.672 177.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 36.3 mt -107.34 23.8 13.85 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.937 0.895 . . . . 0.0 111.091 -177.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -60.53 -56.04 26.13 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.651 0.66 . . . . 0.0 110.486 -175.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 57.7 p-90 -47.16 -42.18 19.21 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.55 1.54 . . . . 0.0 111.658 172.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -64.44 -47.84 77.56 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 125.218 1.407 . . . . 0.0 108.993 -176.051 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 57.5 m -56.43 -51.15 69.48 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.957 0.503 . . . . 0.0 110.93 176.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -60.04 -46.63 88.88 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 122.244 0.217 . . . . 0.0 111.483 -177.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.1 ttmm -67.7 -56.5 9.08 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.6 0.36 . . . . 0.0 111.7 -176.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -89.77 -50.08 6.26 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.399 0.68 . . . . 0.0 112.327 -169.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 -89.39 -19.16 25.53 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 122.636 0.374 . . . . 0.0 111.829 -169.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.04 44.56 11.65 Favored Glycine 0 CA--C 1.528 0.904 0 N-CA-C 110.69 -0.964 . . . . 0.0 110.69 -175.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.039 0 O-C-N 122.316 -0.52 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 38.9 t . . . . . 0 N--CA 1.474 0.75 0 N-CA-C 111.22 0.081 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 77.8 mtm180 -67.84 135.93 53.32 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.124 0.57 . . . . 0.0 109.759 -177.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -70.82 157.34 38.26 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -171.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 164.55 -175.73 40.52 Favored Glycine 0 CA--C 1.532 1.132 0 N-CA-C 109.132 -1.587 . . . . 0.0 109.132 -172.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -64.1 -27.11 65.28 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 123.485 2.79 . . . . 0.0 112.119 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 48.8 mt -102.48 26.4 7.91 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.327 1.051 . . . . 0.0 111.57 177.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -60.84 -53.74 53.62 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 118.972 0.805 . . . . 0.0 109.916 176.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 55.4 p-90 -50.57 -46.18 57.55 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.385 1.074 . . . . 0.0 110.753 177.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -64.67 -49.27 71.64 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.851 1.26 . . . . 0.0 109.053 -175.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 20.9 t -56.14 -55.25 35.32 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.123 0.969 . . . . 0.0 110.967 179.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -59.71 -48.42 81.75 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.583 0.753 . . . . 0.0 111.324 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -61.73 -60.13 4.13 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.645 1.178 . . . . 0.0 111.812 -175.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -89.69 -44.83 9.75 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 122.991 0.517 . . . . 0.0 112.019 -169.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -89.16 -40.55 12.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.241 0.473 . . . . 0.0 110.111 -169.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.72 -62.73 3.29 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 110.749 -0.941 . . . . 0.0 110.749 177.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.033 0 O-C-N 122.353 -0.498 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 30.2 t . . . . . 0 N--CA 1.473 0.722 0 CA-C-O 118.652 -0.69 . . . . 0.0 110.128 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.11 66.5 6.74 Favored 'General case' 0 C--N 1.341 0.233 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 169.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.23 126.2 26.47 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.962 0.905 . . . . 0.0 110.532 -173.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 109.92 -99.89 1.25 Allowed Glycine 0 CA--C 1.534 1.221 0 C-N-CA 125.006 1.289 . . . . 0.0 110.671 -174.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.64 -60.72 0.06 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 123.533 2.822 . . . . 0.0 113.399 -169.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.5 mt -99.94 31.83 3.14 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.42 0.688 . . . . 0.0 110.662 -173.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -71.78 -50.31 31.07 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.391 1.077 . . . . 0.0 109.301 -178.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.6 p-90 -58.99 -40.42 84.8 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.666 0.786 . . . . 0.0 110.922 172.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.7 -39.87 88.24 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.573 0.749 . . . . 0.0 109.285 -176.309 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 51.9 t -66.67 -51.99 49.89 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 122.694 0.398 . . . . 0.0 111.36 174.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.21 -27.17 68.24 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 117.962 0.346 . . . . 0.0 111.569 -177.205 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.5 tttp -83.88 -65.72 0.98 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.698 1.199 . . . . 0.0 110.815 178.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -90.3 -55.63 3.53 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 124.155 0.982 . . . . 0.0 111.978 -170.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -89.26 64.18 6.8 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 -169.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 82.18 57.59 2.62 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 108.861 -1.696 . . . . 0.0 108.861 -169.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.065 0 O-C-N 122.696 -0.296 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 42.5 t . . . . . 0 N--CA 1.475 0.823 0 N-CA-C 111.398 0.147 . . . . 0.0 111.398 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 94.7 mtt-85 -56.91 121.71 10.55 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.953 0.901 . . . . 0.0 109.585 176.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -69.49 159.07 33.98 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.008 0.523 . . . . 0.0 111.586 -174.108 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 158.83 -174.28 35.84 Favored Glycine 0 CA--C 1.53 0.98 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 -174.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -68.06 -11.35 31.77 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 123.456 2.77 . . . . 0.0 112.767 178.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 60.0 mt -109.56 15.57 22.81 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.795 1.238 . . . . 0.0 111.496 176.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -61.46 -50.98 70.6 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 118.996 0.816 . . . . 0.0 110.597 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 34.6 p-90 -54.17 -43.45 70.64 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.532 1.133 . . . . 0.0 111.401 178.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 12.7 mt -63.75 -49.84 71.45 Favored 'General case' 0 C--N 1.339 0.121 0 C-N-CA 122.96 0.504 . . . . 0.0 110.889 175.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 18.1 t -55.79 -44.67 77.98 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.729 0.811 . . . . 0.0 111.584 -177.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -75.86 -58.87 3.02 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.784 0.834 . . . . 0.0 111.013 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -71.76 -54.86 8.89 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.773 0.829 . . . . 0.0 112.944 -169.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -89.12 -45.36 9.65 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 123.19 0.596 . . . . 0.0 111.16 -169.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -88.94 -43.45 11.15 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 -169.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.62 -61.44 4.12 Favored Glycine 0 CA--C 1.528 0.854 0 N-CA-C 110.13 -1.188 . . . . 0.0 110.13 172.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.041 0 O-C-N 122.354 -0.498 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.6 t . . . . . 0 N--CA 1.475 0.813 0 CA-C-O 119.823 -0.132 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -45.91 111.25 0.33 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.407 1.483 . . . . 0.0 110.314 175.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.98 69.96 5.23 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.233 1.013 . . . . 0.0 110.648 -175.551 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -111.01 -165.87 18.74 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.0 1.286 . . . . 0.0 110.648 177.183 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -52.04 -35.62 62.12 Favored 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 124.271 3.314 . . . . 0.0 113.003 175.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.2 mt -99.82 27.97 5.08 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.588 1.155 . . . . 0.0 111.446 -177.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -58.68 -54.89 42.02 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 123.691 0.796 . . . . 0.0 110.447 177.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 57.3 p-90 -55.32 -39.52 70.06 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.996 1.318 . . . . 0.0 111.283 176.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -66.17 -49.96 65.57 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 -176.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.4 t -57.6 -52.69 64.37 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.138 0.575 . . . . 0.0 111.287 176.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.13 -41.39 96.64 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.697 0.399 . . . . 0.0 111.043 -174.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -76.14 -53.38 8.38 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.729 0.812 . . . . 0.0 111.338 -174.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -89.31 -45.82 9.22 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 122.872 0.469 . . . . 0.0 112.025 -170.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -88.86 -42.05 12.1 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -169.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -73.63 -63.38 2.75 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 172.122 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 -0.02 0 O-C-N 122.303 -0.528 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo . . . . . 0 N--CA 1.454 -0.8 0 CA-C-O 118.87 -0.554 . . . . 0.0 112.458 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 88.9 mt -112.69 1.44 15.7 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-O 118.288 -0.863 . . . . 0.0 112.704 -178.474 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -55.2 -54.72 39.75 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 119.76 1.164 . . . . 0.0 111.596 -173.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 45.7 p-90 -49.99 -44.03 50.79 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.052 1.341 . . . . 0.0 111.652 174.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.0 -49.08 66.45 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.004 1.322 . . . . 0.0 109.245 -174.093 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 77.3 m -61.09 -44.94 96.59 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.343 1.057 . . . . 0.0 111.338 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -65.84 -50.6 64.01 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.867 0.303 . . . . 0.0 111.114 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -68.11 -52.25 37.04 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.773 0.429 . . . . 0.0 111.673 -172.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -89.69 -55.44 3.64 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 123.519 0.728 . . . . 0.0 110.972 -175.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.9 m-30 . . . . . 0 CA--C 1.537 0.466 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -169.759 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo . . . . . 0 N--CA 1.459 -0.529 0 N-CA-C 114.25 0.827 . . . . 0.0 114.25 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 50.2 mt -102.41 15.91 27.83 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.246 0.618 . . . . 0.0 111.969 -172.722 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 30.0 tp60 -57.28 -47.56 81.14 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 118.984 0.811 . . . . 0.0 111.319 -174.449 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 34.5 p-90 -54.61 -46.49 73.85 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.449 1.1 . . . . 0.0 111.456 176.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.0 mt -59.25 -42.64 91.61 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.807 0.843 . . . . 0.0 111.164 175.208 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.5 m -58.74 -54.31 48.48 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 117.902 0.319 . . . . 0.0 110.669 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -69.18 -37.65 78.26 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.04 0.536 . . . . 0.0 112.249 -175.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -89.78 -56.19 3.34 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.152 0.581 . . . . 0.0 111.52 -170.349 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -89.43 -49.26 6.8 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 123.313 0.645 . . . . 0.0 111.28 -173.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 . . . . . 0 CA--C 1.531 0.24 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 -169.566 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo . . . . . 0 N--CA 1.457 -0.637 0 N-CA-C 113.618 0.584 . . . . 0.0 113.618 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 89.5 mt -119.38 -3.64 10.47 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 124.18 0.992 . . . . 0.0 112.586 -176.571 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -49.78 -47.9 50.8 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-N 119.521 1.055 . . . . 0.0 111.565 -178.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 28.7 p-90 -52.91 -52.14 58.78 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.62 0.768 . . . . 0.0 111.286 176.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.9 mt -58.04 -49.27 77.46 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.585 0.754 . . . . 0.0 111.456 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.9 m -56.65 -44.1 80.98 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.166 0.986 . . . . 0.0 111.43 -175.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -75.39 -59.9 2.54 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.164 0.586 . . . . 0.0 110.982 177.648 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -63.71 -58.86 5.57 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.642 1.577 . . . . 0.0 112.095 -169.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -89.49 -51.43 5.54 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 123.358 0.663 . . . . 0.0 110.356 -172.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 . . . . . 0 CA--C 1.535 0.392 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 -171.505 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo . . . . . 0 N--CA 1.456 -0.716 0 N-CA-C 113.754 0.636 . . . . 0.0 113.754 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 29.7 mt -103.52 29.36 5.73 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.999 0.919 . . . . 0.0 112.201 -175.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -62.46 -60.62 3.28 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 119.103 0.865 . . . . 0.0 109.516 175.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.6 p-90 -51.26 -43.31 61.51 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.051 1.34 . . . . 0.0 111.383 177.443 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -67.52 -51.97 44.55 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.241 1.016 . . . . 0.0 108.865 -174.54 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 53.0 t -59.03 -42.79 91.03 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.601 0.76 . . . . 0.0 111.89 179.242 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -63.79 -55.05 25.94 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 117.891 0.314 . . . . 0.0 110.926 177.174 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -64.87 -49.22 71.4 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.254 0.621 . . . . 0.0 111.766 -172.422 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -89.73 -59.4 2.22 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 123.492 0.717 . . . . 0.0 110.796 -176.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 . . . . . 0 CA--C 1.536 0.44 0 C-N-CA 123.043 0.537 . . . . 0.0 112.254 -169.561 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo . . . . . 0 N--CA 1.457 -0.637 0 CA-C-O 119.878 -0.134 . . . . 0.0 111.872 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 56.1 mt -100.13 37.96 1.56 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.938 0.895 . . . . 0.0 109.945 -178.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -67.05 -60.36 2.69 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 123.48 0.712 . . . . 0.0 109.519 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 53.6 p-90 -46.37 -44.56 17.09 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.775 1.23 . . . . 0.0 111.038 174.164 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tt -67.24 -56.39 10.03 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.541 1.136 . . . . 0.0 109.45 -173.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.9 p -62.28 -40.73 97.21 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -176.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -65.47 -48.2 73.47 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 118.185 0.448 . . . . 0.0 110.879 178.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -68.77 -49.91 54.8 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.904 0.482 . . . . 0.0 112.015 -174.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -89.67 -51.86 5.3 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.26 0.624 . . . . 0.0 111.829 -171.707 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 . . . . . 0 CA--C 1.532 0.278 0 CA-C-N 117.946 0.339 . . . . 0.0 111.441 -169.516 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo . . . . . 0 N--CA 1.457 -0.619 0 CA-C-O 120.309 0.045 . . . . 0.0 112.171 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 28.8 mt -99.59 37.55 1.58 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.145 0.978 . . . . 0.0 110.528 -178.167 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -61.79 -62.24 1.94 Allowed 'General case' 0 C--N 1.343 0.285 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 174.563 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.4 p-90 -51.64 -45.14 63.22 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.051 1.34 . . . . 0.0 111.673 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -67.17 -51.97 47.12 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.455 1.102 . . . . 0.0 108.733 -173.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.5 t -58.67 -49.92 75.79 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.369 0.668 . . . . 0.0 111.021 178.31 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -54.87 -51.92 64.46 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.926 0.89 . . . . 0.0 111.148 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -71.05 -50.75 30.55 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 122.884 0.473 . . . . 0.0 111.623 -172.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -91.31 -52.28 4.88 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -171.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 . . . . . 0 CA--C 1.533 0.322 0 CA-C-N 118.142 0.428 . . . . 0.0 111.11 -169.028 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo . . . . . 0 CA--C 1.539 0.728 0 CA-C-O 120.959 0.316 . . . . 0.0 111.382 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.4 tp -140.05 -24.77 0.81 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.677 1.991 . . . . 0.0 109.945 177.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -42.0 -56.31 2.84 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 126.176 1.79 . . . . 0.0 111.555 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 49.4 p-90 -48.07 -48.04 33.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.135 1.774 . . . . 0.0 111.957 177.023 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.1 tt -66.43 -48.21 70.73 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.368 1.467 . . . . 0.0 109.085 -176.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 49.1 t -61.61 -49.44 76.58 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 122.647 0.379 . . . . 0.0 111.466 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -62.12 -41.36 98.16 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 122.584 0.354 . . . . 0.0 111.726 -178.324 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.0 mtmt -66.31 -57.77 6.78 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 117.962 0.346 . . . . 0.0 111.606 176.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -95.6 -60.18 1.71 Allowed 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.657 0.783 . . . . 0.0 111.914 -169.437 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 . . . . . 0 CA--C 1.536 0.432 0 C-N-CA 123.17 0.588 . . . . 0.0 111.953 -169.924 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo . . . . . 0 N--CA 1.457 -0.671 0 CA-C-O 119.211 -0.412 . . . . 0.0 112.156 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.0 mp -100.32 26.28 6.75 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.546 1.138 . . . . 0.0 111.285 178.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -64.0 -49.77 71.15 Favored 'General case' 0 C--N 1.341 0.236 0 O-C-N 121.395 -0.816 . . . . 0.0 110.831 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 53.0 p-90 -53.51 -43.1 68.03 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.077 0.551 . . . . 0.0 110.5 172.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tt -66.77 -51.07 60.03 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.484 1.114 . . . . 0.0 110.115 -171.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.0 p -61.06 -39.71 90.87 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -67.7 -50.33 58.14 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.445 0.566 . . . . 0.0 110.633 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -60.44 -59.33 5.57 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.094 1.357 . . . . 0.0 111.432 -175.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -89.53 -55.63 3.57 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.648 0.779 . . . . 0.0 110.875 -173.247 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 CA--C 1.535 0.401 0 C-N-CA 122.778 0.431 . . . . 0.0 110.409 -169.797 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo . . . . . 0 N--CA 1.456 -0.678 0 N-CA-C 114.332 0.858 . . . . 0.0 114.332 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 94.0 mt -127.06 3.09 6.5 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.972 0.909 . . . . 0.0 113.302 -174.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -57.98 -57.1 14.31 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 119.623 1.101 . . . . 0.0 110.013 -178.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 46.0 p-90 -49.69 -44.86 48.27 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.2 1.4 . . . . 0.0 111.534 176.273 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tt -66.32 -51.32 58.5 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 124.453 1.101 . . . . 0.0 108.866 -173.094 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.1 m -61.1 -49.65 76.44 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 122.884 0.473 . . . . 0.0 111.284 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -54.76 -51.96 64.07 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.768 0.427 . . . . 0.0 111.165 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -68.7 -53.69 20.64 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.308 0.643 . . . . 0.0 111.926 -171.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -89.56 -45.59 9.28 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.252 0.621 . . . . 0.0 112.083 -170.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 5.0 m-30 . . . . . 0 CA--C 1.53 0.18 0 CA-C-N 118.318 0.508 . . . . 0.0 110.088 -169.601 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo . . . . . 0 N--CA 1.457 -0.646 0 N-CA-C 113.32 0.469 . . . . 0.0 113.32 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 39.0 mt -107.89 29.99 6.75 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.485 1.114 . . . . 0.0 111.809 -173.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -65.19 -50.7 64.92 Favored 'General case' 0 C--N 1.344 0.336 0 CA-C-N 119.33 0.968 . . . . 0.0 110.376 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.2 p-90 -49.99 -43.98 50.77 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.559 1.144 . . . . 0.0 111.047 174.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.56 -49.71 67.84 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.703 1.201 . . . . 0.0 108.925 -177.352 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.7 t -54.89 -54.63 40.12 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.681 1.192 . . . . 0.0 111.106 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -57.37 -55.5 33.92 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.142 0.977 . . . . 0.0 111.108 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -67.6 -51.45 50.2 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.176 0.59 . . . . 0.0 112.2 -169.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -89.36 -48.65 7.2 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 122.809 0.444 . . . . 0.0 111.724 -171.081 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 . . . . . 0 CA--C 1.53 0.209 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 -169.468 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 N--CA 1.456 -0.727 0 N-CA-C 111.033 -0.41 . . . . 0.0 111.033 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 55.6 mt -105.32 34.0 3.44 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.414 1.086 . . . . 0.0 110.257 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -62.87 -42.3 99.71 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 123.359 0.663 . . . . 0.0 110.279 177.003 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 60.7 p-90 -60.13 -36.31 77.22 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.69 0.796 . . . . 0.0 111.104 174.183 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.66 -42.65 77.63 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 179.468 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 t -59.26 -53.12 61.89 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.431 0.692 . . . . 0.0 112.241 173.599 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.72 -25.71 66.64 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.104 0.411 . . . . 0.0 112.023 -172.179 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -90.05 -58.49 2.49 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.761 0.825 . . . . 0.0 111.035 176.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -89.55 -59.29 2.25 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 123.72 0.808 . . . . 0.0 111.794 -171.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 . . . . . 0 CA--C 1.531 0.243 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 -169.779 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo . . . . . 0 N--CA 1.456 -0.723 0 N-CA-C 111.191 -0.35 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.8 mp -103.48 31.28 4.45 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.567 1.147 . . . . 0.0 110.186 176.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -57.73 -55.46 34.55 Favored 'General case' 0 C--N 1.343 0.289 0 O-C-N 121.41 -0.806 . . . . 0.0 109.417 174.355 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 45.7 p-90 -57.18 -41.39 79.21 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.889 1.276 . . . . 0.0 111.732 176.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.6 -49.72 65.39 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -174.552 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 95.2 m -55.03 -55.51 30.09 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.168 0.987 . . . . 0.0 110.91 172.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.11 -33.32 75.2 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.333 0.653 . . . . 0.0 112.149 -171.423 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -87.13 -53.6 4.78 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.664 0.785 . . . . 0.0 111.38 -174.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -89.52 -53.4 4.55 Favored 'General case' 0 C--N 1.34 0.179 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -169.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 . . . . . 0 CA--C 1.529 0.144 0 C-N-CA 122.347 0.259 . . . . 0.0 111.194 -168.656 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo . . . . . 0 N--CA 1.454 -0.812 0 N-CA-C 111.071 -0.396 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.2 mp -101.48 19.98 16.87 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.34 1.056 . . . . 0.0 110.758 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -56.27 -49.54 73.91 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 120.027 1.285 . . . . 0.0 111.92 -174.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.6 p-90 -54.06 -38.56 65.39 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.154 1.382 . . . . 0.0 111.662 172.38 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.64 -45.47 75.24 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.225 1.01 . . . . 0.0 109.14 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 11.1 m -57.32 -50.45 72.89 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 124.097 0.959 . . . . 0.0 110.017 176.063 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.48 -43.22 73.63 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.927 0.491 . . . . 0.0 111.345 -172.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -77.82 -50.88 11.42 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.641 0.776 . . . . 0.0 111.351 -171.517 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -89.37 -57.55 2.85 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -175.187 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 . . . . . 0 CA--C 1.534 0.36 0 C-N-CA 122.875 0.47 . . . . 0.0 110.243 -170.915 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo . . . . . 0 N--CA 1.458 -0.578 0 N-CA-C 113.999 0.73 . . . . 0.0 113.999 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.9 mt -99.93 22.67 10.85 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.34 1.056 . . . . 0.0 111.879 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -61.21 -55.74 28.63 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 118.778 0.717 . . . . 0.0 110.236 178.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 35.2 p-90 -52.03 -42.69 63.29 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.923 0.889 . . . . 0.0 111.411 177.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -64.16 -53.62 46.59 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 122.864 0.465 . . . . 0.0 111.71 178.179 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 18.6 p -61.64 -38.51 87.94 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -174.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -74.32 -55.42 6.03 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.045 0.538 . . . . 0.0 111.019 178.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -74.6 -53.61 9.04 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.334 0.654 . . . . 0.0 111.954 -169.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 69.6 m-85 -89.53 -54.91 3.87 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 123.381 0.672 . . . . 0.0 110.086 -172.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 . . . . . 0 CA--C 1.536 0.42 0 CA-C-N 117.887 0.312 . . . . 0.0 110.597 -173.405 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo . . . . . 0 N--CA 1.456 -0.722 0 N-CA-C 111.225 -0.337 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.5 tp -101.02 12.89 36.84 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.825 1.25 . . . . 0.0 111.432 -178.565 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -59.84 -56.42 22.03 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 123.589 0.755 . . . . 0.0 110.783 -174.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 50.3 p-90 -51.57 -39.58 58.13 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.927 1.291 . . . . 0.0 112.037 177.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.19 -45.51 84.52 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.012 0.925 . . . . 0.0 108.798 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 12.8 t -59.4 -46.59 88.27 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.33 0.652 . . . . 0.0 111.434 176.004 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -57.58 -55.38 35.63 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 123.705 0.802 . . . . 0.0 111.039 178.365 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -73.85 -52.34 13.33 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.722 0.809 . . . . 0.0 112.093 -169.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -89.91 -57.92 2.69 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.134 0.574 . . . . 0.0 111.065 -174.204 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 . . . . . 0 CA--C 1.532 0.255 0 C-N-CA 122.828 0.451 . . . . 0.0 110.948 -169.14 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo . . . . . 0 N--CA 1.454 -0.798 0 CA-C-O 119.556 -0.268 . . . . 0.0 111.672 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 36.3 mt -107.34 23.8 13.85 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.937 0.895 . . . . 0.0 111.091 -177.185 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -60.53 -56.04 26.13 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.651 0.66 . . . . 0.0 110.486 -175.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 57.7 p-90 -47.16 -42.18 19.21 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.55 1.54 . . . . 0.0 111.658 172.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -64.44 -47.84 77.56 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 125.218 1.407 . . . . 0.0 108.993 -176.051 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 57.5 m -56.43 -51.15 69.48 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.957 0.503 . . . . 0.0 110.93 176.644 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -60.04 -46.63 88.88 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 122.244 0.217 . . . . 0.0 111.483 -177.824 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.1 ttmm -67.7 -56.5 9.08 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.6 0.36 . . . . 0.0 111.7 -176.65 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -89.77 -50.08 6.26 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.399 0.68 . . . . 0.0 112.327 -169.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 . . . . . 0 CA--C 1.535 0.372 0 C-N-CA 122.636 0.374 . . . . 0.0 111.829 -169.635 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo . . . . . 0 N--CA 1.456 -0.678 0 CA-C-O 119.323 -0.365 . . . . 0.0 112.119 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 48.8 mt -102.48 26.4 7.91 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.327 1.051 . . . . 0.0 111.57 177.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -60.84 -53.74 53.62 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 118.972 0.805 . . . . 0.0 109.916 176.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 55.4 p-90 -50.57 -46.18 57.55 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.385 1.074 . . . . 0.0 110.753 177.066 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -64.67 -49.27 71.64 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.851 1.26 . . . . 0.0 109.053 -175.664 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 20.9 t -56.14 -55.25 35.32 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.123 0.969 . . . . 0.0 110.967 179.146 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -59.71 -48.42 81.75 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.583 0.753 . . . . 0.0 111.324 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -61.73 -60.13 4.13 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.645 1.178 . . . . 0.0 111.812 -175.494 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -89.69 -44.83 9.75 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 122.991 0.517 . . . . 0.0 112.019 -169.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 . . . . . 0 CA--C 1.531 0.232 0 CA-C-N 118.241 0.473 . . . . 0.0 110.111 -169.801 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo . . . . . 0 N--CA 1.457 -0.662 0 N-CA-C 113.399 0.5 . . . . 0.0 113.399 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.5 mt -99.94 31.83 3.14 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.42 0.688 . . . . 0.0 110.662 -173.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -71.78 -50.31 31.07 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.391 1.077 . . . . 0.0 109.301 -178.628 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.6 p-90 -58.99 -40.42 84.8 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.666 0.786 . . . . 0.0 110.922 172.594 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.7 -39.87 88.24 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.573 0.749 . . . . 0.0 109.285 -176.309 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 51.9 t -66.67 -51.99 49.89 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 122.694 0.398 . . . . 0.0 111.36 174.429 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.21 -27.17 68.24 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 117.962 0.346 . . . . 0.0 111.569 -177.205 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.5 tttp -83.88 -65.72 0.98 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.698 1.199 . . . . 0.0 110.815 178.305 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -90.3 -55.63 3.53 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 124.155 0.982 . . . . 0.0 111.978 -170.342 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 . . . . . 0 CA--C 1.531 0.234 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 -169.972 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo . . . . . 0 N--CA 1.456 -0.686 0 CA-C-O 118.97 -0.513 . . . . 0.0 112.767 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 60.0 mt -109.56 15.57 22.81 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.795 1.238 . . . . 0.0 111.496 176.381 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -61.46 -50.98 70.6 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 118.996 0.816 . . . . 0.0 110.597 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 34.6 p-90 -54.17 -43.45 70.64 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.532 1.133 . . . . 0.0 111.401 178.787 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 12.7 mt -63.75 -49.84 71.45 Favored 'General case' 0 C--N 1.339 0.121 0 C-N-CA 122.96 0.504 . . . . 0.0 110.889 175.294 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 18.1 t -55.79 -44.67 77.98 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.729 0.811 . . . . 0.0 111.584 -177.201 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -75.86 -58.87 3.02 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.784 0.834 . . . . 0.0 111.013 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -71.76 -54.86 8.89 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.773 0.829 . . . . 0.0 112.944 -169.219 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -89.12 -45.36 9.65 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 123.19 0.596 . . . . 0.0 111.16 -169.527 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 . . . . . 0 CA--C 1.531 0.215 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 -169.767 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo . . . . . 0 N--CA 1.458 -0.612 0 N-CA-C 113.003 0.347 . . . . 0.0 113.003 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.2 mt -99.82 27.97 5.08 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.588 1.155 . . . . 0.0 111.446 -177.114 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -58.68 -54.89 42.02 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 123.691 0.796 . . . . 0.0 110.447 177.3 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 57.3 p-90 -55.32 -39.52 70.06 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.996 1.318 . . . . 0.0 111.283 176.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -66.17 -49.96 65.57 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 -176.649 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.4 t -57.6 -52.69 64.37 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.138 0.575 . . . . 0.0 111.287 176.651 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.13 -41.39 96.64 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.697 0.399 . . . . 0.0 111.043 -174.42 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -76.14 -53.38 8.38 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.729 0.812 . . . . 0.0 111.338 -174.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -89.31 -45.82 9.22 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 122.872 0.469 . . . . 0.0 112.025 -170.302 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 . . . . . 0 CA--C 1.531 0.222 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -169.407 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 47.5 t . . . . . 0 N--CA 1.473 0.715 0 N-CA-C 111.385 0.143 . . . . 0.0 111.385 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 71.5 mtm180 -73.02 105.22 4.39 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 170.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.39 68.49 2.08 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.006 1.322 . . . . 0.0 110.938 -176.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 179.72 -78.18 0.06 OUTLIER Glycine 0 CA--C 1.527 0.814 0 N-CA-C 109.011 -1.635 . . . . 0.0 109.011 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -69.23 -32.7 20.21 Favored 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 123.502 2.801 . . . . 0.0 112.458 -176.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 88.9 mt -112.69 1.44 15.7 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-O 118.288 -0.863 . . . . 0.0 112.704 -178.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -55.2 -54.72 39.75 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 119.76 1.164 . . . . 0.0 111.596 -173.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 45.7 p-90 -49.99 -44.03 50.79 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.052 1.341 . . . . 0.0 111.652 174.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.0 -49.08 66.45 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.004 1.322 . . . . 0.0 109.245 -174.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 77.3 m -61.09 -44.94 96.59 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.343 1.057 . . . . 0.0 111.338 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -65.84 -50.6 64.01 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.867 0.303 . . . . 0.0 111.114 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -68.11 -52.25 37.04 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.773 0.429 . . . . 0.0 111.673 -172.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -89.69 -55.44 3.64 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 123.519 0.728 . . . . 0.0 110.972 -175.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.9 m-30 -89.45 21.73 3.25 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -169.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.26 -56.85 4.88 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 123.677 0.656 . . . . 0.0 112.129 178.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.074 0 O-C-N 122.115 -0.638 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 41.6 t . . . . . 0 N--CA 1.473 0.716 0 CA-C-O 119.564 -0.255 . . . . 0.0 111.4 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -81.08 82.41 7.03 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 170.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.06 141.79 38.85 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.357 1.063 . . . . 0.0 110.681 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 97.34 -93.4 1.43 Allowed Glycine 0 CA--C 1.533 1.16 0 N-CA-C 108.996 -1.642 . . . . 0.0 108.996 -169.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -54.96 -53.49 5.91 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 123.424 2.75 . . . . 0.0 114.25 -175.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 50.2 mt -102.41 15.91 27.83 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.246 0.618 . . . . 0.0 111.969 -172.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 30.0 tp60 -57.28 -47.56 81.14 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 118.984 0.811 . . . . 0.0 111.319 -174.449 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 34.5 p-90 -54.61 -46.49 73.85 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.449 1.1 . . . . 0.0 111.456 176.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.0 mt -59.25 -42.64 91.61 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.807 0.843 . . . . 0.0 111.164 175.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.5 m -58.74 -54.31 48.48 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 117.902 0.319 . . . . 0.0 110.669 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -69.18 -37.65 78.26 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.04 0.536 . . . . 0.0 112.249 -175.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -89.78 -56.19 3.34 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.152 0.581 . . . . 0.0 111.52 -170.349 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -89.43 -49.26 6.8 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 123.313 0.645 . . . . 0.0 111.28 -173.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -88.87 62.88 6.57 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 -169.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.22 55.97 4.16 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 109.189 -1.564 . . . . 0.0 109.189 -169.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.049 0 O-C-N 122.564 -0.374 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 47.3 t . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 111.375 0.139 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 28.4 mmm180 -70.77 106.56 3.61 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 172.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.29 72.53 1.79 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.042 1.337 . . . . 0.0 111.712 -170.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 154.0 -68.67 0.3 Allowed Glycine 0 CA--C 1.527 0.813 0 N-CA-C 108.158 -1.977 . . . . 0.0 108.158 177.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -50.87 -45.17 37.47 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 124.377 3.385 . . . . 0.0 113.618 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 89.5 mt -119.38 -3.64 10.47 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 124.18 0.992 . . . . 0.0 112.586 -176.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -49.78 -47.9 50.8 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-N 119.521 1.055 . . . . 0.0 111.565 -178.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 28.7 p-90 -52.91 -52.14 58.78 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.62 0.768 . . . . 0.0 111.286 176.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.9 mt -58.04 -49.27 77.46 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.585 0.754 . . . . 0.0 111.456 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.9 m -56.65 -44.1 80.98 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.166 0.986 . . . . 0.0 111.43 -175.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -75.39 -59.9 2.54 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.164 0.586 . . . . 0.0 110.982 177.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -63.71 -58.86 5.57 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.642 1.577 . . . . 0.0 112.095 -169.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -89.49 -51.43 5.54 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 123.358 0.663 . . . . 0.0 110.356 -172.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -89.43 46.22 1.35 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 -171.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 177.7 -65.48 0.08 OUTLIER Glycine 0 C--N 1.338 0.681 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -176.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.05 0 O-C-N 122.373 -0.487 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.4 m . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -67.15 116.16 7.64 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.372 0.669 . . . . 0.0 109.209 175.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -76.32 91.15 3.22 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 169.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -168.63 -154.12 8.71 Favored Glycine 0 CA--C 1.528 0.89 0 N-CA-C 109.1 -1.6 . . . . 0.0 109.1 -177.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -48.82 -39.14 39.04 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 124.49 3.46 . . . . 0.0 113.754 179.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 29.7 mt -103.52 29.36 5.73 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.999 0.919 . . . . 0.0 112.201 -175.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -62.46 -60.62 3.28 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 119.103 0.865 . . . . 0.0 109.516 175.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.6 p-90 -51.26 -43.31 61.51 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.051 1.34 . . . . 0.0 111.383 177.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -67.52 -51.97 44.55 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.241 1.016 . . . . 0.0 108.865 -174.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 53.0 t -59.03 -42.79 91.03 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.601 0.76 . . . . 0.0 111.89 179.242 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -63.79 -55.05 25.94 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 117.891 0.314 . . . . 0.0 110.926 177.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -64.87 -49.22 71.4 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.254 0.621 . . . . 0.0 111.766 -172.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -89.73 -59.4 2.22 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 123.492 0.717 . . . . 0.0 110.796 -176.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -89.72 28.31 1.35 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.043 0.537 . . . . 0.0 112.254 -169.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 80.42 -57.05 4.7 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 123.827 0.727 . . . . 0.0 112.587 176.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.097 0 O-C-N 121.937 -0.743 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 30.5 t . . . . . 0 N--CA 1.474 0.757 0 N-CA-C 111.679 0.252 . . . . 0.0 111.679 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.21 101.27 2.26 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 169.715 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -70.53 87.93 0.66 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.233 1.013 . . . . 0.0 109.876 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -159.55 -94.62 0.1 Allowed Glycine 0 CA--C 1.53 1.027 0 N-CA-C 110.157 -1.177 . . . . 0.0 110.157 173.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -69.55 -55.53 0.18 Allowed 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.222 2.615 . . . . 0.0 111.872 -172.028 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 56.1 mt -100.13 37.96 1.56 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.938 0.895 . . . . 0.0 109.945 -178.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -67.05 -60.36 2.69 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 123.48 0.712 . . . . 0.0 109.519 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 53.6 p-90 -46.37 -44.56 17.09 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.775 1.23 . . . . 0.0 111.038 174.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tt -67.24 -56.39 10.03 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.541 1.136 . . . . 0.0 109.45 -173.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.9 p -62.28 -40.73 97.21 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -176.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -65.47 -48.2 73.47 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 118.185 0.448 . . . . 0.0 110.879 178.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -68.77 -49.91 54.8 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.904 0.482 . . . . 0.0 112.015 -174.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -89.67 -51.86 5.3 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.26 0.624 . . . . 0.0 111.829 -171.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -89.35 -29.67 18.95 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.946 0.339 . . . . 0.0 111.441 -169.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.24 45.86 5.47 Favored Glycine 0 CA--C 1.528 0.859 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 -174.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 0.017 0 O-C-N 122.288 -0.536 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 56.1 m . . . . . 0 N--CA 1.475 0.806 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -80.46 159.33 25.64 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 173.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.8 157.36 34.94 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.271 0.628 . . . . 0.0 112.223 -177.309 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.58 -175.99 36.39 Favored Glycine 0 CA--C 1.531 1.059 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -177.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -51.26 -45.67 35.7 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 124.364 3.376 . . . . 0.0 112.171 176.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 28.8 mt -99.59 37.55 1.58 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.145 0.978 . . . . 0.0 110.528 -178.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -61.79 -62.24 1.94 Allowed 'General case' 0 C--N 1.343 0.285 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 174.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.4 p-90 -51.64 -45.14 63.22 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.051 1.34 . . . . 0.0 111.673 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -67.17 -51.97 47.12 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.455 1.102 . . . . 0.0 108.733 -173.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.5 t -58.67 -49.92 75.79 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.369 0.668 . . . . 0.0 111.021 178.31 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -54.87 -51.92 64.46 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.926 0.89 . . . . 0.0 111.148 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -71.05 -50.75 30.55 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 122.884 0.473 . . . . 0.0 111.623 -172.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -91.31 -52.28 4.88 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -171.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -89.47 -78.48 0.36 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.142 0.428 . . . . 0.0 111.11 -169.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -92.48 63.31 2.31 Favored Glycine 0 C--N 1.338 0.694 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 178.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.046 0 CA-C-N 116.633 0.217 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.475 0.807 0 CA-C-O 119.663 -0.208 . . . . 0.0 111.341 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -49.04 134.06 17.67 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.894 1.277 . . . . 0.0 111.565 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -84.75 -166.68 1.54 Allowed 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.436 1.095 . . . . 0.0 111.715 -174.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 89.21 -163.68 31.71 Favored Glycine 0 CA--C 1.531 1.069 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 -177.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -80.08 44.34 1.7 Allowed 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 123.907 3.072 . . . . 0.0 111.382 -177.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.4 tp -140.05 -24.77 0.81 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.677 1.991 . . . . 0.0 109.945 177.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -42.0 -56.31 2.84 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 126.176 1.79 . . . . 0.0 111.555 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 49.4 p-90 -48.07 -48.04 33.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.135 1.774 . . . . 0.0 111.957 177.023 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.1 tt -66.43 -48.21 70.73 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.368 1.467 . . . . 0.0 109.085 -176.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 49.1 t -61.61 -49.44 76.58 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 122.647 0.379 . . . . 0.0 111.466 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -62.12 -41.36 98.16 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 122.584 0.354 . . . . 0.0 111.726 -178.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.0 mtmt -66.31 -57.77 6.78 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 117.962 0.346 . . . . 0.0 111.606 176.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -95.6 -60.18 1.71 Allowed 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.657 0.783 . . . . 0.0 111.914 -169.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -89.67 41.03 1.02 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.17 0.588 . . . . 0.0 111.953 -169.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 79.0 -63.01 3.91 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 123.681 0.658 . . . . 0.0 112.157 178.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.067 0 CA-C-N 117.501 0.651 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 42.7 t . . . . . 0 N--CA 1.474 0.744 0 CA-C-O 120.12 0.01 . . . . 0.0 110.977 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -69.51 161.77 28.85 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.113 0.565 . . . . 0.0 110.358 175.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.87 160.95 27.4 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -173.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 164.75 -176.7 40.53 Favored Glycine 0 CA--C 1.531 1.037 0 N-CA-C 108.984 -1.647 . . . . 0.0 108.984 -172.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -63.07 -31.02 76.23 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 123.217 2.611 . . . . 0.0 112.156 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.0 mp -100.32 26.28 6.75 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.546 1.138 . . . . 0.0 111.285 178.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -64.0 -49.77 71.15 Favored 'General case' 0 C--N 1.341 0.236 0 O-C-N 121.395 -0.816 . . . . 0.0 110.831 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 53.0 p-90 -53.51 -43.1 68.03 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.077 0.551 . . . . 0.0 110.5 172.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tt -66.77 -51.07 60.03 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.484 1.114 . . . . 0.0 110.115 -171.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.0 p -61.06 -39.71 90.87 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -67.7 -50.33 58.14 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.445 0.566 . . . . 0.0 110.633 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -60.44 -59.33 5.57 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.094 1.357 . . . . 0.0 111.432 -175.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -89.53 -55.63 3.57 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.648 0.779 . . . . 0.0 110.875 -173.247 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -89.49 48.34 1.59 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 122.778 0.431 . . . . 0.0 110.409 -169.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -179.89 -65.94 0.07 OUTLIER Glycine 0 C--N 1.339 0.728 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -176.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.046 0 CA-C-N 116.964 0.382 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 90.5 m . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 55.4 ttt85 -63.4 102.03 0.37 Allowed 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 176.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.3 98.37 0.62 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.593 1.157 . . . . 0.0 112.301 -169.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 131.39 -72.91 0.47 Allowed Glycine 0 CA--C 1.525 0.71 0 N-CA-C 108.098 -2.001 . . . . 0.0 108.098 176.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo -49.49 -40.79 45.18 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 124.599 3.533 . . . . 0.0 114.332 175.019 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 94.0 mt -127.06 3.09 6.5 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.972 0.909 . . . . 0.0 113.302 -174.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -57.98 -57.1 14.31 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 119.623 1.101 . . . . 0.0 110.013 -178.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 46.0 p-90 -49.69 -44.86 48.27 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.2 1.4 . . . . 0.0 111.534 176.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tt -66.32 -51.32 58.5 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 124.453 1.101 . . . . 0.0 108.866 -173.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.1 m -61.1 -49.65 76.44 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 122.884 0.473 . . . . 0.0 111.284 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -54.76 -51.96 64.07 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.768 0.427 . . . . 0.0 111.165 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -68.7 -53.69 20.64 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.308 0.643 . . . . 0.0 111.926 -171.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -89.56 -45.59 9.28 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.252 0.621 . . . . 0.0 112.083 -170.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 5.0 m-30 -88.87 -41.95 12.15 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.318 0.508 . . . . 0.0 110.088 -169.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.17 -58.49 6.08 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 170.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.041 0 O-C-N 122.426 -0.455 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 40.8 t . . . . . 0 N--CA 1.473 0.711 0 CA-C-O 119.773 -0.156 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 19.6 tpp180 -57.0 130.65 47.01 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 123.629 0.772 . . . . 0.0 109.336 179.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -68.6 163.92 22.59 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -169.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 163.32 -175.35 39.61 Favored Glycine 0 CA--C 1.53 1.015 0 N-CA-C 108.369 -1.892 . . . . 0.0 108.369 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -51.18 -34.77 49.7 Favored 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 123.916 3.077 . . . . 0.0 113.32 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 39.0 mt -107.89 29.99 6.75 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.485 1.114 . . . . 0.0 111.809 -173.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -65.19 -50.7 64.92 Favored 'General case' 0 C--N 1.344 0.336 0 CA-C-N 119.33 0.968 . . . . 0.0 110.376 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.2 p-90 -49.99 -43.98 50.77 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.559 1.144 . . . . 0.0 111.047 174.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.56 -49.71 67.84 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.703 1.201 . . . . 0.0 108.925 -177.352 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.7 t -54.89 -54.63 40.12 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.681 1.192 . . . . 0.0 111.106 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -57.37 -55.5 33.92 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.142 0.977 . . . . 0.0 111.108 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -67.6 -51.45 50.2 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.176 0.59 . . . . 0.0 112.2 -169.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -89.36 -48.65 7.2 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 122.809 0.444 . . . . 0.0 111.724 -171.081 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -89.01 -37.78 14.92 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 -169.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.94 -61.81 3.61 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 173.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.046 0 O-C-N 122.448 -0.442 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 45.8 t . . . . . 0 N--CA 1.474 0.743 0 N-CA-C 111.048 0.018 . . . . 0.0 111.048 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -82.15 71.59 9.2 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 177.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.58 78.93 1.98 Allowed 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.07 1.348 . . . . 0.0 112.11 -169.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -179.79 -93.71 0.09 OUTLIER Glycine 0 CA--C 1.527 0.829 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 169.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -65.37 -42.52 12.89 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 123.293 2.662 . . . . 0.0 111.033 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 55.6 mt -105.32 34.0 3.44 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.414 1.086 . . . . 0.0 110.257 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -62.87 -42.3 99.71 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 123.359 0.663 . . . . 0.0 110.279 177.003 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 60.7 p-90 -60.13 -36.31 77.22 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.69 0.796 . . . . 0.0 111.104 174.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.66 -42.65 77.63 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 179.468 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 t -59.26 -53.12 61.89 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.431 0.692 . . . . 0.0 112.241 173.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.72 -25.71 66.64 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.104 0.411 . . . . 0.0 112.023 -172.179 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -90.05 -58.49 2.49 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.761 0.825 . . . . 0.0 111.035 176.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -89.55 -59.29 2.25 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 123.72 0.808 . . . . 0.0 111.794 -171.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -88.64 64.22 7.28 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 -169.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 82.11 57.35 2.68 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 -170.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.054 0 O-C-N 122.585 -0.362 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 54.0 t . . . . . 0 N--CA 1.473 0.704 0 CA-C-O 119.616 -0.23 . . . . 0.0 110.799 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -169.03 82.83 0.14 Allowed 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 107.675 -1.232 . . . . 0.0 107.675 175.43 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.38 78.08 5.9 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.796 0.839 . . . . 0.0 109.938 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -177.05 -98.82 0.11 Allowed Glycine 0 CA--C 1.529 0.929 0 N-CA-C 110.095 -1.202 . . . . 0.0 110.095 172.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -63.94 -41.56 22.81 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.249 2.633 . . . . 0.0 111.191 -177.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.8 mp -103.48 31.28 4.45 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.567 1.147 . . . . 0.0 110.186 176.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -57.73 -55.46 34.55 Favored 'General case' 0 C--N 1.343 0.289 0 O-C-N 121.41 -0.806 . . . . 0.0 109.417 174.355 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 45.7 p-90 -57.18 -41.39 79.21 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.889 1.276 . . . . 0.0 111.732 176.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.6 -49.72 65.39 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -174.552 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 95.2 m -55.03 -55.51 30.09 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.168 0.987 . . . . 0.0 110.91 172.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.11 -33.32 75.2 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.333 0.653 . . . . 0.0 112.149 -171.423 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -87.13 -53.6 4.78 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.664 0.785 . . . . 0.0 111.38 -174.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -89.52 -53.4 4.55 Favored 'General case' 0 C--N 1.34 0.179 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -169.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -89.21 -68.09 0.8 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 122.347 0.259 . . . . 0.0 111.194 -168.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -104.32 51.07 0.82 Allowed Glycine 0 CA--C 1.525 0.679 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 174.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.048 0 CA-C-N 117.113 0.457 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 50.1 t . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 111.223 0.082 . . . . 0.0 111.223 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 88.9 mtm180 -72.84 100.68 2.95 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.658 0.783 . . . . 0.0 109.782 -175.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -77.53 60.75 2.17 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.009 1.324 . . . . 0.0 111.177 -179.197 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -159.26 -80.11 0.03 OUTLIER Glycine 0 CA--C 1.527 0.795 0 N-CA-C 108.483 -1.847 . . . . 0.0 108.483 174.509 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -65.93 -43.01 10.08 Favored 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 123.32 2.68 . . . . 0.0 111.071 177.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.2 mp -101.48 19.98 16.87 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.34 1.056 . . . . 0.0 110.758 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -56.27 -49.54 73.91 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 120.027 1.285 . . . . 0.0 111.92 -174.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.6 p-90 -54.06 -38.56 65.39 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.154 1.382 . . . . 0.0 111.662 172.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.64 -45.47 75.24 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.225 1.01 . . . . 0.0 109.14 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 11.1 m -57.32 -50.45 72.89 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 124.097 0.959 . . . . 0.0 110.017 176.063 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.48 -43.22 73.63 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.927 0.491 . . . . 0.0 111.345 -172.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -77.82 -50.88 11.42 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.641 0.776 . . . . 0.0 111.351 -171.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -89.37 -57.55 2.85 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -175.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -89.73 47.25 1.44 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 122.875 0.47 . . . . 0.0 110.243 -170.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -80.44 67.9 3.42 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 124.098 0.856 . . . . 0.0 111.054 -174.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.089 0 O-C-N 122.404 -0.468 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 39.9 t . . . . . 0 N--CA 1.474 0.749 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 20.6 tpp85 -74.2 122.76 23.31 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 174.033 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.19 116.89 5.84 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.455 0.702 . . . . 0.0 109.829 176.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -167.53 -159.38 13.01 Favored Glycine 0 CA--C 1.531 1.084 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 -178.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -50.71 -34.75 45.14 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 124.62 3.546 . . . . 0.0 113.999 179.532 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.9 mt -99.93 22.67 10.85 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.34 1.056 . . . . 0.0 111.879 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -61.21 -55.74 28.63 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 118.778 0.717 . . . . 0.0 110.236 178.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 35.2 p-90 -52.03 -42.69 63.29 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.923 0.889 . . . . 0.0 111.411 177.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -64.16 -53.62 46.59 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 122.864 0.465 . . . . 0.0 111.71 178.179 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 18.6 p -61.64 -38.51 87.94 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -174.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -74.32 -55.42 6.03 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.045 0.538 . . . . 0.0 111.019 178.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -74.6 -53.61 9.04 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.334 0.654 . . . . 0.0 111.954 -169.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 69.6 m-85 -89.53 -54.91 3.87 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 123.381 0.672 . . . . 0.0 110.086 -172.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -89.71 37.49 0.88 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 117.887 0.312 . . . . 0.0 110.597 -173.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 173.36 -164.8 36.68 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 -174.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.065 0 O-C-N 122.392 -0.475 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 97.7 m . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 111.62 0.23 . . . . 0.0 111.62 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -80.94 73.4 7.96 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 169.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -69.27 79.85 0.36 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.644 1.578 . . . . 0.0 112.369 -169.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -171.81 -81.91 0.05 OUTLIER Glycine 0 CA--C 1.526 0.777 0 N-CA-C 107.561 -2.216 . . . . 0.0 107.561 172.071 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -65.56 -34.94 40.41 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 123.342 2.695 . . . . 0.0 111.225 172.511 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.5 tp -101.02 12.89 36.84 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.825 1.25 . . . . 0.0 111.432 -178.565 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -59.84 -56.42 22.03 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 123.589 0.755 . . . . 0.0 110.783 -174.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 50.3 p-90 -51.57 -39.58 58.13 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.927 1.291 . . . . 0.0 112.037 177.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.19 -45.51 84.52 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.012 0.925 . . . . 0.0 108.798 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 12.8 t -59.4 -46.59 88.27 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.33 0.652 . . . . 0.0 111.434 176.004 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -57.58 -55.38 35.63 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 123.705 0.802 . . . . 0.0 111.039 178.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -73.85 -52.34 13.33 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.722 0.809 . . . . 0.0 112.093 -169.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -89.91 -57.92 2.69 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.134 0.574 . . . . 0.0 111.065 -174.204 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -89.47 61.12 5.46 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.828 0.451 . . . . 0.0 110.948 -169.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 83.08 -61.64 4.75 Favored Glycine 0 CA--C 1.527 0.783 0 C-N-CA 123.967 0.794 . . . . 0.0 111.209 177.329 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.098 0 O-C-N 122.386 -0.479 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 30.9 t . . . . . 0 N--CA 1.474 0.731 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -83.69 78.31 9.71 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 106.548 -1.649 . . . . 0.0 106.548 169.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -76.54 62.87 1.97 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.335 1.454 . . . . 0.0 112.614 -169.352 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -161.45 -78.21 0.03 OUTLIER Glycine 0 CA--C 1.527 0.795 0 N-CA-C 108.149 -1.98 . . . . 0.0 108.149 172.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -64.61 -43.35 13.44 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 123.428 2.752 . . . . 0.0 111.672 177.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 36.3 mt -107.34 23.8 13.85 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.937 0.895 . . . . 0.0 111.091 -177.185 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -60.53 -56.04 26.13 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.651 0.66 . . . . 0.0 110.486 -175.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 57.7 p-90 -47.16 -42.18 19.21 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.55 1.54 . . . . 0.0 111.658 172.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -64.44 -47.84 77.56 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 125.218 1.407 . . . . 0.0 108.993 -176.051 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 57.5 m -56.43 -51.15 69.48 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.957 0.503 . . . . 0.0 110.93 176.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -60.04 -46.63 88.88 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 122.244 0.217 . . . . 0.0 111.483 -177.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.1 ttmm -67.7 -56.5 9.08 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.6 0.36 . . . . 0.0 111.7 -176.65 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -89.77 -50.08 6.26 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.399 0.68 . . . . 0.0 112.327 -169.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 -89.39 -19.16 25.53 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 122.636 0.374 . . . . 0.0 111.829 -169.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.04 44.56 11.65 Favored Glycine 0 CA--C 1.528 0.904 0 N-CA-C 110.69 -0.964 . . . . 0.0 110.69 -175.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.039 0 O-C-N 122.316 -0.52 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 38.9 t . . . . . 0 N--CA 1.474 0.75 0 N-CA-C 111.22 0.081 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 77.8 mtm180 -67.84 135.93 53.32 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.124 0.57 . . . . 0.0 109.759 -177.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -70.82 157.34 38.26 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -171.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 164.55 -175.73 40.52 Favored Glycine 0 CA--C 1.532 1.132 0 N-CA-C 109.132 -1.587 . . . . 0.0 109.132 -172.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -64.1 -27.11 65.28 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 123.485 2.79 . . . . 0.0 112.119 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 48.8 mt -102.48 26.4 7.91 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.327 1.051 . . . . 0.0 111.57 177.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -60.84 -53.74 53.62 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 118.972 0.805 . . . . 0.0 109.916 176.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 55.4 p-90 -50.57 -46.18 57.55 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.385 1.074 . . . . 0.0 110.753 177.066 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -64.67 -49.27 71.64 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.851 1.26 . . . . 0.0 109.053 -175.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 20.9 t -56.14 -55.25 35.32 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.123 0.969 . . . . 0.0 110.967 179.146 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -59.71 -48.42 81.75 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.583 0.753 . . . . 0.0 111.324 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -61.73 -60.13 4.13 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.645 1.178 . . . . 0.0 111.812 -175.494 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -89.69 -44.83 9.75 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 122.991 0.517 . . . . 0.0 112.019 -169.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -89.16 -40.55 12.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.241 0.473 . . . . 0.0 110.111 -169.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.72 -62.73 3.29 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 110.749 -0.941 . . . . 0.0 110.749 177.554 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.033 0 O-C-N 122.353 -0.498 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 30.2 t . . . . . 0 N--CA 1.473 0.722 0 CA-C-O 118.652 -0.69 . . . . 0.0 110.128 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.11 66.5 6.74 Favored 'General case' 0 C--N 1.341 0.233 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 169.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.23 126.2 26.47 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.962 0.905 . . . . 0.0 110.532 -173.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 109.92 -99.89 1.25 Allowed Glycine 0 CA--C 1.534 1.221 0 C-N-CA 125.006 1.289 . . . . 0.0 110.671 -174.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.64 -60.72 0.06 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 123.533 2.822 . . . . 0.0 113.399 -169.381 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.5 mt -99.94 31.83 3.14 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.42 0.688 . . . . 0.0 110.662 -173.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -71.78 -50.31 31.07 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.391 1.077 . . . . 0.0 109.301 -178.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.6 p-90 -58.99 -40.42 84.8 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.666 0.786 . . . . 0.0 110.922 172.594 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.7 -39.87 88.24 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.573 0.749 . . . . 0.0 109.285 -176.309 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 51.9 t -66.67 -51.99 49.89 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 122.694 0.398 . . . . 0.0 111.36 174.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.21 -27.17 68.24 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 117.962 0.346 . . . . 0.0 111.569 -177.205 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.5 tttp -83.88 -65.72 0.98 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.698 1.199 . . . . 0.0 110.815 178.305 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -90.3 -55.63 3.53 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 124.155 0.982 . . . . 0.0 111.978 -170.342 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -89.26 64.18 6.8 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 -169.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 82.18 57.59 2.62 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 108.861 -1.696 . . . . 0.0 108.861 -169.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.065 0 O-C-N 122.696 -0.296 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 42.5 t . . . . . 0 N--CA 1.475 0.823 0 N-CA-C 111.398 0.147 . . . . 0.0 111.398 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 94.7 mtt-85 -56.91 121.71 10.55 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.953 0.901 . . . . 0.0 109.585 176.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -69.49 159.07 33.98 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.008 0.523 . . . . 0.0 111.586 -174.108 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 158.83 -174.28 35.84 Favored Glycine 0 CA--C 1.53 0.98 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 -174.089 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -68.06 -11.35 31.77 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 123.456 2.77 . . . . 0.0 112.767 178.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 60.0 mt -109.56 15.57 22.81 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.795 1.238 . . . . 0.0 111.496 176.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -61.46 -50.98 70.6 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 118.996 0.816 . . . . 0.0 110.597 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 34.6 p-90 -54.17 -43.45 70.64 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.532 1.133 . . . . 0.0 111.401 178.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 12.7 mt -63.75 -49.84 71.45 Favored 'General case' 0 C--N 1.339 0.121 0 C-N-CA 122.96 0.504 . . . . 0.0 110.889 175.294 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 18.1 t -55.79 -44.67 77.98 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.729 0.811 . . . . 0.0 111.584 -177.201 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -75.86 -58.87 3.02 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.784 0.834 . . . . 0.0 111.013 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -71.76 -54.86 8.89 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.773 0.829 . . . . 0.0 112.944 -169.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -89.12 -45.36 9.65 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 123.19 0.596 . . . . 0.0 111.16 -169.527 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -88.94 -43.45 11.15 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 -169.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.62 -61.44 4.12 Favored Glycine 0 CA--C 1.528 0.854 0 N-CA-C 110.13 -1.188 . . . . 0.0 110.13 172.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.041 0 O-C-N 122.354 -0.498 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.6 t . . . . . 0 N--CA 1.475 0.813 0 CA-C-O 119.823 -0.132 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -45.91 111.25 0.33 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.407 1.483 . . . . 0.0 110.314 175.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.98 69.96 5.23 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.233 1.013 . . . . 0.0 110.648 -175.551 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -111.01 -165.87 18.74 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.0 1.286 . . . . 0.0 110.648 177.183 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -52.04 -35.62 62.12 Favored 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 124.271 3.314 . . . . 0.0 113.003 175.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.2 mt -99.82 27.97 5.08 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.588 1.155 . . . . 0.0 111.446 -177.114 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -58.68 -54.89 42.02 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 123.691 0.796 . . . . 0.0 110.447 177.3 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 57.3 p-90 -55.32 -39.52 70.06 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.996 1.318 . . . . 0.0 111.283 176.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -66.17 -49.96 65.57 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 -176.649 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.4 t -57.6 -52.69 64.37 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.138 0.575 . . . . 0.0 111.287 176.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.13 -41.39 96.64 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.697 0.399 . . . . 0.0 111.043 -174.42 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -76.14 -53.38 8.38 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.729 0.812 . . . . 0.0 111.338 -174.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -89.31 -45.82 9.22 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 122.872 0.469 . . . . 0.0 112.025 -170.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -88.86 -42.05 12.1 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -169.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -73.63 -63.38 2.75 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 172.122 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 -0.02 0 O-C-N 122.303 -0.528 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo . . . . . 0 N--CA 1.454 -0.8 0 CA-C-O 118.87 -0.554 . . . . 0.0 112.458 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 88.9 mt -112.69 1.44 15.7 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-O 118.288 -0.863 . . . . 0.0 112.704 -178.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -55.2 -54.72 39.75 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 119.76 1.164 . . . . 0.0 111.596 -173.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 45.7 p-90 -49.99 -44.03 50.79 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.052 1.341 . . . . 0.0 111.652 174.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.0 -49.08 66.45 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.004 1.322 . . . . 0.0 109.245 -174.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 77.3 m -61.09 -44.94 96.59 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.343 1.057 . . . . 0.0 111.338 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -65.84 -50.6 64.01 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.867 0.303 . . . . 0.0 111.114 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -68.11 -52.25 37.04 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.773 0.429 . . . . 0.0 111.673 -172.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -89.69 -55.44 3.64 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 123.519 0.728 . . . . 0.0 110.972 -175.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.9 m-30 . . . . . 0 CA--C 1.537 0.466 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -169.759 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo . . . . . 0 N--CA 1.459 -0.529 0 N-CA-C 114.25 0.827 . . . . 0.0 114.25 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 50.2 mt -102.41 15.91 27.83 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.246 0.618 . . . . 0.0 111.969 -172.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 30.0 tp60 -57.28 -47.56 81.14 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 118.984 0.811 . . . . 0.0 111.319 -174.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 34.5 p-90 -54.61 -46.49 73.85 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.449 1.1 . . . . 0.0 111.456 176.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.0 mt -59.25 -42.64 91.61 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.807 0.843 . . . . 0.0 111.164 175.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.5 m -58.74 -54.31 48.48 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 117.902 0.319 . . . . 0.0 110.669 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -69.18 -37.65 78.26 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.04 0.536 . . . . 0.0 112.249 -175.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -89.78 -56.19 3.34 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.152 0.581 . . . . 0.0 111.52 -170.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -89.43 -49.26 6.8 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 123.313 0.645 . . . . 0.0 111.28 -173.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 . . . . . 0 CA--C 1.531 0.24 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 -169.566 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo . . . . . 0 N--CA 1.457 -0.637 0 N-CA-C 113.618 0.584 . . . . 0.0 113.618 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 89.5 mt -119.38 -3.64 10.47 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 124.18 0.992 . . . . 0.0 112.586 -176.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -49.78 -47.9 50.8 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-N 119.521 1.055 . . . . 0.0 111.565 -178.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 28.7 p-90 -52.91 -52.14 58.78 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.62 0.768 . . . . 0.0 111.286 176.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.9 mt -58.04 -49.27 77.46 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.585 0.754 . . . . 0.0 111.456 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.9 m -56.65 -44.1 80.98 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.166 0.986 . . . . 0.0 111.43 -175.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -75.39 -59.9 2.54 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.164 0.586 . . . . 0.0 110.982 177.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -63.71 -58.86 5.57 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.642 1.577 . . . . 0.0 112.095 -169.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -89.49 -51.43 5.54 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 123.358 0.663 . . . . 0.0 110.356 -172.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 . . . . . 0 CA--C 1.535 0.392 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 -171.505 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo . . . . . 0 N--CA 1.456 -0.716 0 N-CA-C 113.754 0.636 . . . . 0.0 113.754 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 29.7 mt -103.52 29.36 5.73 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.999 0.919 . . . . 0.0 112.201 -175.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -62.46 -60.62 3.28 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 119.103 0.865 . . . . 0.0 109.516 175.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.6 p-90 -51.26 -43.31 61.51 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.051 1.34 . . . . 0.0 111.383 177.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -67.52 -51.97 44.55 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.241 1.016 . . . . 0.0 108.865 -174.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 53.0 t -59.03 -42.79 91.03 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.601 0.76 . . . . 0.0 111.89 179.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -63.79 -55.05 25.94 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 117.891 0.314 . . . . 0.0 110.926 177.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -64.87 -49.22 71.4 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.254 0.621 . . . . 0.0 111.766 -172.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -89.73 -59.4 2.22 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 123.492 0.717 . . . . 0.0 110.796 -176.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 . . . . . 0 CA--C 1.536 0.44 0 C-N-CA 123.043 0.537 . . . . 0.0 112.254 -169.561 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo . . . . . 0 N--CA 1.457 -0.637 0 CA-C-O 119.878 -0.134 . . . . 0.0 111.872 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 56.1 mt -100.13 37.96 1.56 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.938 0.895 . . . . 0.0 109.945 -178.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -67.05 -60.36 2.69 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 123.48 0.712 . . . . 0.0 109.519 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 53.6 p-90 -46.37 -44.56 17.09 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.775 1.23 . . . . 0.0 111.038 174.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tt -67.24 -56.39 10.03 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.541 1.136 . . . . 0.0 109.45 -173.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.9 p -62.28 -40.73 97.21 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -176.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -65.47 -48.2 73.47 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 118.185 0.448 . . . . 0.0 110.879 178.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -68.77 -49.91 54.8 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.904 0.482 . . . . 0.0 112.015 -174.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -89.67 -51.86 5.3 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.26 0.624 . . . . 0.0 111.829 -171.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 . . . . . 0 CA--C 1.532 0.278 0 CA-C-N 117.946 0.339 . . . . 0.0 111.441 -169.516 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo . . . . . 0 N--CA 1.457 -0.619 0 CA-C-O 120.309 0.045 . . . . 0.0 112.171 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 28.8 mt -99.59 37.55 1.58 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.145 0.978 . . . . 0.0 110.528 -178.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -61.79 -62.24 1.94 Allowed 'General case' 0 C--N 1.343 0.285 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 174.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.4 p-90 -51.64 -45.14 63.22 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.051 1.34 . . . . 0.0 111.673 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -67.17 -51.97 47.12 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.455 1.102 . . . . 0.0 108.733 -173.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.5 t -58.67 -49.92 75.79 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.369 0.668 . . . . 0.0 111.021 178.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -54.87 -51.92 64.46 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.926 0.89 . . . . 0.0 111.148 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -71.05 -50.75 30.55 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 122.884 0.473 . . . . 0.0 111.623 -172.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -91.31 -52.28 4.88 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -171.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 . . . . . 0 CA--C 1.533 0.322 0 CA-C-N 118.142 0.428 . . . . 0.0 111.11 -169.028 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo . . . . . 0 CA--C 1.539 0.728 0 CA-C-O 120.959 0.316 . . . . 0.0 111.382 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.4 tp -140.05 -24.77 0.81 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.677 1.991 . . . . 0.0 109.945 177.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -42.0 -56.31 2.84 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 126.176 1.79 . . . . 0.0 111.555 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 49.4 p-90 -48.07 -48.04 33.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.135 1.774 . . . . 0.0 111.957 177.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.1 tt -66.43 -48.21 70.73 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.368 1.467 . . . . 0.0 109.085 -176.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 49.1 t -61.61 -49.44 76.58 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 122.647 0.379 . . . . 0.0 111.466 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -62.12 -41.36 98.16 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 122.584 0.354 . . . . 0.0 111.726 -178.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.0 mtmt -66.31 -57.77 6.78 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 117.962 0.346 . . . . 0.0 111.606 176.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -95.6 -60.18 1.71 Allowed 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.657 0.783 . . . . 0.0 111.914 -169.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 . . . . . 0 CA--C 1.536 0.432 0 C-N-CA 123.17 0.588 . . . . 0.0 111.953 -169.924 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo . . . . . 0 N--CA 1.457 -0.671 0 CA-C-O 119.211 -0.412 . . . . 0.0 112.156 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.0 mp -100.32 26.28 6.75 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.546 1.138 . . . . 0.0 111.285 178.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -64.0 -49.77 71.15 Favored 'General case' 0 C--N 1.341 0.236 0 O-C-N 121.395 -0.816 . . . . 0.0 110.831 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 53.0 p-90 -53.51 -43.1 68.03 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.077 0.551 . . . . 0.0 110.5 172.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tt -66.77 -51.07 60.03 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.484 1.114 . . . . 0.0 110.115 -171.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.0 p -61.06 -39.71 90.87 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -67.7 -50.33 58.14 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.445 0.566 . . . . 0.0 110.633 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -60.44 -59.33 5.57 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.094 1.357 . . . . 0.0 111.432 -175.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -89.53 -55.63 3.57 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.648 0.779 . . . . 0.0 110.875 -173.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 . . . . . 0 CA--C 1.535 0.401 0 C-N-CA 122.778 0.431 . . . . 0.0 110.409 -169.797 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo . . . . . 0 N--CA 1.456 -0.678 0 N-CA-C 114.332 0.858 . . . . 0.0 114.332 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 94.0 mt -127.06 3.09 6.5 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.972 0.909 . . . . 0.0 113.302 -174.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -57.98 -57.1 14.31 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 119.623 1.101 . . . . 0.0 110.013 -178.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 46.0 p-90 -49.69 -44.86 48.27 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.2 1.4 . . . . 0.0 111.534 176.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tt -66.32 -51.32 58.5 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 124.453 1.101 . . . . 0.0 108.866 -173.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.1 m -61.1 -49.65 76.44 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 122.884 0.473 . . . . 0.0 111.284 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -54.76 -51.96 64.07 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.768 0.427 . . . . 0.0 111.165 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -68.7 -53.69 20.64 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.308 0.643 . . . . 0.0 111.926 -171.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -89.56 -45.59 9.28 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.252 0.621 . . . . 0.0 112.083 -170.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 5.0 m-30 . . . . . 0 CA--C 1.53 0.18 0 CA-C-N 118.318 0.508 . . . . 0.0 110.088 -169.601 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo . . . . . 0 N--CA 1.457 -0.646 0 N-CA-C 113.32 0.469 . . . . 0.0 113.32 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 39.0 mt -107.89 29.99 6.75 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.485 1.114 . . . . 0.0 111.809 -173.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -65.19 -50.7 64.92 Favored 'General case' 0 C--N 1.344 0.336 0 CA-C-N 119.33 0.968 . . . . 0.0 110.376 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.2 p-90 -49.99 -43.98 50.77 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.559 1.144 . . . . 0.0 111.047 174.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.56 -49.71 67.84 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.703 1.201 . . . . 0.0 108.925 -177.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.7 t -54.89 -54.63 40.12 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.681 1.192 . . . . 0.0 111.106 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -57.37 -55.5 33.92 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.142 0.977 . . . . 0.0 111.108 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -67.6 -51.45 50.2 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.176 0.59 . . . . 0.0 112.2 -169.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -89.36 -48.65 7.2 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 122.809 0.444 . . . . 0.0 111.724 -171.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 . . . . . 0 CA--C 1.53 0.209 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 -169.468 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 N--CA 1.456 -0.727 0 N-CA-C 111.033 -0.41 . . . . 0.0 111.033 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 55.6 mt -105.32 34.0 3.44 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.414 1.086 . . . . 0.0 110.257 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -62.87 -42.3 99.71 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 123.359 0.663 . . . . 0.0 110.279 177.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 60.7 p-90 -60.13 -36.31 77.22 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.69 0.796 . . . . 0.0 111.104 174.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.66 -42.65 77.63 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 179.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 t -59.26 -53.12 61.89 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.431 0.692 . . . . 0.0 112.241 173.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.72 -25.71 66.64 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.104 0.411 . . . . 0.0 112.023 -172.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -90.05 -58.49 2.49 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.761 0.825 . . . . 0.0 111.035 176.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -89.55 -59.29 2.25 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 123.72 0.808 . . . . 0.0 111.794 -171.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 . . . . . 0 CA--C 1.531 0.243 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 -169.779 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo . . . . . 0 N--CA 1.456 -0.723 0 N-CA-C 111.191 -0.35 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.8 mp -103.48 31.28 4.45 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.567 1.147 . . . . 0.0 110.186 176.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -57.73 -55.46 34.55 Favored 'General case' 0 C--N 1.343 0.289 0 O-C-N 121.41 -0.806 . . . . 0.0 109.417 174.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 45.7 p-90 -57.18 -41.39 79.21 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.889 1.276 . . . . 0.0 111.732 176.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.6 -49.72 65.39 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -174.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 95.2 m -55.03 -55.51 30.09 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.168 0.987 . . . . 0.0 110.91 172.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.11 -33.32 75.2 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.333 0.653 . . . . 0.0 112.149 -171.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -87.13 -53.6 4.78 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.664 0.785 . . . . 0.0 111.38 -174.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -89.52 -53.4 4.55 Favored 'General case' 0 C--N 1.34 0.179 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -169.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 . . . . . 0 CA--C 1.529 0.144 0 C-N-CA 122.347 0.259 . . . . 0.0 111.194 -168.656 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo . . . . . 0 N--CA 1.454 -0.812 0 N-CA-C 111.071 -0.396 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.2 mp -101.48 19.98 16.87 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.34 1.056 . . . . 0.0 110.758 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -56.27 -49.54 73.91 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 120.027 1.285 . . . . 0.0 111.92 -174.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.6 p-90 -54.06 -38.56 65.39 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.154 1.382 . . . . 0.0 111.662 172.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.64 -45.47 75.24 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.225 1.01 . . . . 0.0 109.14 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 11.1 m -57.32 -50.45 72.89 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 124.097 0.959 . . . . 0.0 110.017 176.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.48 -43.22 73.63 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.927 0.491 . . . . 0.0 111.345 -172.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -77.82 -50.88 11.42 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.641 0.776 . . . . 0.0 111.351 -171.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -89.37 -57.55 2.85 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -175.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 . . . . . 0 CA--C 1.534 0.36 0 C-N-CA 122.875 0.47 . . . . 0.0 110.243 -170.915 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo . . . . . 0 N--CA 1.458 -0.578 0 N-CA-C 113.999 0.73 . . . . 0.0 113.999 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.9 mt -99.93 22.67 10.85 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.34 1.056 . . . . 0.0 111.879 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -61.21 -55.74 28.63 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 118.778 0.717 . . . . 0.0 110.236 178.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 35.2 p-90 -52.03 -42.69 63.29 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.923 0.889 . . . . 0.0 111.411 177.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -64.16 -53.62 46.59 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 122.864 0.465 . . . . 0.0 111.71 178.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 18.6 p -61.64 -38.51 87.94 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -174.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -74.32 -55.42 6.03 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.045 0.538 . . . . 0.0 111.019 178.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -74.6 -53.61 9.04 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.334 0.654 . . . . 0.0 111.954 -169.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 69.6 m-85 -89.53 -54.91 3.87 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 123.381 0.672 . . . . 0.0 110.086 -172.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 . . . . . 0 CA--C 1.536 0.42 0 CA-C-N 117.887 0.312 . . . . 0.0 110.597 -173.405 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo . . . . . 0 N--CA 1.456 -0.722 0 N-CA-C 111.225 -0.337 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.5 tp -101.02 12.89 36.84 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.825 1.25 . . . . 0.0 111.432 -178.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -59.84 -56.42 22.03 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 123.589 0.755 . . . . 0.0 110.783 -174.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 50.3 p-90 -51.57 -39.58 58.13 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.927 1.291 . . . . 0.0 112.037 177.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.19 -45.51 84.52 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.012 0.925 . . . . 0.0 108.798 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 12.8 t -59.4 -46.59 88.27 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.33 0.652 . . . . 0.0 111.434 176.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -57.58 -55.38 35.63 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 123.705 0.802 . . . . 0.0 111.039 178.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -73.85 -52.34 13.33 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.722 0.809 . . . . 0.0 112.093 -169.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -89.91 -57.92 2.69 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.134 0.574 . . . . 0.0 111.065 -174.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 . . . . . 0 CA--C 1.532 0.255 0 C-N-CA 122.828 0.451 . . . . 0.0 110.948 -169.14 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo . . . . . 0 N--CA 1.454 -0.798 0 CA-C-O 119.556 -0.268 . . . . 0.0 111.672 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 36.3 mt -107.34 23.8 13.85 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.937 0.895 . . . . 0.0 111.091 -177.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -60.53 -56.04 26.13 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.651 0.66 . . . . 0.0 110.486 -175.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 57.7 p-90 -47.16 -42.18 19.21 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.55 1.54 . . . . 0.0 111.658 172.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -64.44 -47.84 77.56 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 125.218 1.407 . . . . 0.0 108.993 -176.051 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 57.5 m -56.43 -51.15 69.48 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.957 0.503 . . . . 0.0 110.93 176.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -60.04 -46.63 88.88 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 122.244 0.217 . . . . 0.0 111.483 -177.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.1 ttmm -67.7 -56.5 9.08 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.6 0.36 . . . . 0.0 111.7 -176.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -89.77 -50.08 6.26 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.399 0.68 . . . . 0.0 112.327 -169.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 . . . . . 0 CA--C 1.535 0.372 0 C-N-CA 122.636 0.374 . . . . 0.0 111.829 -169.635 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo . . . . . 0 N--CA 1.456 -0.678 0 CA-C-O 119.323 -0.365 . . . . 0.0 112.119 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 48.8 mt -102.48 26.4 7.91 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.327 1.051 . . . . 0.0 111.57 177.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -60.84 -53.74 53.62 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 118.972 0.805 . . . . 0.0 109.916 176.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 55.4 p-90 -50.57 -46.18 57.55 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.385 1.074 . . . . 0.0 110.753 177.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -64.67 -49.27 71.64 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.851 1.26 . . . . 0.0 109.053 -175.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 20.9 t -56.14 -55.25 35.32 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.123 0.969 . . . . 0.0 110.967 179.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -59.71 -48.42 81.75 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.583 0.753 . . . . 0.0 111.324 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -61.73 -60.13 4.13 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.645 1.178 . . . . 0.0 111.812 -175.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -89.69 -44.83 9.75 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 122.991 0.517 . . . . 0.0 112.019 -169.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 . . . . . 0 CA--C 1.531 0.232 0 CA-C-N 118.241 0.473 . . . . 0.0 110.111 -169.801 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo . . . . . 0 N--CA 1.457 -0.662 0 N-CA-C 113.399 0.5 . . . . 0.0 113.399 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.5 mt -99.94 31.83 3.14 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.42 0.688 . . . . 0.0 110.662 -173.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -71.78 -50.31 31.07 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.391 1.077 . . . . 0.0 109.301 -178.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.6 p-90 -58.99 -40.42 84.8 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.666 0.786 . . . . 0.0 110.922 172.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.7 -39.87 88.24 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.573 0.749 . . . . 0.0 109.285 -176.309 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 51.9 t -66.67 -51.99 49.89 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 122.694 0.398 . . . . 0.0 111.36 174.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.21 -27.17 68.24 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 117.962 0.346 . . . . 0.0 111.569 -177.205 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.5 tttp -83.88 -65.72 0.98 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.698 1.199 . . . . 0.0 110.815 178.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -90.3 -55.63 3.53 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 124.155 0.982 . . . . 0.0 111.978 -170.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 . . . . . 0 CA--C 1.531 0.234 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 -169.972 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo . . . . . 0 N--CA 1.456 -0.686 0 CA-C-O 118.97 -0.513 . . . . 0.0 112.767 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 60.0 mt -109.56 15.57 22.81 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.795 1.238 . . . . 0.0 111.496 176.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -61.46 -50.98 70.6 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 118.996 0.816 . . . . 0.0 110.597 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 34.6 p-90 -54.17 -43.45 70.64 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.532 1.133 . . . . 0.0 111.401 178.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 12.7 mt -63.75 -49.84 71.45 Favored 'General case' 0 C--N 1.339 0.121 0 C-N-CA 122.96 0.504 . . . . 0.0 110.889 175.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 18.1 t -55.79 -44.67 77.98 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.729 0.811 . . . . 0.0 111.584 -177.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -75.86 -58.87 3.02 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.784 0.834 . . . . 0.0 111.013 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -71.76 -54.86 8.89 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.773 0.829 . . . . 0.0 112.944 -169.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -89.12 -45.36 9.65 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 123.19 0.596 . . . . 0.0 111.16 -169.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 . . . . . 0 CA--C 1.531 0.215 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 -169.767 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo . . . . . 0 N--CA 1.458 -0.612 0 N-CA-C 113.003 0.347 . . . . 0.0 113.003 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.2 mt -99.82 27.97 5.08 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.588 1.155 . . . . 0.0 111.446 -177.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -58.68 -54.89 42.02 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 123.691 0.796 . . . . 0.0 110.447 177.3 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 57.3 p-90 -55.32 -39.52 70.06 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.996 1.318 . . . . 0.0 111.283 176.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -66.17 -49.96 65.57 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 -176.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.4 t -57.6 -52.69 64.37 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.138 0.575 . . . . 0.0 111.287 176.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.13 -41.39 96.64 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.697 0.399 . . . . 0.0 111.043 -174.42 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -76.14 -53.38 8.38 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.729 0.812 . . . . 0.0 111.338 -174.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -89.31 -45.82 9.22 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 122.872 0.469 . . . . 0.0 112.025 -170.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 . . . . . 0 CA--C 1.531 0.222 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -169.407 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 47.5 t . . . . . 0 N--CA 1.473 0.715 0 N-CA-C 111.385 0.143 . . . . 0.0 111.385 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 71.5 mtm180 -73.02 105.22 4.39 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 170.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.39 68.49 2.08 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.006 1.322 . . . . 0.0 110.938 -176.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 179.72 -78.18 0.06 OUTLIER Glycine 0 CA--C 1.527 0.814 0 N-CA-C 109.011 -1.635 . . . . 0.0 109.011 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -69.23 -32.7 20.21 Favored 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 123.502 2.801 . . . . 0.0 112.458 -176.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 88.9 mt -112.69 1.44 15.7 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-O 118.288 -0.863 . . . . 0.0 112.704 -178.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -55.2 -54.72 39.75 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 119.76 1.164 . . . . 0.0 111.596 -173.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 45.7 p-90 -49.99 -44.03 50.79 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.052 1.341 . . . . 0.0 111.652 174.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.0 -49.08 66.45 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.004 1.322 . . . . 0.0 109.245 -174.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 77.3 m -61.09 -44.94 96.59 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.343 1.057 . . . . 0.0 111.338 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -65.84 -50.6 64.01 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.867 0.303 . . . . 0.0 111.114 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -68.11 -52.25 37.04 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.773 0.429 . . . . 0.0 111.673 -172.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -89.69 -55.44 3.64 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 123.519 0.728 . . . . 0.0 110.972 -175.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.9 m-30 -89.45 21.73 3.25 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -169.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 81.26 -56.85 4.88 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 123.677 0.656 . . . . 0.0 112.129 178.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.074 0 O-C-N 122.115 -0.638 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 41.6 t . . . . . 0 N--CA 1.473 0.716 0 CA-C-O 119.564 -0.255 . . . . 0.0 111.4 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -81.08 82.41 7.03 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 170.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.06 141.79 38.85 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.357 1.063 . . . . 0.0 110.681 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 97.34 -93.4 1.43 Allowed Glycine 0 CA--C 1.533 1.16 0 N-CA-C 108.996 -1.642 . . . . 0.0 108.996 -169.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -54.96 -53.49 5.91 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 123.424 2.75 . . . . 0.0 114.25 -175.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 50.2 mt -102.41 15.91 27.83 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.246 0.618 . . . . 0.0 111.969 -172.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 30.0 tp60 -57.28 -47.56 81.14 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-N 118.984 0.811 . . . . 0.0 111.319 -174.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 34.5 p-90 -54.61 -46.49 73.85 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.449 1.1 . . . . 0.0 111.456 176.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.0 mt -59.25 -42.64 91.61 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.807 0.843 . . . . 0.0 111.164 175.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.5 m -58.74 -54.31 48.48 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 117.902 0.319 . . . . 0.0 110.669 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -69.18 -37.65 78.26 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.04 0.536 . . . . 0.0 112.249 -175.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -89.78 -56.19 3.34 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.152 0.581 . . . . 0.0 111.52 -170.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -89.43 -49.26 6.8 Favored 'General case' 0 C--N 1.339 0.137 0 C-N-CA 123.313 0.645 . . . . 0.0 111.28 -173.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -88.87 62.88 6.57 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 -169.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 77.22 55.97 4.16 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 109.189 -1.564 . . . . 0.0 109.189 -169.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.049 0 O-C-N 122.564 -0.374 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 47.3 t . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 111.375 0.139 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 28.4 mmm180 -70.77 106.56 3.61 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 172.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.29 72.53 1.79 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.042 1.337 . . . . 0.0 111.712 -170.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 154.0 -68.67 0.3 Allowed Glycine 0 CA--C 1.527 0.813 0 N-CA-C 108.158 -1.977 . . . . 0.0 108.158 177.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -50.87 -45.17 37.47 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 124.377 3.385 . . . . 0.0 113.618 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 89.5 mt -119.38 -3.64 10.47 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 124.18 0.992 . . . . 0.0 112.586 -176.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -49.78 -47.9 50.8 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-N 119.521 1.055 . . . . 0.0 111.565 -178.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 28.7 p-90 -52.91 -52.14 58.78 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.62 0.768 . . . . 0.0 111.286 176.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.9 mt -58.04 -49.27 77.46 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 123.585 0.754 . . . . 0.0 111.456 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.9 m -56.65 -44.1 80.98 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.166 0.986 . . . . 0.0 111.43 -175.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -75.39 -59.9 2.54 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.164 0.586 . . . . 0.0 110.982 177.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -63.71 -58.86 5.57 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.642 1.577 . . . . 0.0 112.095 -169.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -89.49 -51.43 5.54 Favored 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 123.358 0.663 . . . . 0.0 110.356 -172.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -89.43 46.22 1.35 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 -171.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 177.7 -65.48 0.08 OUTLIER Glycine 0 C--N 1.338 0.681 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -176.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.05 0 O-C-N 122.373 -0.487 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 19.4 m . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -67.15 116.16 7.64 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.372 0.669 . . . . 0.0 109.209 175.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -76.32 91.15 3.22 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 169.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -168.63 -154.12 8.71 Favored Glycine 0 CA--C 1.528 0.89 0 N-CA-C 109.1 -1.6 . . . . 0.0 109.1 -177.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -48.82 -39.14 39.04 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 124.49 3.46 . . . . 0.0 113.754 179.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 29.7 mt -103.52 29.36 5.73 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.999 0.919 . . . . 0.0 112.201 -175.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -62.46 -60.62 3.28 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 119.103 0.865 . . . . 0.0 109.516 175.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.6 p-90 -51.26 -43.31 61.51 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.051 1.34 . . . . 0.0 111.383 177.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -67.52 -51.97 44.55 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.241 1.016 . . . . 0.0 108.865 -174.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 53.0 t -59.03 -42.79 91.03 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.601 0.76 . . . . 0.0 111.89 179.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -63.79 -55.05 25.94 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 117.891 0.314 . . . . 0.0 110.926 177.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -64.87 -49.22 71.4 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.254 0.621 . . . . 0.0 111.766 -172.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -89.73 -59.4 2.22 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 123.492 0.717 . . . . 0.0 110.796 -176.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -89.72 28.31 1.35 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.043 0.537 . . . . 0.0 112.254 -169.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 80.42 -57.05 4.7 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 123.827 0.727 . . . . 0.0 112.587 176.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.097 0 O-C-N 121.937 -0.743 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 30.5 t . . . . . 0 N--CA 1.474 0.757 0 N-CA-C 111.679 0.252 . . . . 0.0 111.679 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.21 101.27 2.26 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 169.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -70.53 87.93 0.66 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.233 1.013 . . . . 0.0 109.876 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -159.55 -94.62 0.1 Allowed Glycine 0 CA--C 1.53 1.027 0 N-CA-C 110.157 -1.177 . . . . 0.0 110.157 173.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -69.55 -55.53 0.18 Allowed 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.222 2.615 . . . . 0.0 111.872 -172.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 56.1 mt -100.13 37.96 1.56 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.938 0.895 . . . . 0.0 109.945 -178.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 62.2 tt0 -67.05 -60.36 2.69 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 123.48 0.712 . . . . 0.0 109.519 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 53.6 p-90 -46.37 -44.56 17.09 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.775 1.23 . . . . 0.0 111.038 174.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tt -67.24 -56.39 10.03 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.541 1.136 . . . . 0.0 109.45 -173.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.9 p -62.28 -40.73 97.21 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -176.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -65.47 -48.2 73.47 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 118.185 0.448 . . . . 0.0 110.879 178.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -68.77 -49.91 54.8 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.904 0.482 . . . . 0.0 112.015 -174.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -89.67 -51.86 5.3 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 123.26 0.624 . . . . 0.0 111.829 -171.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -89.35 -29.67 18.95 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.946 0.339 . . . . 0.0 111.441 -169.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 86.24 45.86 5.47 Favored Glycine 0 CA--C 1.528 0.859 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 -174.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 0.017 0 O-C-N 122.288 -0.536 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 56.1 m . . . . . 0 N--CA 1.475 0.806 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -80.46 159.33 25.64 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 173.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.8 157.36 34.94 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.271 0.628 . . . . 0.0 112.223 -177.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.58 -175.99 36.39 Favored Glycine 0 CA--C 1.531 1.059 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -177.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -51.26 -45.67 35.7 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 124.364 3.376 . . . . 0.0 112.171 176.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 28.8 mt -99.59 37.55 1.58 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.145 0.978 . . . . 0.0 110.528 -178.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -61.79 -62.24 1.94 Allowed 'General case' 0 C--N 1.343 0.285 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 174.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.4 p-90 -51.64 -45.14 63.22 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.051 1.34 . . . . 0.0 111.673 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -67.17 -51.97 47.12 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.455 1.102 . . . . 0.0 108.733 -173.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.5 t -58.67 -49.92 75.79 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.369 0.668 . . . . 0.0 111.021 178.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -54.87 -51.92 64.46 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.926 0.89 . . . . 0.0 111.148 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -71.05 -50.75 30.55 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 122.884 0.473 . . . . 0.0 111.623 -172.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -91.31 -52.28 4.88 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -171.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -89.47 -78.48 0.36 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.142 0.428 . . . . 0.0 111.11 -169.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -92.48 63.31 2.31 Favored Glycine 0 C--N 1.338 0.694 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 178.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.046 0 CA-C-N 116.633 0.217 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.475 0.807 0 CA-C-O 119.663 -0.208 . . . . 0.0 111.341 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -49.04 134.06 17.67 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.894 1.277 . . . . 0.0 111.565 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -84.75 -166.68 1.54 Allowed 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 124.436 1.095 . . . . 0.0 111.715 -174.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 89.21 -163.68 31.71 Favored Glycine 0 CA--C 1.531 1.069 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 -177.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -80.08 44.34 1.7 Allowed 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 123.907 3.072 . . . . 0.0 111.382 -177.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.4 tp -140.05 -24.77 0.81 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.677 1.991 . . . . 0.0 109.945 177.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -42.0 -56.31 2.84 Favored 'General case' 0 C--N 1.345 0.409 0 C-N-CA 126.176 1.79 . . . . 0.0 111.555 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 49.4 p-90 -48.07 -48.04 33.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.135 1.774 . . . . 0.0 111.957 177.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.1 tt -66.43 -48.21 70.73 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.368 1.467 . . . . 0.0 109.085 -176.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 49.1 t -61.61 -49.44 76.58 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 122.647 0.379 . . . . 0.0 111.466 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -62.12 -41.36 98.16 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 122.584 0.354 . . . . 0.0 111.726 -178.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.0 mtmt -66.31 -57.77 6.78 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 117.962 0.346 . . . . 0.0 111.606 176.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -95.6 -60.18 1.71 Allowed 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.657 0.783 . . . . 0.0 111.914 -169.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -89.67 41.03 1.02 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.17 0.588 . . . . 0.0 111.953 -169.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 79.0 -63.01 3.91 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 123.681 0.658 . . . . 0.0 112.157 178.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.067 0 CA-C-N 117.501 0.651 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 42.7 t . . . . . 0 N--CA 1.474 0.744 0 CA-C-O 120.12 0.01 . . . . 0.0 110.977 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -69.51 161.77 28.85 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.113 0.565 . . . . 0.0 110.358 175.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.87 160.95 27.4 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -173.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 164.75 -176.7 40.53 Favored Glycine 0 CA--C 1.531 1.037 0 N-CA-C 108.984 -1.647 . . . . 0.0 108.984 -172.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -63.07 -31.02 76.23 Favored 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 123.217 2.611 . . . . 0.0 112.156 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.0 mp -100.32 26.28 6.75 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.546 1.138 . . . . 0.0 111.285 178.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -64.0 -49.77 71.15 Favored 'General case' 0 C--N 1.341 0.236 0 O-C-N 121.395 -0.816 . . . . 0.0 110.831 177.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 53.0 p-90 -53.51 -43.1 68.03 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.077 0.551 . . . . 0.0 110.5 172.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tt -66.77 -51.07 60.03 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.484 1.114 . . . . 0.0 110.115 -171.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.0 p -61.06 -39.71 90.87 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -67.7 -50.33 58.14 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.445 0.566 . . . . 0.0 110.633 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -60.44 -59.33 5.57 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.094 1.357 . . . . 0.0 111.432 -175.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -89.53 -55.63 3.57 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.648 0.779 . . . . 0.0 110.875 -173.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -89.49 48.34 1.59 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 122.778 0.431 . . . . 0.0 110.409 -169.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -179.89 -65.94 0.07 OUTLIER Glycine 0 C--N 1.339 0.728 0 N-CA-C 109.49 -1.444 . . . . 0.0 109.49 -176.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.046 0 CA-C-N 116.964 0.382 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 90.5 m . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 55.4 ttt85 -63.4 102.03 0.37 Allowed 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 176.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.3 98.37 0.62 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.593 1.157 . . . . 0.0 112.301 -169.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 131.39 -72.91 0.47 Allowed Glycine 0 CA--C 1.525 0.71 0 N-CA-C 108.098 -2.001 . . . . 0.0 108.098 176.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_exo -49.49 -40.79 45.18 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 124.599 3.533 . . . . 0.0 114.332 175.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 94.0 mt -127.06 3.09 6.5 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.972 0.909 . . . . 0.0 113.302 -174.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -57.98 -57.1 14.31 Favored 'General case' 0 C--N 1.341 0.208 0 CA-C-N 119.623 1.101 . . . . 0.0 110.013 -178.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 46.0 p-90 -49.69 -44.86 48.27 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 125.2 1.4 . . . . 0.0 111.534 176.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 tt -66.32 -51.32 58.5 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 124.453 1.101 . . . . 0.0 108.866 -173.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.1 m -61.1 -49.65 76.44 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 122.884 0.473 . . . . 0.0 111.284 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -54.76 -51.96 64.07 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.768 0.427 . . . . 0.0 111.165 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -68.7 -53.69 20.64 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.308 0.643 . . . . 0.0 111.926 -171.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.3 m-85 -89.56 -45.59 9.28 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.252 0.621 . . . . 0.0 112.083 -170.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 5.0 m-30 -88.87 -41.95 12.15 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.318 0.508 . . . . 0.0 110.088 -169.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.17 -58.49 6.08 Favored Glycine 0 CA--C 1.528 0.869 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 170.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.041 0 O-C-N 122.426 -0.455 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 40.8 t . . . . . 0 N--CA 1.473 0.711 0 CA-C-O 119.773 -0.156 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 19.6 tpp180 -57.0 130.65 47.01 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 123.629 0.772 . . . . 0.0 109.336 179.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -68.6 163.92 22.59 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -169.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 163.32 -175.35 39.61 Favored Glycine 0 CA--C 1.53 1.015 0 N-CA-C 108.369 -1.892 . . . . 0.0 108.369 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -51.18 -34.77 49.7 Favored 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 123.916 3.077 . . . . 0.0 113.32 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 39.0 mt -107.89 29.99 6.75 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.485 1.114 . . . . 0.0 111.809 -173.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -65.19 -50.7 64.92 Favored 'General case' 0 C--N 1.344 0.336 0 CA-C-N 119.33 0.968 . . . . 0.0 110.376 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.2 p-90 -49.99 -43.98 50.77 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.559 1.144 . . . . 0.0 111.047 174.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.56 -49.71 67.84 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.703 1.201 . . . . 0.0 108.925 -177.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.7 t -54.89 -54.63 40.12 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.681 1.192 . . . . 0.0 111.106 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -57.37 -55.5 33.92 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.142 0.977 . . . . 0.0 111.108 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -67.6 -51.45 50.2 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.176 0.59 . . . . 0.0 112.2 -169.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -89.36 -48.65 7.2 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 122.809 0.444 . . . . 0.0 111.724 -171.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -89.01 -37.78 14.92 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 -169.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.94 -61.81 3.61 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 173.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.046 0 O-C-N 122.448 -0.442 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 45.8 t . . . . . 0 N--CA 1.474 0.743 0 N-CA-C 111.048 0.018 . . . . 0.0 111.048 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -82.15 71.59 9.2 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 107.507 -1.294 . . . . 0.0 107.507 177.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.58 78.93 1.98 Allowed 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.07 1.348 . . . . 0.0 112.11 -169.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -179.79 -93.71 0.09 OUTLIER Glycine 0 CA--C 1.527 0.829 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 169.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -65.37 -42.52 12.89 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 123.293 2.662 . . . . 0.0 111.033 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 55.6 mt -105.32 34.0 3.44 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.414 1.086 . . . . 0.0 110.257 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -62.87 -42.3 99.71 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 123.359 0.663 . . . . 0.0 110.279 177.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 60.7 p-90 -60.13 -36.31 77.22 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.69 0.796 . . . . 0.0 111.104 174.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.66 -42.65 77.63 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 179.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.6 t -59.26 -53.12 61.89 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.431 0.692 . . . . 0.0 112.241 173.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.72 -25.71 66.64 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 118.104 0.411 . . . . 0.0 112.023 -172.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -90.05 -58.49 2.49 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.761 0.825 . . . . 0.0 111.035 176.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -89.55 -59.29 2.25 Favored 'General case' 0 C--N 1.341 0.236 0 C-N-CA 123.72 0.808 . . . . 0.0 111.794 -171.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -88.64 64.22 7.28 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 -169.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 82.11 57.35 2.68 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 -170.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.054 0 O-C-N 122.585 -0.362 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 54.0 t . . . . . 0 N--CA 1.473 0.704 0 CA-C-O 119.616 -0.23 . . . . 0.0 110.799 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.1 tpm_? -169.03 82.83 0.14 Allowed 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 107.675 -1.232 . . . . 0.0 107.675 175.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.38 78.08 5.9 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.796 0.839 . . . . 0.0 109.938 -179.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -177.05 -98.82 0.11 Allowed Glycine 0 CA--C 1.529 0.929 0 N-CA-C 110.095 -1.202 . . . . 0.0 110.095 172.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -63.94 -41.56 22.81 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.249 2.633 . . . . 0.0 111.191 -177.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.8 mp -103.48 31.28 4.45 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.567 1.147 . . . . 0.0 110.186 176.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -57.73 -55.46 34.55 Favored 'General case' 0 C--N 1.343 0.289 0 O-C-N 121.41 -0.806 . . . . 0.0 109.417 174.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 45.7 p-90 -57.18 -41.39 79.21 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.889 1.276 . . . . 0.0 111.732 176.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -66.6 -49.72 65.39 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -174.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 95.2 m -55.03 -55.51 30.09 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.168 0.987 . . . . 0.0 110.91 172.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.11 -33.32 75.2 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.333 0.653 . . . . 0.0 112.149 -171.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -87.13 -53.6 4.78 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.664 0.785 . . . . 0.0 111.38 -174.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -89.52 -53.4 4.55 Favored 'General case' 0 C--N 1.34 0.179 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -169.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -89.21 -68.09 0.8 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 122.347 0.259 . . . . 0.0 111.194 -168.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -104.32 51.07 0.82 Allowed Glycine 0 CA--C 1.525 0.679 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 174.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.048 0 CA-C-N 117.113 0.457 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 50.1 t . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 111.223 0.082 . . . . 0.0 111.223 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 88.9 mtm180 -72.84 100.68 2.95 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.658 0.783 . . . . 0.0 109.782 -175.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -77.53 60.75 2.17 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.009 1.324 . . . . 0.0 111.177 -179.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -159.26 -80.11 0.03 OUTLIER Glycine 0 CA--C 1.527 0.795 0 N-CA-C 108.483 -1.847 . . . . 0.0 108.483 174.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -65.93 -43.01 10.08 Favored 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 123.32 2.68 . . . . 0.0 111.071 177.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.2 mp -101.48 19.98 16.87 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.34 1.056 . . . . 0.0 110.758 179.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -56.27 -49.54 73.91 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 120.027 1.285 . . . . 0.0 111.92 -174.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.6 p-90 -54.06 -38.56 65.39 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.154 1.382 . . . . 0.0 111.662 172.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.64 -45.47 75.24 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.225 1.01 . . . . 0.0 109.14 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 11.1 m -57.32 -50.45 72.89 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 124.097 0.959 . . . . 0.0 110.017 176.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.48 -43.22 73.63 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.927 0.491 . . . . 0.0 111.345 -172.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -77.82 -50.88 11.42 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.641 0.776 . . . . 0.0 111.351 -171.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -89.37 -57.55 2.85 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -175.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -89.73 47.25 1.44 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 122.875 0.47 . . . . 0.0 110.243 -170.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -80.44 67.9 3.42 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 124.098 0.856 . . . . 0.0 111.054 -174.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.089 0 O-C-N 122.404 -0.468 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 39.9 t . . . . . 0 N--CA 1.474 0.749 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 20.6 tpp85 -74.2 122.76 23.31 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 174.033 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.19 116.89 5.84 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.455 0.702 . . . . 0.0 109.829 176.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -167.53 -159.38 13.01 Favored Glycine 0 CA--C 1.531 1.084 0 N-CA-C 109.99 -1.244 . . . . 0.0 109.99 -178.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -50.71 -34.75 45.14 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 124.62 3.546 . . . . 0.0 113.999 179.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.9 mt -99.93 22.67 10.85 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.34 1.056 . . . . 0.0 111.879 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -61.21 -55.74 28.63 Favored 'General case' 0 C--N 1.343 0.31 0 CA-C-N 118.778 0.717 . . . . 0.0 110.236 178.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 35.2 p-90 -52.03 -42.69 63.29 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.923 0.889 . . . . 0.0 111.411 177.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -64.16 -53.62 46.59 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 122.864 0.465 . . . . 0.0 111.71 178.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 18.6 p -61.64 -38.51 87.94 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 -174.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -74.32 -55.42 6.03 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.045 0.538 . . . . 0.0 111.019 178.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -74.6 -53.61 9.04 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.334 0.654 . . . . 0.0 111.954 -169.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 69.6 m-85 -89.53 -54.91 3.87 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 123.381 0.672 . . . . 0.0 110.086 -172.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -89.71 37.49 0.88 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 117.887 0.312 . . . . 0.0 110.597 -173.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 173.36 -164.8 36.68 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 -174.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.065 0 O-C-N 122.392 -0.475 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 97.7 m . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 111.62 0.23 . . . . 0.0 111.62 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 53.7 ttp180 -80.94 73.4 7.96 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 169.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -69.27 79.85 0.36 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.644 1.578 . . . . 0.0 112.369 -169.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -171.81 -81.91 0.05 OUTLIER Glycine 0 CA--C 1.526 0.777 0 N-CA-C 107.561 -2.216 . . . . 0.0 107.561 172.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -65.56 -34.94 40.41 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 123.342 2.695 . . . . 0.0 111.225 172.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.5 tp -101.02 12.89 36.84 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.825 1.25 . . . . 0.0 111.432 -178.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.9 tp60 -59.84 -56.42 22.03 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 123.589 0.755 . . . . 0.0 110.783 -174.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 50.3 p-90 -51.57 -39.58 58.13 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.927 1.291 . . . . 0.0 112.037 177.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.19 -45.51 84.52 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.012 0.925 . . . . 0.0 108.798 -179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 12.8 t -59.4 -46.59 88.27 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.33 0.652 . . . . 0.0 111.434 176.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -57.58 -55.38 35.63 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 123.705 0.802 . . . . 0.0 111.039 178.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -73.85 -52.34 13.33 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.722 0.809 . . . . 0.0 112.093 -169.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -89.91 -57.92 2.69 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.134 0.574 . . . . 0.0 111.065 -174.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -89.47 61.12 5.46 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.828 0.451 . . . . 0.0 110.948 -169.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 83.08 -61.64 4.75 Favored Glycine 0 CA--C 1.527 0.783 0 C-N-CA 123.967 0.794 . . . . 0.0 111.209 177.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.098 0 O-C-N 122.386 -0.479 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 30.9 t . . . . . 0 N--CA 1.474 0.731 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -83.69 78.31 9.71 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 106.548 -1.649 . . . . 0.0 106.548 169.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -76.54 62.87 1.97 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.335 1.454 . . . . 0.0 112.614 -169.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -161.45 -78.21 0.03 OUTLIER Glycine 0 CA--C 1.527 0.795 0 N-CA-C 108.149 -1.98 . . . . 0.0 108.149 172.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -64.61 -43.35 13.44 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 123.428 2.752 . . . . 0.0 111.672 177.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 36.3 mt -107.34 23.8 13.85 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.937 0.895 . . . . 0.0 111.091 -177.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -60.53 -56.04 26.13 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.651 0.66 . . . . 0.0 110.486 -175.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 57.7 p-90 -47.16 -42.18 19.21 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.55 1.54 . . . . 0.0 111.658 172.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -64.44 -47.84 77.56 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 125.218 1.407 . . . . 0.0 108.993 -176.051 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 57.5 m -56.43 -51.15 69.48 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 122.957 0.503 . . . . 0.0 110.93 176.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -60.04 -46.63 88.88 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 122.244 0.217 . . . . 0.0 111.483 -177.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.1 ttmm -67.7 -56.5 9.08 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.6 0.36 . . . . 0.0 111.7 -176.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -89.77 -50.08 6.26 Favored 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 123.399 0.68 . . . . 0.0 112.327 -169.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 -89.39 -19.16 25.53 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 122.636 0.374 . . . . 0.0 111.829 -169.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.04 44.56 11.65 Favored Glycine 0 CA--C 1.528 0.904 0 N-CA-C 110.69 -0.964 . . . . 0.0 110.69 -175.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.039 0 O-C-N 122.316 -0.52 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 38.9 t . . . . . 0 N--CA 1.474 0.75 0 N-CA-C 111.22 0.081 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 77.8 mtm180 -67.84 135.93 53.32 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.124 0.57 . . . . 0.0 109.759 -177.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -70.82 157.34 38.26 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -171.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 164.55 -175.73 40.52 Favored Glycine 0 CA--C 1.532 1.132 0 N-CA-C 109.132 -1.587 . . . . 0.0 109.132 -172.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -64.1 -27.11 65.28 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 123.485 2.79 . . . . 0.0 112.119 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 48.8 mt -102.48 26.4 7.91 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.327 1.051 . . . . 0.0 111.57 177.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -60.84 -53.74 53.62 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 118.972 0.805 . . . . 0.0 109.916 176.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 55.4 p-90 -50.57 -46.18 57.55 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.385 1.074 . . . . 0.0 110.753 177.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -64.67 -49.27 71.64 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.851 1.26 . . . . 0.0 109.053 -175.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 20.9 t -56.14 -55.25 35.32 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.123 0.969 . . . . 0.0 110.967 179.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -59.71 -48.42 81.75 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.583 0.753 . . . . 0.0 111.324 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -61.73 -60.13 4.13 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.645 1.178 . . . . 0.0 111.812 -175.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -89.69 -44.83 9.75 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 122.991 0.517 . . . . 0.0 112.019 -169.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -89.16 -40.55 12.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.241 0.473 . . . . 0.0 110.111 -169.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -71.72 -62.73 3.29 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 110.749 -0.941 . . . . 0.0 110.749 177.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.033 0 O-C-N 122.353 -0.498 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 30.2 t . . . . . 0 N--CA 1.473 0.722 0 CA-C-O 118.652 -0.69 . . . . 0.0 110.128 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.11 66.5 6.74 Favored 'General case' 0 C--N 1.341 0.233 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 169.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.23 126.2 26.47 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.962 0.905 . . . . 0.0 110.532 -173.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 109.92 -99.89 1.25 Allowed Glycine 0 CA--C 1.534 1.221 0 C-N-CA 125.006 1.289 . . . . 0.0 110.671 -174.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.64 -60.72 0.06 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 123.533 2.822 . . . . 0.0 113.399 -169.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.5 mt -99.94 31.83 3.14 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.42 0.688 . . . . 0.0 110.662 -173.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -71.78 -50.31 31.07 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.391 1.077 . . . . 0.0 109.301 -178.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 52.6 p-90 -58.99 -40.42 84.8 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.666 0.786 . . . . 0.0 110.922 172.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.7 -39.87 88.24 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.573 0.749 . . . . 0.0 109.285 -176.309 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 51.9 t -66.67 -51.99 49.89 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 122.694 0.398 . . . . 0.0 111.36 174.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.21 -27.17 68.24 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 117.962 0.346 . . . . 0.0 111.569 -177.205 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.5 tttp -83.88 -65.72 0.98 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.698 1.199 . . . . 0.0 110.815 178.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -90.3 -55.63 3.53 Favored 'General case' 0 C--N 1.34 0.186 0 C-N-CA 124.155 0.982 . . . . 0.0 111.978 -170.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -89.26 64.18 6.8 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 -169.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 82.18 57.59 2.62 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 108.861 -1.696 . . . . 0.0 108.861 -169.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.065 0 O-C-N 122.696 -0.296 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 42.5 t . . . . . 0 N--CA 1.475 0.823 0 N-CA-C 111.398 0.147 . . . . 0.0 111.398 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 94.7 mtt-85 -56.91 121.71 10.55 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.953 0.901 . . . . 0.0 109.585 176.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -69.49 159.07 33.98 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.008 0.523 . . . . 0.0 111.586 -174.108 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 158.83 -174.28 35.84 Favored Glycine 0 CA--C 1.53 0.98 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 -174.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -68.06 -11.35 31.77 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 123.456 2.77 . . . . 0.0 112.767 178.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 60.0 mt -109.56 15.57 22.81 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.795 1.238 . . . . 0.0 111.496 176.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -61.46 -50.98 70.6 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 118.996 0.816 . . . . 0.0 110.597 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 34.6 p-90 -54.17 -43.45 70.64 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.532 1.133 . . . . 0.0 111.401 178.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 12.7 mt -63.75 -49.84 71.45 Favored 'General case' 0 C--N 1.339 0.121 0 C-N-CA 122.96 0.504 . . . . 0.0 110.889 175.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 18.1 t -55.79 -44.67 77.98 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.729 0.811 . . . . 0.0 111.584 -177.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -75.86 -58.87 3.02 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.784 0.834 . . . . 0.0 111.013 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -71.76 -54.86 8.89 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.773 0.829 . . . . 0.0 112.944 -169.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -89.12 -45.36 9.65 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 123.19 0.596 . . . . 0.0 111.16 -169.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -88.94 -43.45 11.15 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 -169.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -70.62 -61.44 4.12 Favored Glycine 0 CA--C 1.528 0.854 0 N-CA-C 110.13 -1.188 . . . . 0.0 110.13 172.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 -0.041 0 O-C-N 122.354 -0.498 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . . . . . . . . . 17.6 t . . . . . 0 N--CA 1.475 0.813 0 CA-C-O 119.823 -0.132 . . . . 0.0 111.245 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.5 tpm_? -45.91 111.25 0.33 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.407 1.483 . . . . 0.0 110.314 175.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.98 69.96 5.23 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.233 1.013 . . . . 0.0 110.648 -175.551 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -111.01 -165.87 18.74 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 125.0 1.286 . . . . 0.0 110.648 177.183 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -52.04 -35.62 62.12 Favored 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 124.271 3.314 . . . . 0.0 113.003 175.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.2 mt -99.82 27.97 5.08 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.588 1.155 . . . . 0.0 111.446 -177.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -58.68 -54.89 42.02 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 123.691 0.796 . . . . 0.0 110.447 177.3 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 57.3 p-90 -55.32 -39.52 70.06 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.996 1.318 . . . . 0.0 111.283 176.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 tt -66.17 -49.96 65.57 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 -176.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.4 t -57.6 -52.69 64.37 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.138 0.575 . . . . 0.0 111.287 176.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.13 -41.39 96.64 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.697 0.399 . . . . 0.0 111.043 -174.42 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -76.14 -53.38 8.38 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.729 0.812 . . . . 0.0 111.338 -174.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -89.31 -45.82 9.22 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 122.872 0.469 . . . . 0.0 112.025 -170.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -88.86 -42.05 12.1 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -169.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -73.63 -63.38 2.75 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 172.122 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 -0.02 0 O-C-N 122.303 -0.528 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_