data_1lfc_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 1lfc _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 ' 3' ' ' CYS . . . . . 0.454 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.599 0.714 . . . . 0.0 110.545 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.539 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -153.09 -31.8 0.13 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.529 -0.732 . . . . 0.0 111.475 -179.765 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.53 ' CG ' ' HD3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -146.64 84.41 1.61 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.779 -1.201 . . . . 0.0 111.636 -179.376 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.668 ' HB3' HG12 ' A' ' 18' ' ' ILE . 90.5 m95 -66.06 100.93 0.63 Allowed 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.104 -0.997 . . . . 0.0 109.768 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.493 ' HB3' HG12 ' A' ' 21' ' ' VAL . 28.9 tt0 -87.96 112.45 22.58 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.094 -1.004 . . . . 0.0 110.537 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.585 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 50.7 m95 -51.01 104.86 0.09 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.304 -0.873 . . . . 0.0 110.419 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.1 mtp180 -79.11 -177.15 5.48 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.247 -0.908 . . . . 0.0 109.709 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -82.9 154.85 24.38 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.154 -0.966 . . . . 0.0 110.232 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.514 ' CD ' ' OG ' ' A' ' 17' ' ' SER . 1.4 mtpt -159.1 -154.74 0.43 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.481 -0.762 . . . . 0.0 110.193 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.498 ' O ' ' O ' ' A' ' 11' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.496 1.829 0 CA-C-O 121.784 0.802 . . . . 0.0 110.907 -179.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.477 ' HB2' ' HB3' ' A' ' 8' ' ' TRP . 49.0 Cg_endo . . . . . 0 N--CA 1.483 0.877 0 N-CA-C 110.223 -0.722 . . . . 0.0 110.223 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.514 ' OG ' ' CD ' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -136.89 97.55 3.55 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.131 -0.981 . . . . 0.0 109.936 179.429 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.668 HG12 ' HB3' ' A' ' 6' ' ' TRP . 2.0 tt -73.96 113.94 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.125 -0.985 . . . . 0.0 110.139 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.543 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 21.2 m -111.73 173.72 6.22 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.361 -0.837 . . . . 0.0 109.752 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.569 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 44.3 t -79.57 118.65 21.61 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.095 -1.003 . . . . 0.0 110.211 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.521 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -108.56 26.78 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.103 -0.998 . . . . 0.0 109.754 -179.958 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.539 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.34 132.95 4.84 Favored 'General case' 0 C--N 1.293 -1.868 0 O-C-N 121.904 -0.497 . . . . 0.0 110.099 179.829 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.5 mtp-105 -106.73 54.09 0.68 Allowed 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.073 -1.017 . . . . 0.0 110.037 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.601 0 O-C-N 121.333 -0.854 . . . . 0.0 110.231 179.981 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.616 0.722 . . . . 0.0 110.505 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.541 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -153.12 -32.03 0.13 Allowed 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.347 -179.686 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.53 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -151.22 89.85 1.55 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.731 -1.231 . . . . 0.0 111.769 -179.257 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.665 ' HB3' HG12 ' A' ' 18' ' ' ILE . 88.6 m95 -67.67 98.45 0.7 Allowed 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.207 -0.933 . . . . 0.0 109.773 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.491 ' HB3' HG12 ' A' ' 21' ' ' VAL . 23.1 tt0 -86.06 107.3 17.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.184 -0.947 . . . . 0.0 110.584 -179.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.591 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 52.9 m95 -45.26 102.79 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.231 -0.918 . . . . 0.0 110.325 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' A' ' 17' ' ' SER . 5.8 mmm180 -78.96 -171.77 2.77 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.167 -0.958 . . . . 0.0 109.619 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.1 mtp -80.17 152.85 28.98 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.071 -1.018 . . . . 0.0 110.362 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.529 ' CG ' ' HB2' ' A' ' 17' ' ' SER . 0.0 OUTLIER -159.81 -156.67 0.51 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.616 -0.678 . . . . 0.0 109.667 179.667 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' A' ' 11' ' ' LYS . 3.6 mttt . . . . . 0 N--CA 1.493 1.686 0 C-N-CA 119.742 -0.783 . . . . 0.0 109.764 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.584 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.1 Cg_endo . . . . . 0 N--CA 1.48 0.678 0 N-CA-C 110.119 -0.762 . . . . 0.0 110.119 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.529 ' HB2' ' CG ' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -135.48 95.91 3.36 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.094 -1.004 . . . . 0.0 110.135 179.322 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.665 HG12 ' HB3' ' A' ' 6' ' ' TRP . 1.7 tt -74.75 112.39 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 120.981 -1.074 . . . . 0.0 109.769 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.538 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 7.2 m -111.14 172.84 6.64 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.347 -0.846 . . . . 0.0 109.95 -179.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.575 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 43.4 t -79.55 114.07 18.19 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.239 -0.913 . . . . 0.0 109.868 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.53 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.1 m -103.06 27.19 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.054 -1.029 . . . . 0.0 110.121 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.541 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.44 137.27 6.83 Favored 'General case' 0 C--N 1.291 -1.941 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.186 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 73.5 mtt-85 -108.03 53.86 0.68 Allowed 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.045 -1.034 . . . . 0.0 110.034 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.349 -0.844 . . . . 0.0 110.233 -179.946 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.657 0.741 . . . . 0.0 110.566 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.551 ' HD3' ' CB ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -154.61 -32.09 0.1 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.607 -0.683 . . . . 0.0 110.959 -179.618 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.551 ' CB ' ' HD3' ' A' ' 4' ' ' ARG . 0.1 OUTLIER -135.01 77.83 1.7 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.812 -1.18 . . . . 0.0 111.426 -179.392 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.662 ' HB3' HG12 ' A' ' 18' ' ' ILE . 91.2 m95 -66.66 108.87 2.62 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.014 -1.054 . . . . 0.0 110.082 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.474 ' HB3' HG12 ' A' ' 21' ' ' VAL . 14.9 tt0 -93.95 112.51 24.36 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.076 -1.015 . . . . 0.0 110.398 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.594 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 55.5 m95 -52.0 103.67 0.07 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.27 -0.894 . . . . 0.0 110.342 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 70.9 mtp180 -79.14 -179.18 6.55 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.346 -0.847 . . . . 0.0 109.748 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -77.26 156.05 31.69 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.177 -0.952 . . . . 0.0 109.934 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.494 ' CG ' ' N ' ' A' ' 12' ' ' LYS . 14.9 tttt -157.93 169.74 23.91 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.449 -0.782 . . . . 0.0 110.026 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.494 ' N ' ' CG ' ' A' ' 11' ' ' LYS . 4.3 mtmt . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.184 -0.947 . . . . 0.0 109.953 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.59 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 41.0 Cg_endo . . . . . 0 N--CA 1.486 1.088 0 N-CA-C 110.74 -0.523 . . . . 0.0 110.74 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.445 ' OG ' ' HB2' ' A' ' 11' ' ' LYS . 13.1 m -133.49 97.34 3.92 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.332 -0.855 . . . . 0.0 110.035 179.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.662 HG12 ' HB3' ' A' ' 6' ' ' TRP . 2.0 tt -75.51 115.49 17.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.121 -0.987 . . . . 0.0 110.223 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.537 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 58.3 m -111.33 175.47 5.41 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.356 -0.84 . . . . 0.0 109.768 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 48.5 t -79.42 129.53 34.55 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.144 -0.972 . . . . 0.0 110.115 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.526 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 0.8 OUTLIER -126.56 25.55 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.13 -0.981 . . . . 0.0 110.1 -179.818 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.467 ' HB3' ' HB3' ' A' ' 4' ' ' ARG . 1.7 tpm_? -162.65 159.08 24.03 Favored 'General case' 0 C--N 1.289 -2.023 0 O-C-N 121.801 -0.562 . . . . 0.0 110.321 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.37 155.37 19.18 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.239 -0.913 . . . . 0.0 109.817 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.609 0 O-C-N 121.274 -0.891 . . . . 0.0 110.238 -179.851 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.576 0.703 . . . . 0.0 110.486 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.541 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -146.89 -32.74 0.31 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.543 -0.723 . . . . 0.0 111.255 -179.7 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.525 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 17.6 ttm-85 -150.6 92.07 1.81 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.859 -1.151 . . . . 0.0 111.589 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.665 ' HB3' HG12 ' A' ' 18' ' ' ILE . 82.0 m95 -70.39 106.84 3.54 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.286 -0.884 . . . . 0.0 110.049 179.165 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.474 ' HB3' HG12 ' A' ' 21' ' ' VAL . 23.7 tt0 -92.21 109.28 20.65 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.199 -0.938 . . . . 0.0 110.464 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.59 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 54.2 m95 -48.84 103.68 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.27 -0.894 . . . . 0.0 110.512 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.489 ' HG3' ' CG2' ' A' ' 19' ' ' THR . 1.0 OUTLIER -79.15 -174.72 4.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.19 -0.944 . . . . 0.0 109.603 179.702 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 mtt -82.74 153.63 25.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.084 -1.01 . . . . 0.0 110.275 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.524 ' CD ' ' HB3' ' A' ' 17' ' ' SER . 0.1 OUTLIER -158.0 -155.55 0.51 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.474 -0.766 . . . . 0.0 110.102 179.818 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.493 ' O ' ' O ' ' A' ' 11' ' ' LYS . 6.1 mtmt . . . . . 0 N--CA 1.494 1.748 0 CA-C-O 121.77 0.795 . . . . 0.0 110.73 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.563 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.6 Cg_endo . . . . . 0 N--CA 1.482 0.829 0 N-CA-C 110.252 -0.711 . . . . 0.0 110.252 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.524 ' HB3' ' CD ' ' A' ' 11' ' ' LYS . 0.2 OUTLIER -138.74 95.59 3.0 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.189 -0.944 . . . . 0.0 110.038 179.621 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.665 HG12 ' HB3' ' A' ' 6' ' ' TRP . 1.7 tt -74.53 117.57 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.161 -0.962 . . . . 0.0 110.111 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.542 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 0.2 OUTLIER -116.82 177.09 4.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.236 -0.915 . . . . 0.0 110.077 -179.936 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 50.9 t -79.97 118.21 21.5 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.315 -0.866 . . . . 0.0 109.558 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.525 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -109.48 24.97 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.02 -1.05 . . . . 0.0 110.147 -179.475 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.541 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.86 113.44 1.45 Allowed 'General case' 0 C--N 1.292 -1.929 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.123 179.638 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.3 mtt85 -95.09 55.07 1.75 Allowed 'General case' 0 C--N 1.302 -1.473 0 O-C-N 120.92 -1.113 . . . . 0.0 110.137 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.57 0 O-C-N 121.309 -0.869 . . . . 0.0 110.208 -179.948 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.51 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.599 0.714 . . . . 0.0 110.529 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.583 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -143.23 -33.42 0.44 Allowed 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.605 -0.685 . . . . 0.0 111.258 -179.581 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.583 ' N ' ' CD ' ' A' ' 4' ' ' ARG . 1.5 tpm_? -117.3 75.83 1.01 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.977 -1.077 . . . . 0.0 111.001 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.658 ' HB3' HG12 ' A' ' 18' ' ' ILE . 69.3 m95 -74.27 97.87 3.09 Favored 'General case' 0 C--N 1.306 -1.316 0 O-C-N 121.229 -0.919 . . . . 0.0 110.337 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.468 ' HB3' HG12 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -85.95 101.67 13.09 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.17 -0.956 . . . . 0.0 110.251 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.588 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 52.3 m95 -41.75 104.42 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.278 -0.888 . . . . 0.0 110.618 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.458 ' HD2' ' CG2' ' A' ' 19' ' ' THR . 7.6 mtp180 -79.22 -172.41 3.15 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.173 -0.954 . . . . 0.0 109.454 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.9 mmt -85.6 154.77 21.48 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.039 -1.038 . . . . 0.0 110.215 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.524 ' CD ' ' OG ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -158.77 -155.12 0.46 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.497 -0.752 . . . . 0.0 110.179 179.802 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.493 ' O ' ' O ' ' A' ' 11' ' ' LYS . 2.3 mtmp? . . . . . 0 N--CA 1.496 1.828 0 CA-C-O 121.801 0.81 . . . . 0.0 110.771 -179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.575 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.9 Cg_endo . . . . . 0 N--CA 1.483 0.865 0 N-CA-C 110.225 -0.721 . . . . 0.0 110.225 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.524 ' OG ' ' CD ' ' A' ' 11' ' ' LYS . 0.3 OUTLIER -137.16 95.91 3.19 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.252 -0.905 . . . . 0.0 110.088 179.567 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.658 HG12 ' HB3' ' A' ' 6' ' ' TRP . 1.2 tt -75.77 115.25 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.1 -1.0 . . . . 0.0 110.132 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.588 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 11.9 t -112.6 -153.39 0.52 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.181 -0.95 . . . . 0.0 109.855 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.1 t -112.15 114.28 27.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.023 -1.048 . . . . 0.0 109.98 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.469 HG23 ' HG2' ' A' ' 5' ' ' ARG . 0.8 OUTLIER -107.65 21.91 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.12 -0.987 . . . . 0.0 109.913 -179.733 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.513 ' HD3' ' NE ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.82 89.15 0.64 Allowed 'General case' 0 C--N 1.29 -1.983 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.025 179.854 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 14.4 mtt180 -79.61 76.24 6.25 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.043 -1.035 . . . . 0.0 110.143 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.326 -0.859 . . . . 0.0 110.236 179.954 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.595 0.712 . . . . 0.0 110.485 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.537 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -149.95 -34.65 0.17 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.558 -0.714 . . . . 0.0 111.055 -179.905 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.527 ' CB ' ' HD3' ' A' ' 4' ' ' ARG . 0.4 OUTLIER -152.52 91.38 1.57 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.994 -1.066 . . . . 0.0 111.212 -179.466 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.675 ' HB3' HG12 ' A' ' 18' ' ' ILE . 83.1 m95 -63.73 121.98 15.29 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.27 -0.893 . . . . 0.0 110.166 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.498 ' HB3' HG12 ' A' ' 21' ' ' VAL . 2.6 tt0 -104.38 124.06 48.54 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.174 -0.953 . . . . 0.0 110.221 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.611 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 64.6 m95 -61.72 106.26 0.65 Allowed 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.217 -0.927 . . . . 0.0 110.441 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -79.4 -177.06 5.56 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.352 -0.843 . . . . 0.0 109.815 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.01 153.49 21.24 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.197 -0.939 . . . . 0.0 109.749 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.519 ' CD ' ' OG ' ' A' ' 17' ' ' SER . 0.1 OUTLIER -162.9 -153.92 0.27 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.369 -0.832 . . . . 0.0 110.503 -179.741 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.516 ' O ' ' O ' ' A' ' 11' ' ' LYS . 1.3 mtpp . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 121.6 0.714 . . . . 0.0 110.578 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.59 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 42.8 Cg_endo . . . . . 0 N--CA 1.483 0.892 0 N-CA-C 110.809 -0.496 . . . . 0.0 110.809 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.519 ' OG ' ' CD ' ' A' ' 11' ' ' LYS . 2.7 m -135.58 96.73 3.51 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.374 -0.829 . . . . 0.0 110.077 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.675 HG12 ' HB3' ' A' ' 6' ' ' TRP . 3.7 tt -74.0 118.28 19.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.163 -0.961 . . . . 0.0 110.301 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.532 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 26.8 m -112.45 177.49 4.62 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.291 -0.881 . . . . 0.0 109.853 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.458 ' SG ' ' O ' ' A' ' 22' ' ' ARG . 42.9 t -79.43 118.3 21.18 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.14 -0.975 . . . . 0.0 109.983 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.525 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 0.9 OUTLIER -106.21 27.39 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.046 -1.034 . . . . 0.0 109.855 -179.77 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.537 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.24 134.36 5.56 Favored 'General case' 0 C--N 1.293 -1.885 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.144 179.826 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.2 mtt85 -108.2 54.27 0.67 Allowed 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.026 -1.046 . . . . 0.0 110.165 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.596 0 O-C-N 121.314 -0.866 . . . . 0.0 110.233 -179.948 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.506 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.611 0.72 . . . . 0.0 110.551 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.532 ' CD ' ' HB2' ' A' ' 5' ' ' ARG . 0.6 OUTLIER -152.89 -30.31 0.14 Allowed 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 119.943 -0.703 . . . . 0.0 111.713 -179.545 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.532 ' HB2' ' CD ' ' A' ' 4' ' ' ARG . 9.1 mtt-85 -135.56 77.49 1.67 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.742 -1.224 . . . . 0.0 111.534 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.666 ' HB3' HG12 ' A' ' 18' ' ' ILE . 87.6 m95 -66.17 99.26 0.51 Allowed 'General case' 0 C--N 1.305 -1.326 0 O-C-N 121.068 -1.02 . . . . 0.0 109.975 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.484 ' HB3' HG12 ' A' ' 21' ' ' VAL . 2.4 tt0 -85.84 109.21 18.53 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.158 -0.964 . . . . 0.0 110.589 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.586 ' NE1' ' CD1' ' A' ' 18' ' ' ILE . 49.2 m95 -48.07 102.6 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.255 -0.903 . . . . 0.0 110.585 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.442 ' HD2' ' HB ' ' A' ' 19' ' ' THR . 0.3 OUTLIER -78.98 -176.82 5.25 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.136 -0.978 . . . . 0.0 109.588 179.699 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.425 ' O ' ' OG ' ' A' ' 17' ' ' SER . 2.2 mtm -79.28 154.24 29.3 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.957 -1.089 . . . . 0.0 110.26 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.526 ' CG ' ' HB3' ' A' ' 17' ' ' SER . 0.1 OUTLIER -157.41 -155.77 0.54 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.413 -0.805 . . . . 0.0 110.088 179.8 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.479 ' O ' ' O ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 121.79 0.805 . . . . 0.0 110.683 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.561 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.6 Cg_endo . . . . . 0 N--CA 1.482 0.795 0 N-CA-C 110.208 -0.728 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.526 ' HB3' ' CG ' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -136.87 95.92 3.21 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.153 -0.967 . . . . 0.0 110.069 179.554 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.666 HG12 ' HB3' ' A' ' 6' ' ' TRP . 1.7 tt -74.51 114.72 14.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.048 -1.032 . . . . 0.0 110.136 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.537 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 33.0 m -115.34 176.2 5.18 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.358 -0.839 . . . . 0.0 109.707 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.449 ' SG ' ' O ' ' A' ' 22' ' ' ARG . 47.7 t -79.4 123.96 28.0 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.091 -1.006 . . . . 0.0 110.218 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.522 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.3 m -113.07 22.18 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.183 -0.948 . . . . 0.0 110.11 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.526 ' CG ' ' HG2' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.93 145.07 10.31 Favored 'General case' 0 C--N 1.291 -1.97 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.061 179.531 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 26.3 ptt85 -118.69 59.26 0.82 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.104 -0.998 . . . . 0.0 110.154 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.245 -0.909 . . . . 0.0 110.219 -179.962 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.512 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.568 0.699 . . . . 0.0 110.508 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.539 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -150.12 -31.72 0.2 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.6 -0.688 . . . . 0.0 111.318 -179.703 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.52 ' HB2' ' CD ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -144.03 81.37 1.68 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 120.836 -1.165 . . . . 0.0 111.518 -179.394 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.664 ' HB3' HG12 ' A' ' 18' ' ' ILE . 91.3 m95 -66.19 101.54 0.73 Allowed 'General case' 0 C--N 1.306 -1.316 0 O-C-N 121.035 -1.041 . . . . 0.0 109.931 179.116 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.48 ' HB3' HG12 ' A' ' 21' ' ' VAL . 21.4 tt0 -88.95 113.23 24.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.108 -0.995 . . . . 0.0 110.624 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.581 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 52.6 m95 -51.63 106.47 0.14 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.258 -0.901 . . . . 0.0 110.444 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.8 mtp180 -79.21 -178.43 6.18 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.252 -0.905 . . . . 0.0 109.816 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.4 mtm -83.11 154.99 24.07 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.149 -0.969 . . . . 0.0 110.196 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -160.72 -155.04 0.4 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.488 -0.758 . . . . 0.0 110.227 179.934 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 11' ' ' LYS . 1.2 mtpt . . . . . 0 N--CA 1.495 1.802 0 CA-C-O 121.804 0.812 . . . . 0.0 110.96 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.48 ' HB2' ' HB3' ' A' ' 8' ' ' TRP . 48.4 Cg_endo . . . . . 0 N--CA 1.482 0.833 0 N-CA-C 110.215 -0.725 . . . . 0.0 110.215 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.47 ' CB ' ' HG3' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -136.67 97.83 3.64 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.162 -0.961 . . . . 0.0 109.894 179.345 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.664 HG12 ' HB3' ' A' ' 6' ' ' TRP . 2.1 tt -73.82 114.21 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.081 -1.012 . . . . 0.0 110.063 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.543 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 24.7 m -111.57 173.92 6.12 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.36 -0.837 . . . . 0.0 109.674 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.572 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 51.5 t -79.55 121.39 25.18 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.085 -1.009 . . . . 0.0 110.153 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.517 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -112.83 25.33 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.091 -1.006 . . . . 0.0 109.926 -179.921 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.539 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.63 93.96 0.85 Allowed 'General case' 0 C--N 1.292 -1.913 0 O-C-N 121.912 -0.492 . . . . 0.0 110.187 179.917 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -79.76 59.01 2.96 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.001 -1.062 . . . . 0.0 110.044 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.359 -0.838 . . . . 0.0 110.227 -179.9 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.502 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.617 0.722 . . . . 0.0 110.531 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.528 ' CD ' ' HB2' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -155.9 -32.18 0.09 Allowed 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.901 -0.72 . . . . 0.0 111.193 -179.729 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.529 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -136.67 78.88 1.73 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.923 -1.111 . . . . 0.0 111.623 -179.202 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.648 ' HB3' HG12 ' A' ' 18' ' ' ILE . 73.2 m95 -66.1 97.21 0.36 Allowed 'General case' 0 C--N 1.305 -1.327 0 O-C-N 120.994 -1.066 . . . . 0.0 109.625 178.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.478 ' HB3' HG12 ' A' ' 21' ' ' VAL . 31.0 tp60 -84.74 104.39 14.67 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.055 -1.028 . . . . 0.0 110.367 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.591 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 55.0 m95 -43.14 105.58 0.05 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.275 -0.891 . . . . 0.0 110.399 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.447 ' HG3' HG23 ' A' ' 19' ' ' THR . 5.2 mtp180 -79.31 179.91 7.14 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.283 -0.885 . . . . 0.0 109.721 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.457 ' O ' ' HD3' ' A' ' 11' ' ' LYS . 7.4 mtm -78.32 155.61 30.04 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.161 -0.962 . . . . 0.0 109.854 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.467 ' CE ' ' OG ' ' A' ' 17' ' ' SER . 0.6 OUTLIER -157.19 171.65 20.04 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.294 -0.879 . . . . 0.0 110.08 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 O-C-N 121.198 -0.939 . . . . 0.0 110.082 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.585 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 41.6 Cg_endo . . . . . 0 N--CA 1.487 1.113 0 N-CA-C 110.629 -0.566 . . . . 0.0 110.629 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.467 ' OG ' ' CE ' ' A' ' 11' ' ' LYS . 0.4 OUTLIER -133.26 97.36 3.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.36 -0.837 . . . . 0.0 110.001 179.477 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.648 HG12 ' HB3' ' A' ' 6' ' ' TRP . 1.5 tt -76.27 115.74 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.221 -0.924 . . . . 0.0 110.286 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.592 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 9.3 t -107.25 -158.24 0.65 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.281 -0.887 . . . . 0.0 109.773 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.4 t -108.11 120.04 41.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.21 -0.931 . . . . 0.0 110.4 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.529 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -113.11 28.36 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.111 -0.993 . . . . 0.0 109.778 179.897 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.517 ' HD2' ' CG ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.2 128.91 3.69 Favored 'General case' 0 C--N 1.292 -1.901 0 O-C-N 121.945 -0.472 . . . . 0.0 110.08 179.81 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 53.8 mtp85 -105.44 55.1 0.69 Allowed 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.031 -1.043 . . . . 0.0 110.175 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.596 0 O-C-N 121.3 -0.875 . . . . 0.0 110.223 179.943 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 121.574 0.702 . . . . 0.0 110.552 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.531 ' CD ' ' HB2' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -160.91 -31.81 0.05 Allowed 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 119.782 -0.767 . . . . 0.0 111.308 -179.682 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.531 ' HB2' ' CD ' ' A' ' 4' ' ' ARG . 0.2 OUTLIER -136.96 80.23 1.8 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.763 -1.211 . . . . 0.0 111.677 -179.183 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.657 ' HB3' HG12 ' A' ' 18' ' ' ILE . 73.1 m95 -65.76 97.19 0.32 Allowed 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.068 -1.02 . . . . 0.0 109.594 178.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.486 ' HB3' HG12 ' A' ' 21' ' ' VAL . 1.5 tt0 -82.84 105.05 13.54 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.071 -1.018 . . . . 0.0 110.489 -179.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.588 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 48.6 m95 -46.94 106.17 0.08 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.337 -0.852 . . . . 0.0 110.46 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.446 ' HG3' HG23 ' A' ' 19' ' ' THR . 34.7 mtp180 -79.2 -177.59 5.74 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 109.718 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 6.8 mtm -83.69 155.47 23.11 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.058 -1.026 . . . . 0.0 110.237 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.49 ' O ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -160.41 -154.87 0.4 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.457 -0.777 . . . . 0.0 110.202 179.861 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.49 ' O ' ' O ' ' A' ' 11' ' ' LYS . 6.4 mttt . . . . . 0 N--CA 1.495 1.805 0 CA-C-O 121.783 0.801 . . . . 0.0 110.82 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.48 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.7 Cg_endo . . . . . 0 N--CA 1.483 0.867 0 N-CA-C 110.192 -0.734 . . . . 0.0 110.192 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.477 ' CB ' ' HG3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -134.46 98.21 4.02 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.165 -0.96 . . . . 0.0 109.856 179.423 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.657 HG12 ' HB3' ' A' ' 6' ' ' TRP . 1.3 tt -75.93 114.77 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.103 -0.998 . . . . 0.0 110.288 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.592 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 6.7 t -107.48 -159.38 0.69 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.32 -0.863 . . . . 0.0 109.675 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.6 t -107.27 122.79 47.25 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.194 -0.941 . . . . 0.0 110.129 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.529 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -116.45 28.79 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.018 -1.051 . . . . 0.0 110.013 179.981 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.527 ' CG ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.09 143.84 11.01 Favored 'General case' 0 C--N 1.294 -1.828 0 O-C-N 121.808 -0.557 . . . . 0.0 110.099 179.578 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -104.3 55.05 0.72 Allowed 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.154 -0.966 . . . . 0.0 110.19 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.453 ' HB1' ' O ' ' A' ' 3' ' ' CYS . . . . . . . . 0 N--CA 1.492 1.653 0 O-C-N 121.345 -0.847 . . . . 0.0 110.17 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.604 0.716 . . . . 0.0 110.523 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.542 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -151.48 -32.48 0.15 Allowed 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 119.864 -0.734 . . . . 0.0 111.203 -179.782 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.523 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 24.6 ttm-85 -150.72 89.9 1.59 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.898 -1.126 . . . . 0.0 111.592 -179.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.662 ' HB3' HG12 ' A' ' 18' ' ' ILE . 86.1 m95 -67.67 99.86 0.84 Allowed 'General case' 0 C--N 1.307 -1.259 0 O-C-N 121.109 -0.994 . . . . 0.0 109.943 179.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.482 ' HB3' HG12 ' A' ' 21' ' ' VAL . 15.4 tt0 -85.97 109.57 18.86 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.146 -0.971 . . . . 0.0 110.471 -179.6 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.594 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 56.5 m95 -47.46 107.05 0.1 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.305 -0.872 . . . . 0.0 110.371 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 29.0 mtt180 -79.42 178.91 7.76 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.288 -0.882 . . . . 0.0 109.785 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.97 155.22 27.77 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.149 -0.969 . . . . 0.0 109.914 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.502 ' HD3' ' N ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -157.28 175.74 13.62 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.385 -0.822 . . . . 0.0 110.112 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.502 ' N ' ' HD3' ' A' ' 11' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.208 -0.933 . . . . 0.0 110.077 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.586 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 41.7 Cg_endo . . . . . 0 N--CA 1.487 1.132 0 N-CA-C 110.766 -0.513 . . . . 0.0 110.766 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.444 ' OG ' ' HB2' ' A' ' 11' ' ' LYS . 75.5 m -133.92 97.16 3.81 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.301 -0.874 . . . . 0.0 110.002 179.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.662 HG12 ' HB3' ' A' ' 6' ' ' TRP . 2.0 tt -75.78 116.9 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.122 -0.986 . . . . 0.0 110.465 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.531 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 62.9 m -114.69 174.99 5.69 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.331 -0.856 . . . . 0.0 109.658 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.498 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 42.9 t -79.59 122.04 26.01 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.111 -0.993 . . . . 0.0 110.27 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.523 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.1 m -110.33 25.77 3.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.105 -0.997 . . . . 0.0 109.868 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.542 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.45 137.21 6.79 Favored 'General case' 0 C--N 1.293 -1.856 0 O-C-N 121.851 -0.53 . . . . 0.0 110.164 179.829 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 41.8 mtt-85 -106.44 53.13 0.71 Allowed 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.186 -0.946 . . . . 0.0 109.981 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.399 -0.813 . . . . 0.0 110.23 -179.857 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.507 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.629 0.728 . . . . 0.0 110.472 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.586 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -174.76 -64.38 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.919 -0.712 . . . . 0.0 110.902 -179.895 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.586 ' N ' ' CD ' ' A' ' 4' ' ' ARG . 4.3 ttt180 -84.06 53.85 2.74 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.256 -0.903 . . . . 0.0 110.958 -179.075 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.602 ' HB3' HG12 ' A' ' 18' ' ' ILE . 72.7 m95 -46.84 176.39 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.373 -0.829 . . . . 0.0 110.18 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 32.4 tt0 -151.53 95.27 2.11 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.051 -1.031 . . . . 0.0 110.55 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.578 ' NE1' ' CD1' ' A' ' 18' ' ' ILE . 52.8 m95 -45.12 111.63 0.35 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.236 -0.915 . . . . 0.0 110.034 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.493 ' O ' ' HA ' ' A' ' 16' ' ' PRO . 0.5 OUTLIER -79.42 -173.24 3.61 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.058 -1.026 . . . . 0.0 109.873 179.814 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 6.6 mtt -99.89 163.19 12.56 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.198 -0.939 . . . . 0.0 110.027 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.471 ' O ' ' O ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -175.02 -152.52 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.168 -0.957 . . . . 0.0 111.178 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.471 ' O ' ' O ' ' A' ' 11' ' ' LYS . 6.3 mttm . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 122.088 0.947 . . . . 0.0 111.952 -178.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.493 ' HA ' ' O ' ' A' ' 9' ' ' ARG . 42.6 Cg_endo . . . . . 0 N--CA 1.485 1.011 0 CA-C-O 121.461 0.525 . . . . 0.0 110.891 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.3 m -144.19 96.21 2.85 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.483 -0.761 . . . . 0.0 109.644 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.602 HG12 ' HB3' ' A' ' 6' ' ' TRP . 0.7 OUTLIER -60.46 113.35 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.25 -0.906 . . . . 0.0 110.003 -179.315 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.542 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 85.3 m -106.19 173.52 6.28 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.247 -0.908 . . . . 0.0 109.972 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 50.7 t -79.71 124.55 28.68 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.133 -0.979 . . . . 0.0 110.099 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.654 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 0.2 OUTLIER -137.14 33.54 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 CA-C-O 122.834 1.302 . . . . 0.0 109.138 -179.55 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.527 ' HG3' ' CB ' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -161.09 96.15 1.08 Allowed 'General case' 0 C--N 1.296 -1.747 0 O-C-N 121.105 -0.997 . . . . 0.0 110.191 179.342 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.4 mtt-85 -79.82 90.35 5.27 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.286 -0.884 . . . . 0.0 110.269 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.288 -0.883 . . . . 0.0 110.272 -179.998 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.666 0.746 . . . . 0.0 110.536 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.544 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -149.83 -33.15 0.19 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.507 -0.745 . . . . 0.0 111.142 -179.737 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.515 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 1.5 tmm_? -152.87 92.52 1.65 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.795 -1.19 . . . . 0.0 111.673 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.665 ' HB3' HG12 ' A' ' 18' ' ' ILE . 83.6 m95 -67.62 102.1 1.12 Allowed 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.244 -0.91 . . . . 0.0 109.838 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.484 ' HB3' HG12 ' A' ' 21' ' ' VAL . 5.6 tp-100 -88.21 109.54 20.0 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.181 -0.949 . . . . 0.0 110.346 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.605 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 59.1 m95 -47.01 107.64 0.12 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.193 -0.942 . . . . 0.0 110.318 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -79.51 179.19 7.6 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.301 -0.875 . . . . 0.0 109.786 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.5 153.89 23.03 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.264 -0.897 . . . . 0.0 109.754 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.499 ' O ' ' O ' ' A' ' 12' ' ' LYS . 4.4 tptt -163.07 -154.35 0.29 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.341 -0.85 . . . . 0.0 110.614 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.499 ' O ' ' O ' ' A' ' 11' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 121.637 0.732 . . . . 0.0 110.646 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.591 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 42.8 Cg_endo . . . . . 0 N--CA 1.483 0.907 0 CA-C-O 121.36 0.483 . . . . 0.0 110.854 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.443 ' OG ' ' CG ' ' A' ' 11' ' ' LYS . 73.9 m -133.86 96.97 3.77 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.408 -0.808 . . . . 0.0 109.986 179.526 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.665 HG12 ' HB3' ' A' ' 6' ' ' TRP . 2.1 tt -75.65 117.13 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.203 -0.935 . . . . 0.0 110.397 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.543 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 32.1 m -115.57 176.49 5.05 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.434 -0.791 . . . . 0.0 109.669 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.439 ' SG ' ' O ' ' A' ' 22' ' ' ARG . 42.4 t -79.62 123.3 27.5 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.072 -1.018 . . . . 0.0 110.21 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.515 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.2 m -111.06 25.61 3.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.181 -0.949 . . . . 0.0 109.907 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.544 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.2 OUTLIER -162.63 137.27 6.62 Favored 'General case' 0 C--N 1.292 -1.903 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.128 179.691 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.5 mtp180 -107.14 53.33 0.69 Allowed 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.15 -0.969 . . . . 0.0 110.063 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.436 -0.79 . . . . 0.0 110.237 179.996 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.489 0.661 . . . . 0.0 110.507 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.544 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -149.9 -34.61 0.17 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 119.945 -0.702 . . . . 0.0 111.069 -179.852 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.522 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 0.5 OUTLIER -152.63 89.85 1.44 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.945 -1.097 . . . . 0.0 111.347 -179.475 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.673 ' HB3' HG12 ' A' ' 18' ' ' ILE . 85.1 m95 -63.55 112.32 2.74 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.254 -0.904 . . . . 0.0 110.358 179.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.502 ' O ' ' CG ' ' A' ' 7' ' ' GLN . 14.1 pt20 -94.22 117.79 30.63 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.174 -0.954 . . . . 0.0 110.552 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.606 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 56.9 m95 -57.17 105.46 0.23 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.208 -0.933 . . . . 0.0 110.315 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 -79.19 -178.69 6.31 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.222 -0.924 . . . . 0.0 109.817 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 5.2 mtp -81.69 155.08 25.74 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.209 -0.932 . . . . 0.0 109.911 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.465 ' HG3' ' OG ' ' A' ' 17' ' ' SER . 0.8 OUTLIER -157.76 174.21 15.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.311 -0.868 . . . . 0.0 110.063 179.832 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.138 -0.976 . . . . 0.0 110.092 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.586 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 40.9 Cg_endo . . . . . 0 N--CA 1.487 1.124 0 N-CA-C 110.729 -0.527 . . . . 0.0 110.729 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.465 ' OG ' ' HG3' ' A' ' 11' ' ' LYS . 4.8 m -134.26 97.05 3.74 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.378 -0.826 . . . . 0.0 109.985 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.673 HG12 ' HB3' ' A' ' 6' ' ' TRP . 2.8 tt -75.17 117.35 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.18 -0.95 . . . . 0.0 110.347 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.535 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 30.5 m -112.87 176.12 5.15 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.38 -0.825 . . . . 0.0 109.668 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.477 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 43.6 t -79.71 123.91 28.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.118 -0.989 . . . . 0.0 110.206 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.522 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.2 m -110.6 25.38 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.028 -1.045 . . . . 0.0 110.055 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.544 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 7.2 tpt85 -162.43 138.28 7.38 Favored 'General case' 0 C--N 1.293 -1.878 0 O-C-N 121.799 -0.563 . . . . 0.0 110.283 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.2 mtm-85 -109.91 53.28 0.7 Allowed 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.08 -1.013 . . . . 0.0 110.051 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.405 -0.809 . . . . 0.0 110.233 -179.918 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 t . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.609 0.718 . . . . 0.0 110.37 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.54 ' CG ' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -144.54 -32.56 0.41 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.577 -0.702 . . . . 0.0 111.098 -179.669 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.532 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 2.7 ttt180 -146.32 96.77 2.83 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.988 -1.07 . . . . 0.0 110.653 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.567 ' HB3' HG12 ' A' ' 18' ' ' ILE . 70.5 m95 -68.97 169.38 11.82 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.277 -0.889 . . . . 0.0 110.403 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.541 ' CB ' HG12 ' A' ' 21' ' ' VAL . 2.9 tt0 -146.44 93.31 2.28 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.228 -0.92 . . . . 0.0 109.836 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.587 ' NE1' ' CD1' ' A' ' 18' ' ' ILE . 42.7 m95 -39.7 95.42 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.378 -0.826 . . . . 0.0 110.638 -179.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.514 ' O ' ' N ' ' A' ' 17' ' ' SER . 17.0 mtp-105 -78.87 -170.51 2.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.305 -0.872 . . . . 0.0 109.537 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.423 ' O ' ' HD2' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -82.66 152.51 25.81 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.151 -0.968 . . . . 0.0 110.233 -179.648 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.513 ' HA ' ' CE ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -148.64 -151.12 0.38 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.464 -0.772 . . . . 0.0 110.167 179.736 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.48 ' O ' ' O ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.838 0 CA-C-O 121.849 0.833 . . . . 0.0 110.952 -179.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.561 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 50.3 Cg_endo . . . . . 0 C--O 1.216 -0.617 0 N-CA-C 110.162 -0.745 . . . . 0.0 110.162 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.514 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.3 OUTLIER -146.95 93.3 2.25 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.115 -0.99 . . . . 0.0 109.943 179.505 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.587 ' CD1' ' NE1' ' A' ' 8' ' ' TRP . 1.0 OUTLIER -63.9 114.15 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.153 -0.967 . . . . 0.0 109.821 -179.657 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.539 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 22.7 m -120.61 174.37 6.61 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.32 -0.863 . . . . 0.0 109.927 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.9 t -79.27 122.51 26.41 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.093 -1.005 . . . . 0.0 109.856 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.541 HG12 ' CB ' ' A' ' 7' ' ' GLN . 0.7 OUTLIER -111.06 23.28 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.126 -0.984 . . . . 0.0 109.655 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.54 ' CB ' ' CG ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.07 89.68 0.72 Allowed 'General case' 0 C--N 1.292 -1.893 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.008 179.792 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 22.9 mtt180 -79.72 59.84 3.19 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.039 -1.038 . . . . 0.0 110.004 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.583 0 O-C-N 121.39 -0.818 . . . . 0.0 110.271 -179.996 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.52 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.596 0.713 . . . . 0.0 110.537 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.53 ' HB3' ' CG ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -153.07 -33.24 0.12 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.599 -0.688 . . . . 0.0 111.082 -179.704 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.527 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -136.31 79.93 1.79 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.856 -1.153 . . . . 0.0 111.545 -178.969 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.651 ' HB3' HG12 ' A' ' 18' ' ' ILE . 72.9 m95 -67.01 97.16 0.48 Allowed 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.093 -1.004 . . . . 0.0 109.68 179.036 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.475 ' HB3' HG12 ' A' ' 21' ' ' VAL . 6.4 tt0 -84.21 103.69 13.63 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.12 -0.988 . . . . 0.0 110.374 -179.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.595 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 54.7 m95 -42.69 105.76 0.05 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.231 -0.918 . . . . 0.0 110.415 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.463 ' HG3' HG23 ' A' ' 19' ' ' THR . 4.4 mtt180 -79.25 179.41 7.41 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.277 -0.89 . . . . 0.0 109.67 179.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 6.6 mtm -76.99 156.36 31.94 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.172 -0.955 . . . . 0.0 109.945 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.477 ' HG3' ' CB ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -157.59 168.68 26.57 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.344 -0.847 . . . . 0.0 109.993 179.924 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.9 mtmt . . . . . 0 N--CA 1.491 1.601 0 O-C-N 121.198 -0.939 . . . . 0.0 109.964 179.902 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.587 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 41.7 Cg_endo . . . . . 0 N--CA 1.486 1.063 0 N-CA-C 110.661 -0.553 . . . . 0.0 110.661 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.477 ' CB ' ' HG3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -133.05 97.39 3.99 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.239 -0.913 . . . . 0.0 109.953 179.56 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.651 HG12 ' HB3' ' A' ' 6' ' ' TRP . 1.5 tt -76.69 116.31 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.201 -0.937 . . . . 0.0 110.265 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.592 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 9.0 t -108.47 -158.32 0.65 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.343 -0.848 . . . . 0.0 109.759 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.7 t -107.1 124.44 49.68 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.169 -0.957 . . . . 0.0 110.148 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.527 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -117.88 26.74 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.042 -1.037 . . . . 0.0 110.118 -179.999 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.53 ' CG ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.56 94.6 0.88 Allowed 'General case' 0 C--N 1.292 -1.916 0 O-C-N 121.87 -0.519 . . . . 0.0 110.116 179.671 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 38.3 mtp180 -79.7 61.41 3.66 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.99 -1.069 . . . . 0.0 110.021 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.613 0 O-C-N 121.333 -0.854 . . . . 0.0 110.158 179.98 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.528 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.595 0.712 . . . . 0.0 110.588 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.58 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -141.8 -30.26 0.59 Allowed 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.642 -0.661 . . . . 0.0 111.448 -179.65 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.58 ' N ' ' CD ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -120.9 74.04 1.05 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.92 -1.112 . . . . 0.0 111.296 -179.157 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.643 ' HB3' HG12 ' A' ' 18' ' ' ILE . 95.3 m95 -73.54 96.26 2.4 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.1 -1.0 . . . . 0.0 110.088 179.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.502 ' OE1' ' NH2' ' A' ' 5' ' ' ARG . 2.3 tp60 -87.36 109.14 19.33 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.169 -0.957 . . . . 0.0 110.394 -179.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.597 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 54.1 m95 -46.46 103.58 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.179 -0.951 . . . . 0.0 110.383 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.446 ' HD2' ' HB ' ' A' ' 19' ' ' THR . 2.3 mtp-105 -79.19 -179.64 6.84 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.326 -0.859 . . . . 0.0 109.698 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.02 156.74 35.89 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.212 -0.93 . . . . 0.0 109.938 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.502 ' CG ' ' OG ' ' A' ' 17' ' ' SER . 1.2 tmtt? -157.74 165.49 35.24 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.345 -0.847 . . . . 0.0 110.046 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 O-C-N 121.241 -0.912 . . . . 0.0 109.99 179.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.589 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 40.4 Cg_endo . . . . . 0 N--CA 1.488 1.152 0 N-CA-C 110.562 -0.592 . . . . 0.0 110.562 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.502 ' OG ' ' CG ' ' A' ' 11' ' ' LYS . 0.5 OUTLIER -133.5 96.9 3.81 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.274 -0.891 . . . . 0.0 110.117 179.604 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.643 HG12 ' HB3' ' A' ' 6' ' ' TRP . 1.9 tt -75.59 115.1 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.175 -0.953 . . . . 0.0 110.097 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.538 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 8.1 m -115.91 170.4 8.51 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.31 -0.869 . . . . 0.0 109.89 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.521 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 5.4 t -78.85 113.2 16.74 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.122 -0.986 . . . . 0.0 110.005 -179.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.491 HG23 ' CG ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -102.91 21.1 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.162 -0.961 . . . . 0.0 109.836 -179.814 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.504 ' HG2' ' NE ' ' A' ' 4' ' ' ARG . 14.9 tpt85 -162.98 86.44 0.55 Allowed 'General case' 0 C--N 1.289 -2.061 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.989 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 25.0 mtt180 -79.14 65.51 4.33 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.924 -1.11 . . . . 0.0 110.126 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.617 0 O-C-N 121.369 -0.832 . . . . 0.0 110.213 -179.987 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.481 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.519 0.676 . . . . 0.0 110.509 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.596 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -175.08 -61.83 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 119.946 -0.701 . . . . 0.0 110.899 -179.9 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.596 ' N ' ' CD ' ' A' ' 4' ' ' ARG . 0.6 OUTLIER -85.45 53.03 2.62 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.285 -0.885 . . . . 0.0 110.94 -178.98 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.578 ' HB3' HG12 ' A' ' 18' ' ' ILE . 74.9 m95 -46.41 175.39 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.444 -0.785 . . . . 0.0 110.209 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.513 ' O ' ' N ' ' A' ' 9' ' ' ARG . 11.4 tt0 -150.77 93.62 1.98 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.952 -1.093 . . . . 0.0 110.559 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.589 ' NE1' ' CD1' ' A' ' 18' ' ' ILE . 42.7 m95 -43.32 94.4 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.206 -0.934 . . . . 0.0 109.988 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 7' ' ' GLN . 3.7 mtp180 -78.65 -170.27 2.04 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.097 -1.002 . . . . 0.0 109.815 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -82.63 151.98 26.08 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.19 -0.944 . . . . 0.0 110.171 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.49 ' O ' ' O ' ' A' ' 12' ' ' LYS . 4.2 tttm -152.39 -150.33 0.33 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.479 -0.763 . . . . 0.0 110.29 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.49 ' O ' ' O ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.824 0 CA-C-O 121.785 0.803 . . . . 0.0 110.814 -179.507 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.587 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 46.1 Cg_endo . . . . . 0 N--CA 1.48 0.723 0 N-CA-C 110.358 -0.67 . . . . 0.0 110.358 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.465 ' OG ' ' HG3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -144.4 93.04 2.37 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.161 -0.962 . . . . 0.0 110.096 179.603 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.589 ' CD1' ' NE1' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -63.16 111.97 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.168 -0.958 . . . . 0.0 109.67 -179.913 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.532 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 82.9 m -109.14 173.18 6.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.167 -0.958 . . . . 0.0 110.157 -179.429 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.4 t -79.55 124.28 28.36 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.096 -1.003 . . . . 0.0 109.921 -179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.653 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 0.2 OUTLIER -136.98 33.64 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 CA-C-O 122.942 1.353 . . . . 0.0 109.068 -179.642 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.513 ' HD3' ' CZ ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -160.83 96.38 1.12 Allowed 'General case' 0 C--N 1.296 -1.75 0 O-C-N 121.075 -1.015 . . . . 0.0 110.017 179.118 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.53 ' CG ' ' O ' ' A' ' 23' ' ' ARG . 23.1 ptt85 -79.62 94.74 5.73 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.235 -0.916 . . . . 0.0 110.275 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.322 -0.861 . . . . 0.0 110.136 -179.972 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.401 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.622 0.725 . . . . 0.0 110.493 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.517 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -148.83 -34.77 0.2 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 120.001 -0.679 . . . . 0.0 110.769 -179.784 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.523 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 0.5 OUTLIER -143.59 92.24 2.34 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.063 -1.023 . . . . 0.0 111.224 -179.427 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.66 ' HB3' HG12 ' A' ' 18' ' ' ILE . 68.2 m95 -71.16 105.47 3.41 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.237 -0.914 . . . . 0.0 110.079 179.44 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.473 ' HB3' HG12 ' A' ' 21' ' ' VAL . 32.3 tp60 -89.26 108.22 19.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.053 -1.029 . . . . 0.0 110.367 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.597 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 59.4 m95 -46.33 103.68 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.283 -0.886 . . . . 0.0 110.547 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.449 ' N ' ' O ' ' A' ' 17' ' ' SER . 12.1 mtp180 -79.35 -172.1 3.04 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.262 -0.899 . . . . 0.0 109.558 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.453 ' O ' ' HD3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -81.72 151.92 27.28 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.076 -1.015 . . . . 0.0 110.098 -179.755 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.495 ' CE ' ' OG ' ' A' ' 17' ' ' SER . 1.7 tptt -163.27 -154.66 0.29 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.618 -0.676 . . . . 0.0 109.767 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.483 ' O ' ' O ' ' A' ' 11' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.803 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.876 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.593 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 43.3 Cg_endo . . . . . 0 N--CA 1.484 0.933 0 N-CA-C 110.255 -0.709 . . . . 0.0 110.255 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.495 ' OG ' ' CE ' ' A' ' 11' ' ' LYS . 0.3 OUTLIER -134.44 97.13 3.74 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.083 -1.01 . . . . 0.0 110.374 179.552 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.66 HG12 ' HB3' ' A' ' 6' ' ' TRP . 1.7 tt -77.45 117.73 23.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.099 -1.001 . . . . 0.0 110.316 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.587 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 14.2 t -112.96 -158.1 0.64 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.307 -0.87 . . . . 0.0 109.79 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.7 t -101.55 129.13 47.58 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.229 -0.92 . . . . 0.0 109.919 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.523 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 0.9 OUTLIER -122.14 25.48 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.025 -1.047 . . . . 0.0 110.153 -179.697 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.517 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.7 94.86 0.88 Allowed 'General case' 0 C--N 1.292 -1.916 0 O-C-N 121.781 -0.575 . . . . 0.0 110.327 179.671 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 23.0 mtm180 -79.92 52.85 1.56 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.991 -1.068 . . . . 0.0 109.777 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.586 0 O-C-N 121.465 -0.772 . . . . 0.0 110.271 -179.862 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.518 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.646 0.736 . . . . 0.0 110.495 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . 0.527 ' CD ' ' HB2' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -155.66 -32.43 0.09 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.544 -0.723 . . . . 0.0 111.286 -179.671 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.527 ' HB2' ' CD ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -136.19 78.38 1.71 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.778 -1.201 . . . . 0.0 111.625 -179.102 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.656 ' HB3' HG12 ' A' ' 18' ' ' ILE . 73.5 m95 -65.94 96.93 0.33 Allowed 'General case' 0 C--N 1.305 -1.355 0 O-C-N 120.961 -1.087 . . . . 0.0 109.64 178.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.474 ' HB3' HG12 ' A' ' 21' ' ' VAL . 28.1 tt0 -84.17 104.41 14.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.114 -0.991 . . . . 0.0 110.415 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.587 ' NE1' ' CD1' ' A' ' 18' ' ' ILE . 49.9 m95 -44.53 105.47 0.06 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.264 -0.897 . . . . 0.0 110.555 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.513 ' CD ' HG23 ' A' ' 19' ' ' THR . 28.8 mtt180 -79.23 -177.69 5.81 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.23 -0.919 . . . . 0.0 109.386 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.524 ' N ' ' SD ' ' A' ' 10' ' ' MET . 0.0 OUTLIER -107.31 135.29 49.06 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.033 -1.042 . . . . 0.0 110.016 -179.863 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.524 ' CE ' ' O ' ' A' ' 16' ' ' PRO . 0.2 OUTLIER -134.17 -166.92 1.87 Allowed 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.477 -0.764 . . . . 0.0 109.81 179.89 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.319 -0.863 . . . . 0.0 109.894 179.713 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.525 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 44.1 Cg_endo . . . . . 0 N--CA 1.484 0.927 0 N-CA-C 110.458 -0.632 . . . . 0.0 110.458 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -133.88 97.95 4.03 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.264 -0.898 . . . . 0.0 109.847 179.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.656 HG12 ' HB3' ' A' ' 6' ' ' TRP . 1.5 tt -75.4 115.08 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.212 -0.93 . . . . 0.0 110.176 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.591 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 6.9 t -106.86 -159.22 0.69 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.287 -0.883 . . . . 0.0 109.732 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.2 t -107.77 119.22 38.84 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.156 -0.965 . . . . 0.0 110.246 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.527 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.1 m -112.52 28.29 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.162 -0.961 . . . . 0.0 109.806 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.524 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.1 OUTLIER -162.15 126.96 3.32 Favored 'General case' 0 C--N 1.293 -1.891 0 O-C-N 121.918 -0.489 . . . . 0.0 110.019 179.734 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 60.4 mtt85 -105.35 55.06 0.7 Allowed 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.078 -1.013 . . . . 0.0 110.179 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.608 0 O-C-N 121.366 -0.834 . . . . 0.0 110.211 -179.982 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 0.412 ' CE1' ' HA ' ' A' ' 23' ' ' ARG . 19.6 t80 . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.234 0.54 . . . . 0.0 110.171 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.03 100.06 5.1 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.24 -0.912 . . . . 0.0 110.16 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.454 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER -66.36 -158.17 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.25 -0.906 . . . . 0.0 110.545 179.925 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.539 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -153.09 -31.8 0.13 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.529 -0.732 . . . . 0.0 111.475 -179.765 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.53 ' CG ' ' HD3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -146.64 84.41 1.61 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.779 -1.201 . . . . 0.0 111.636 -179.376 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.668 ' HB3' HG12 ' A' ' 18' ' ' ILE . 90.5 m95 -66.06 100.93 0.63 Allowed 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.104 -0.997 . . . . 0.0 109.768 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.493 ' HB3' HG12 ' A' ' 21' ' ' VAL . 28.9 tt0 -87.96 112.45 22.58 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.094 -1.004 . . . . 0.0 110.537 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.585 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 50.7 m95 -51.01 104.86 0.09 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.304 -0.873 . . . . 0.0 110.419 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.1 mtp180 -79.11 -177.15 5.48 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.247 -0.908 . . . . 0.0 109.709 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -82.9 154.85 24.38 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.154 -0.966 . . . . 0.0 110.232 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.523 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 1.4 mtpt -159.1 -154.74 0.43 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.481 -0.762 . . . . 0.0 110.193 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.498 ' O ' ' O ' ' A' ' 11' ' ' LYS . 0.5 OUTLIER -52.59 -164.71 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.784 0.802 . . . . 0.0 110.907 -179.564 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.467 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -72.75 137.02 45.62 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.535 -0.728 . . . . 0.0 111.414 -179.12 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.57 46.74 8.87 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.523 ' O ' ' CB ' ' A' ' 11' ' ' LYS . . . -162.45 98.31 1.13 Allowed Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 121.092 -1.24 . . . . 0.0 110.641 179.69 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.477 ' HB2' ' HB3' ' A' ' 8' ' ' TRP . 49.0 Cg_endo -76.34 177.96 8.13 Favored 'Trans proline' 0 C--N 1.301 -1.924 0 O-C-N 124.124 1.591 . . . . 0.0 110.223 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.514 ' OG ' ' CD ' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -136.89 97.55 3.55 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.131 -0.981 . . . . 0.0 109.936 179.429 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.668 HG12 ' HB3' ' A' ' 6' ' ' TRP . 2.0 tt -73.96 113.94 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.125 -0.985 . . . . 0.0 110.139 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.543 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 21.2 m -111.73 173.72 6.22 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.361 -0.837 . . . . 0.0 109.752 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.569 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 44.3 t -79.57 118.65 21.61 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.095 -1.003 . . . . 0.0 110.211 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.521 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -108.56 26.78 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.103 -0.998 . . . . 0.0 109.754 -179.958 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.539 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.34 132.95 4.84 Favored 'General case' 0 C--N 1.293 -1.868 0 O-C-N 121.904 -0.497 . . . . 0.0 110.099 179.829 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.412 ' HA ' ' CE1' ' A' ' 1' ' ' PHE . 1.5 mtp-105 -106.73 54.09 0.68 Allowed 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.073 -1.017 . . . . 0.0 110.037 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.42 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -75.88 120.03 20.67 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.333 -0.854 . . . . 0.0 110.231 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.42 ' C ' ' O ' ' A' ' 24' ' ' ALA . 7.6 m-85 . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.352 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 72.3 t80 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.241 0.543 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.459 ' HD2' ' O ' ' A' ' 25' ' ' PHE . 0.1 OUTLIER -79.88 159.67 26.33 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.258 -0.901 . . . . 0.0 110.207 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.5 OUTLIER -163.21 -158.03 0.46 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.195 -0.941 . . . . 0.0 110.505 179.949 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.541 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -153.12 -32.03 0.13 Allowed 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.347 -179.686 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.53 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -151.22 89.85 1.55 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.731 -1.231 . . . . 0.0 111.769 -179.257 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.665 ' HB3' HG12 ' A' ' 18' ' ' ILE . 88.6 m95 -67.67 98.45 0.7 Allowed 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.207 -0.933 . . . . 0.0 109.773 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.491 ' HB3' HG12 ' A' ' 21' ' ' VAL . 23.1 tt0 -86.06 107.3 17.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.184 -0.947 . . . . 0.0 110.584 -179.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.591 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 52.9 m95 -45.26 102.79 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.231 -0.918 . . . . 0.0 110.325 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.405 ' HB2' ' O ' ' A' ' 17' ' ' SER . 5.8 mmm180 -78.96 -171.77 2.77 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.167 -0.958 . . . . 0.0 109.619 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.1 mtp -80.17 152.85 28.98 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.071 -1.018 . . . . 0.0 110.362 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.529 ' CG ' ' HB2' ' A' ' 17' ' ' SER . 0.0 OUTLIER -159.81 -156.67 0.51 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.616 -0.678 . . . . 0.0 109.667 179.667 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' A' ' 11' ' ' LYS . 3.6 mttt -54.28 -166.64 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 119.742 -0.783 . . . . 0.0 109.764 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.89 146.1 30.99 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.197 -0.939 . . . . 0.0 111.33 -179.326 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 52.01 19.81 5.79 Favored Glycine 0 N--CA 1.487 2.07 0 N-CA-C 109.174 -1.57 . . . . 0.0 109.174 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.495 ' O ' ' HB3' ' A' ' 11' ' ' LYS . . . -146.31 110.32 4.28 Favored Pre-proline 0 N--CA 1.493 1.689 0 O-C-N 121.15 -1.206 . . . . 0.0 111.207 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.584 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.1 Cg_endo -85.45 -178.56 3.09 Favored 'Trans proline' 0 C--N 1.306 -1.672 0 O-C-N 124.065 1.561 . . . . 0.0 110.119 179.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.529 ' HB2' ' CG ' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -135.48 95.91 3.36 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.094 -1.004 . . . . 0.0 110.135 179.322 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.665 HG12 ' HB3' ' A' ' 6' ' ' TRP . 1.7 tt -74.75 112.39 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 120.981 -1.074 . . . . 0.0 109.769 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.538 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 7.2 m -111.14 172.84 6.64 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.347 -0.846 . . . . 0.0 109.95 -179.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.575 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 43.4 t -79.55 114.07 18.19 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.239 -0.913 . . . . 0.0 109.868 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.53 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.1 m -103.06 27.19 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.054 -1.029 . . . . 0.0 110.121 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.541 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.44 137.27 6.83 Favored 'General case' 0 C--N 1.291 -1.941 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.186 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 73.5 mtt-85 -108.03 53.86 0.68 Allowed 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.045 -1.034 . . . . 0.0 110.034 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.453 ' O ' ' OXT' ' A' ' 25' ' ' PHE . . . -77.39 88.3 3.77 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.349 -0.844 . . . . 0.0 110.233 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.459 ' O ' ' HD2' ' A' ' 2' ' ' LYS . 39.8 p90 . . . . . 0 N--CA 1.49 1.55 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.367 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 0.535 ' CZ ' ' SG ' ' A' ' 20' ' ' CYS . 46.2 p90 . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.231 0.539 . . . . 0.0 110.172 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.52 ' CB ' ' O ' ' A' ' 24' ' ' ALA . 0.2 OUTLIER -86.15 112.85 21.7 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.345 -0.847 . . . . 0.0 110.223 179.974 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.53 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 1.0 OUTLIER -95.93 -157.77 0.6 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.259 -0.901 . . . . 0.0 110.566 -179.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.551 ' HD3' ' CB ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -154.61 -32.09 0.1 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.607 -0.683 . . . . 0.0 110.959 -179.618 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.551 ' CB ' ' HD3' ' A' ' 4' ' ' ARG . 0.1 OUTLIER -135.01 77.83 1.7 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.812 -1.18 . . . . 0.0 111.426 -179.392 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.662 ' HB3' HG12 ' A' ' 18' ' ' ILE . 91.2 m95 -66.66 108.87 2.62 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.014 -1.054 . . . . 0.0 110.082 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.474 ' HB3' HG12 ' A' ' 21' ' ' VAL . 14.9 tt0 -93.95 112.51 24.36 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.076 -1.015 . . . . 0.0 110.398 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.594 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 55.5 m95 -52.0 103.67 0.07 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.27 -0.894 . . . . 0.0 110.342 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 70.9 mtp180 -79.14 -179.18 6.55 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.346 -0.847 . . . . 0.0 109.748 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -77.26 156.05 31.69 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.177 -0.952 . . . . 0.0 109.934 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.494 ' CG ' ' N ' ' A' ' 12' ' ' LYS . 14.9 tttt -157.93 169.74 23.91 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.449 -0.782 . . . . 0.0 110.026 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.494 ' N ' ' CG ' ' A' ' 11' ' ' LYS . 4.3 mtmt -69.43 -165.78 0.08 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.184 -0.947 . . . . 0.0 109.953 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.436 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -52.92 155.04 2.56 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.421 -0.799 . . . . 0.0 110.451 -179.887 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 112.58 -71.0 0.22 Allowed Glycine 0 N--CA 1.489 2.186 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.528 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . . . -176.2 178.93 0.43 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.42 -1.047 . . . . 0.0 110.948 -179.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.59 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 41.0 Cg_endo -71.47 -176.57 2.01 Favored 'Trans proline' 0 C--N 1.307 -1.607 0 O-C-N 124.166 1.613 . . . . 0.0 110.74 179.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.445 ' OG ' ' HB2' ' A' ' 11' ' ' LYS . 13.1 m -133.49 97.34 3.92 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.332 -0.855 . . . . 0.0 110.035 179.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.662 HG12 ' HB3' ' A' ' 6' ' ' TRP . 2.0 tt -75.51 115.49 17.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.121 -0.987 . . . . 0.0 110.223 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.537 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 58.3 m -111.33 175.47 5.41 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.356 -0.84 . . . . 0.0 109.768 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.535 ' SG ' ' CZ ' ' A' ' 1' ' ' PHE . 48.5 t -79.42 129.53 34.55 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.144 -0.972 . . . . 0.0 110.115 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.526 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 0.8 OUTLIER -126.56 25.55 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.13 -0.981 . . . . 0.0 110.1 -179.818 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.467 ' HB3' ' HB3' ' A' ' 4' ' ' ARG . 1.7 tpm_? -162.65 159.08 24.03 Favored 'General case' 0 C--N 1.289 -2.023 0 O-C-N 121.801 -0.562 . . . . 0.0 110.321 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.37 155.37 19.18 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.239 -0.913 . . . . 0.0 109.817 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.52 ' O ' ' CB ' ' A' ' 2' ' ' LYS . . . -175.27 76.43 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.274 -0.891 . . . . 0.0 110.238 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.422 ' O ' ' O ' ' A' ' 24' ' ' ALA . 28.6 p90 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.339 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 27.5 t80 . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.231 0.539 . . . . 0.0 110.244 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.522 ' HB2' ' CE2' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -100.39 115.01 29.0 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.249 -0.907 . . . . 0.0 110.193 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -122.72 -158.13 0.77 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.223 -0.923 . . . . 0.0 110.486 -179.991 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.541 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -146.89 -32.74 0.31 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.543 -0.723 . . . . 0.0 111.255 -179.7 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.525 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 17.6 ttm-85 -150.6 92.07 1.81 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.859 -1.151 . . . . 0.0 111.589 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.665 ' HB3' HG12 ' A' ' 18' ' ' ILE . 82.0 m95 -70.39 106.84 3.54 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.286 -0.884 . . . . 0.0 110.049 179.165 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.474 ' HB3' HG12 ' A' ' 21' ' ' VAL . 23.7 tt0 -92.21 109.28 20.65 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.199 -0.938 . . . . 0.0 110.464 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.59 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 54.2 m95 -48.84 103.68 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.27 -0.894 . . . . 0.0 110.512 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.489 ' HG3' ' CG2' ' A' ' 19' ' ' THR . 1.0 OUTLIER -79.15 -174.72 4.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.19 -0.944 . . . . 0.0 109.603 179.702 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 mtt -82.74 153.63 25.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.084 -1.01 . . . . 0.0 110.275 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.524 ' CD ' ' HB3' ' A' ' 17' ' ' SER . 0.1 OUTLIER -158.0 -155.55 0.51 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.474 -0.766 . . . . 0.0 110.102 179.818 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.493 ' O ' ' O ' ' A' ' 11' ' ' LYS . 6.1 mtmt -53.12 -164.72 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 121.77 0.795 . . . . 0.0 110.73 -179.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.467 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -73.86 139.27 44.93 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.458 -0.776 . . . . 0.0 111.292 -179.177 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.61 45.91 8.75 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 110.27 -1.132 . . . . 0.0 110.27 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.52 ' O ' ' CB ' ' A' ' 11' ' ' LYS . . . -164.01 100.96 0.91 Allowed Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.185 -1.185 . . . . 0.0 110.609 179.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.563 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.6 Cg_endo -77.45 -178.47 4.62 Favored 'Trans proline' 0 C--N 1.303 -1.827 0 O-C-N 124.109 1.584 . . . . 0.0 110.252 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.524 ' HB3' ' CD ' ' A' ' 11' ' ' LYS . 0.2 OUTLIER -138.74 95.59 3.0 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.189 -0.944 . . . . 0.0 110.038 179.621 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.665 HG12 ' HB3' ' A' ' 6' ' ' TRP . 1.7 tt -74.53 117.57 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.161 -0.962 . . . . 0.0 110.111 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.542 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 0.2 OUTLIER -116.82 177.09 4.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.236 -0.915 . . . . 0.0 110.077 -179.936 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 50.9 t -79.97 118.21 21.5 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.315 -0.866 . . . . 0.0 109.558 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.525 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -109.48 24.97 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.02 -1.05 . . . . 0.0 110.147 -179.475 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.541 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.86 113.44 1.45 Allowed 'General case' 0 C--N 1.292 -1.929 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.123 179.638 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.3 mtt85 -95.09 55.07 1.75 Allowed 'General case' 0 C--N 1.302 -1.473 0 O-C-N 120.92 -1.113 . . . . 0.0 110.137 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.32 134.6 53.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.309 -0.869 . . . . 0.0 110.208 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.522 ' CE2' ' HB2' ' A' ' 2' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.305 -1.364 0 CA-C-O 118.065 -0.969 . . . . 0.0 110.273 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 18.7 t80 . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.23 0.538 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.0 mttp -76.42 74.21 3.18 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.207 -0.933 . . . . 0.0 110.208 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.51 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 1.0 OUTLIER -72.5 -161.12 0.08 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.225 -0.922 . . . . 0.0 110.529 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.583 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -143.23 -33.42 0.44 Allowed 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.605 -0.685 . . . . 0.0 111.258 -179.581 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.583 ' N ' ' CD ' ' A' ' 4' ' ' ARG . 1.5 tpm_? -117.3 75.83 1.01 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.977 -1.077 . . . . 0.0 111.001 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.658 ' HB3' HG12 ' A' ' 18' ' ' ILE . 69.3 m95 -74.27 97.87 3.09 Favored 'General case' 0 C--N 1.306 -1.316 0 O-C-N 121.229 -0.919 . . . . 0.0 110.337 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.468 ' HB3' HG12 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -85.95 101.67 13.09 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.17 -0.956 . . . . 0.0 110.251 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.588 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 52.3 m95 -41.75 104.42 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.278 -0.888 . . . . 0.0 110.618 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.458 ' HD2' ' CG2' ' A' ' 19' ' ' THR . 7.6 mtp180 -79.22 -172.41 3.15 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.173 -0.954 . . . . 0.0 109.454 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.9 mmt -85.6 154.77 21.48 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.039 -1.038 . . . . 0.0 110.215 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -158.77 -155.12 0.46 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.497 -0.752 . . . . 0.0 110.179 179.802 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.493 ' O ' ' O ' ' A' ' 11' ' ' LYS . 2.3 mtmp? -53.02 -164.62 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.801 0.81 . . . . 0.0 110.771 -179.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.467 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 0.9 OUTLIER -73.63 139.13 45.26 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.467 -0.77 . . . . 0.0 111.339 -179.237 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.64 45.97 8.81 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 179.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.529 ' O ' ' CB ' ' A' ' 11' ' ' LYS . . . -163.62 101.14 0.95 Allowed Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.158 -1.201 . . . . 0.0 110.593 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.575 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.9 Cg_endo -77.38 -178.52 4.65 Favored 'Trans proline' 0 C--N 1.302 -1.896 0 O-C-N 124.062 1.559 . . . . 0.0 110.225 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.524 ' OG ' ' CD ' ' A' ' 11' ' ' LYS . 0.3 OUTLIER -137.16 95.91 3.19 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.252 -0.905 . . . . 0.0 110.088 179.567 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.658 HG12 ' HB3' ' A' ' 6' ' ' TRP . 1.2 tt -75.77 115.25 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.1 -1.0 . . . . 0.0 110.132 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.588 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 11.9 t -112.6 -153.39 0.52 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.181 -0.95 . . . . 0.0 109.855 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.1 t -112.15 114.28 27.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.023 -1.048 . . . . 0.0 109.98 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.469 HG23 ' HG2' ' A' ' 5' ' ' ARG . 0.8 OUTLIER -107.65 21.91 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.12 -0.987 . . . . 0.0 109.913 -179.733 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.513 ' HD3' ' NE ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.82 89.15 0.64 Allowed 'General case' 0 C--N 1.29 -1.983 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.025 179.854 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 14.4 mtt180 -79.61 76.24 6.25 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.043 -1.035 . . . . 0.0 110.143 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.445 ' O ' ' OXT' ' A' ' 25' ' ' PHE . . . -84.95 123.32 30.38 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.326 -0.859 . . . . 0.0 110.236 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.445 ' OXT' ' O ' ' A' ' 24' ' ' ALA . 6.2 m-85 . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.438 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 42.3 t80 . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.258 0.552 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.459 ' HB3' ' O ' ' A' ' 24' ' ' ALA . 0.0 OUTLIER -80.12 125.65 30.08 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.236 -0.915 . . . . 0.0 110.228 179.959 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.7 OUTLIER -134.66 -158.62 0.89 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.311 -0.868 . . . . 0.0 110.485 -179.976 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.537 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -149.95 -34.65 0.17 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.558 -0.714 . . . . 0.0 111.055 -179.905 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.527 ' CB ' ' HD3' ' A' ' 4' ' ' ARG . 0.4 OUTLIER -152.52 91.38 1.57 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.994 -1.066 . . . . 0.0 111.212 -179.466 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.675 ' HB3' HG12 ' A' ' 18' ' ' ILE . 83.1 m95 -63.73 121.98 15.29 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.27 -0.893 . . . . 0.0 110.166 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.498 ' HB3' HG12 ' A' ' 21' ' ' VAL . 2.6 tt0 -104.38 124.06 48.54 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.174 -0.953 . . . . 0.0 110.221 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.611 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 64.6 m95 -61.72 106.26 0.65 Allowed 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.217 -0.927 . . . . 0.0 110.441 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -79.4 -177.06 5.56 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.352 -0.843 . . . . 0.0 109.815 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.01 153.49 21.24 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.197 -0.939 . . . . 0.0 109.749 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.519 ' CD ' ' OG ' ' A' ' 17' ' ' SER . 0.1 OUTLIER -162.9 -153.92 0.27 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.369 -0.832 . . . . 0.0 110.503 -179.741 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.555 ' O ' ' O ' ' A' ' 13' ' ' LEU . 1.3 mtpp -56.0 -141.58 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 121.6 0.714 . . . . 0.0 110.578 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.555 ' O ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -41.31 174.46 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.708 0 O-C-N 121.784 -0.572 . . . . 0.0 110.982 -179.682 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.489 ' C ' ' O ' ' A' ' 13' ' ' LEU . . . -34.77 -31.34 0.01 OUTLIER Glycine 0 N--CA 1.496 2.663 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.538 ' N ' ' O ' ' A' ' 13' ' ' LEU . . . -51.47 106.62 0.67 Allowed Pre-proline 0 N--CA 1.492 1.668 0 O-C-N 121.233 -1.157 . . . . 0.0 110.183 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.59 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 42.8 Cg_endo -78.43 -176.45 3.26 Favored 'Trans proline' 0 C--N 1.306 -1.659 0 O-C-N 123.93 1.49 . . . . 0.0 110.809 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.519 ' OG ' ' CD ' ' A' ' 11' ' ' LYS . 2.7 m -135.58 96.73 3.51 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.374 -0.829 . . . . 0.0 110.077 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.675 HG12 ' HB3' ' A' ' 6' ' ' TRP . 3.7 tt -74.0 118.28 19.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.163 -0.961 . . . . 0.0 110.301 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.532 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 26.8 m -112.45 177.49 4.62 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.291 -0.881 . . . . 0.0 109.853 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.458 ' SG ' ' O ' ' A' ' 22' ' ' ARG . 42.9 t -79.43 118.3 21.18 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.14 -0.975 . . . . 0.0 109.983 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.525 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 0.9 OUTLIER -106.21 27.39 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.046 -1.034 . . . . 0.0 109.855 -179.77 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.537 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.24 134.36 5.56 Favored 'General case' 0 C--N 1.293 -1.885 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.144 179.826 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.2 mtt85 -108.2 54.27 0.67 Allowed 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.026 -1.046 . . . . 0.0 110.165 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.459 ' O ' ' HB3' ' A' ' 2' ' ' LYS . . . -72.1 98.53 2.13 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.314 -0.866 . . . . 0.0 110.233 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.346 -179.881 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 0.571 ' O ' ' CD2' ' A' ' 1' ' ' PHE . 87.2 t80 . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.246 0.546 . . . . 0.0 110.197 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.441 ' CG ' ' O ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -42.86 102.94 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.26 -0.9 . . . . 0.0 110.178 179.955 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.506 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.5 OUTLIER -56.93 -161.48 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.227 -0.92 . . . . 0.0 110.551 -179.946 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.532 ' CD ' ' HB2' ' A' ' 5' ' ' ARG . 0.6 OUTLIER -152.89 -30.31 0.14 Allowed 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 119.943 -0.703 . . . . 0.0 111.713 -179.545 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.532 ' HB2' ' CD ' ' A' ' 4' ' ' ARG . 9.1 mtt-85 -135.56 77.49 1.67 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.742 -1.224 . . . . 0.0 111.534 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.666 ' HB3' HG12 ' A' ' 18' ' ' ILE . 87.6 m95 -66.17 99.26 0.51 Allowed 'General case' 0 C--N 1.305 -1.326 0 O-C-N 121.068 -1.02 . . . . 0.0 109.975 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.484 ' HB3' HG12 ' A' ' 21' ' ' VAL . 2.4 tt0 -85.84 109.21 18.53 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.158 -0.964 . . . . 0.0 110.589 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.586 ' NE1' ' CD1' ' A' ' 18' ' ' ILE . 49.2 m95 -48.07 102.6 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.255 -0.903 . . . . 0.0 110.585 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.442 ' HD2' ' HB ' ' A' ' 19' ' ' THR . 0.3 OUTLIER -78.98 -176.82 5.25 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.136 -0.978 . . . . 0.0 109.588 179.699 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.425 ' O ' ' OG ' ' A' ' 17' ' ' SER . 2.2 mtm -79.28 154.24 29.3 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.957 -1.089 . . . . 0.0 110.26 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.526 ' CG ' ' HB3' ' A' ' 17' ' ' SER . 0.1 OUTLIER -157.41 -155.77 0.54 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.413 -0.805 . . . . 0.0 110.088 179.8 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.479 ' O ' ' O ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -53.31 -164.62 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.773 0 CA-C-O 121.79 0.805 . . . . 0.0 110.683 -179.681 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.465 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -74.42 140.45 44.7 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.371 -0.831 . . . . 0.0 111.216 -179.291 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.51 45.71 8.55 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.521 ' O ' ' CB ' ' A' ' 11' ' ' LYS . . . -165.02 103.67 0.79 Allowed Pre-proline 0 N--CA 1.492 1.648 0 O-C-N 121.198 -1.178 . . . . 0.0 110.566 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.561 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.6 Cg_endo -78.08 -179.54 5.54 Favored 'Trans proline' 0 C--N 1.303 -1.826 0 O-C-N 124.15 1.605 . . . . 0.0 110.208 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.526 ' HB3' ' CG ' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -136.87 95.92 3.21 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.153 -0.967 . . . . 0.0 110.069 179.554 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.666 HG12 ' HB3' ' A' ' 6' ' ' TRP . 1.7 tt -74.51 114.72 14.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.048 -1.032 . . . . 0.0 110.136 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.537 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 33.0 m -115.34 176.2 5.18 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.358 -0.839 . . . . 0.0 109.707 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.553 ' SG ' ' CE2' ' A' ' 1' ' ' PHE . 47.7 t -79.4 123.96 28.0 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.091 -1.006 . . . . 0.0 110.218 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.522 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.3 m -113.07 22.18 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.183 -0.948 . . . . 0.0 110.11 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.526 ' CG ' ' HG2' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.93 145.07 10.31 Favored 'General case' 0 C--N 1.291 -1.97 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.061 179.531 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 26.3 ptt85 -118.69 59.26 0.82 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.104 -0.998 . . . . 0.0 110.154 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.431 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -65.65 96.84 0.29 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.245 -0.909 . . . . 0.0 110.219 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.431 ' C ' ' O ' ' A' ' 24' ' ' ALA . 2.4 m-85 . . . . . 0 N--CA 1.49 1.542 0 CA-C-O 118.055 -0.974 . . . . 0.0 110.319 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.303 0.573 . . . . 0.0 110.171 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 10.2 mtpp -97.3 88.37 4.41 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.236 -0.915 . . . . 0.0 110.219 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.512 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER -85.53 -158.87 0.41 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.257 -0.902 . . . . 0.0 110.508 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.539 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -150.12 -31.72 0.2 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.6 -0.688 . . . . 0.0 111.318 -179.703 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.52 ' HB2' ' CD ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -144.03 81.37 1.68 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 120.836 -1.165 . . . . 0.0 111.518 -179.394 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.664 ' HB3' HG12 ' A' ' 18' ' ' ILE . 91.3 m95 -66.19 101.54 0.73 Allowed 'General case' 0 C--N 1.306 -1.316 0 O-C-N 121.035 -1.041 . . . . 0.0 109.931 179.116 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.48 ' HB3' HG12 ' A' ' 21' ' ' VAL . 21.4 tt0 -88.95 113.23 24.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.108 -0.995 . . . . 0.0 110.624 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.581 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 52.6 m95 -51.63 106.47 0.14 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.258 -0.901 . . . . 0.0 110.444 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.8 mtp180 -79.21 -178.43 6.18 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.252 -0.905 . . . . 0.0 109.816 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.4 mtm -83.11 154.99 24.07 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.149 -0.969 . . . . 0.0 110.196 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.526 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -160.72 -155.04 0.4 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.488 -0.758 . . . . 0.0 110.227 179.934 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 11' ' ' LYS . 1.2 mtpt -52.58 -164.38 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.804 0.812 . . . . 0.0 110.96 -179.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.463 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 1.1 pp -73.15 135.95 44.74 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.466 -0.771 . . . . 0.0 111.476 -179.074 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.58 46.93 8.93 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 110.502 -1.039 . . . . 0.0 110.502 179.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.526 ' O ' ' CB ' ' A' ' 11' ' ' LYS . . . -161.88 94.14 1.32 Allowed Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 121.086 -1.243 . . . . 0.0 110.657 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.48 ' HB2' ' HB3' ' A' ' 8' ' ' TRP . 48.4 Cg_endo -74.96 177.25 8.83 Favored 'Trans proline' 0 C--N 1.3 -1.987 0 O-C-N 124.194 1.628 . . . . 0.0 110.215 179.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.47 ' CB ' ' HG3' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -136.67 97.83 3.64 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.162 -0.961 . . . . 0.0 109.894 179.345 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.664 HG12 ' HB3' ' A' ' 6' ' ' TRP . 2.1 tt -73.82 114.21 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.081 -1.012 . . . . 0.0 110.063 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.543 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 24.7 m -111.57 173.92 6.12 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.36 -0.837 . . . . 0.0 109.674 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.572 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 51.5 t -79.55 121.39 25.18 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.085 -1.009 . . . . 0.0 110.153 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.517 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -112.83 25.33 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.091 -1.006 . . . . 0.0 109.926 -179.921 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.539 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.63 93.96 0.85 Allowed 'General case' 0 C--N 1.292 -1.913 0 O-C-N 121.912 -0.492 . . . . 0.0 110.187 179.917 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -79.76 59.01 2.96 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.001 -1.062 . . . . 0.0 110.044 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.41 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -80.13 74.11 6.93 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.359 -0.838 . . . . 0.0 110.227 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.41 ' C ' ' O ' ' A' ' 24' ' ' ALA . 22.6 m-85 . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.403 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 0.449 ' CD1' ' C ' ' A' ' 1' ' ' PHE . 15.8 p90 . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 121.238 0.542 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.4 mtpp -117.51 96.37 5.37 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.272 -0.893 . . . . 0.0 110.198 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.502 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER -61.34 -158.0 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.173 -0.954 . . . . 0.0 110.531 179.969 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.528 ' CD ' ' HB2' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -155.9 -32.18 0.09 Allowed 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.901 -0.72 . . . . 0.0 111.193 -179.729 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.529 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -136.67 78.88 1.73 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.923 -1.111 . . . . 0.0 111.623 -179.202 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.648 ' HB3' HG12 ' A' ' 18' ' ' ILE . 73.2 m95 -66.1 97.21 0.36 Allowed 'General case' 0 C--N 1.305 -1.327 0 O-C-N 120.994 -1.066 . . . . 0.0 109.625 178.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.478 ' HB3' HG12 ' A' ' 21' ' ' VAL . 31.0 tp60 -84.74 104.39 14.67 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.055 -1.028 . . . . 0.0 110.367 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.591 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 55.0 m95 -43.14 105.58 0.05 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.275 -0.891 . . . . 0.0 110.399 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.447 ' HG3' HG23 ' A' ' 19' ' ' THR . 5.2 mtp180 -79.31 179.91 7.14 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.283 -0.885 . . . . 0.0 109.721 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.457 ' O ' ' HD3' ' A' ' 11' ' ' LYS . 7.4 mtm -78.32 155.61 30.04 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.161 -0.962 . . . . 0.0 109.854 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.467 ' CE ' ' OG ' ' A' ' 17' ' ' SER . 0.6 OUTLIER -157.19 171.65 20.04 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.294 -0.879 . . . . 0.0 110.08 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.27 -165.96 0.11 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.198 -0.939 . . . . 0.0 110.082 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.432 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -52.97 155.43 2.45 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.435 -0.791 . . . . 0.0 110.477 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 112.53 -71.01 0.22 Allowed Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.53 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . . . -176.1 179.28 0.42 Allowed Pre-proline 0 N--CA 1.493 1.72 0 O-C-N 121.423 -1.045 . . . . 0.0 110.881 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.585 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 41.6 Cg_endo -71.87 -177.11 2.37 Favored 'Trans proline' 0 C--N 1.307 -1.636 0 O-C-N 124.216 1.64 . . . . 0.0 110.629 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.467 ' OG ' ' CE ' ' A' ' 11' ' ' LYS . 0.4 OUTLIER -133.26 97.36 3.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.36 -0.837 . . . . 0.0 110.001 179.477 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.648 HG12 ' HB3' ' A' ' 6' ' ' TRP . 1.5 tt -76.27 115.74 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.221 -0.924 . . . . 0.0 110.286 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.592 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 9.3 t -107.25 -158.24 0.65 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.281 -0.887 . . . . 0.0 109.773 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.4 t -108.11 120.04 41.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.21 -0.931 . . . . 0.0 110.4 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.529 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -113.11 28.36 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.111 -0.993 . . . . 0.0 109.778 179.897 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.517 ' HD2' ' CG ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.2 128.91 3.69 Favored 'General case' 0 C--N 1.292 -1.901 0 O-C-N 121.945 -0.472 . . . . 0.0 110.08 179.81 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 53.8 mtp85 -105.44 55.1 0.69 Allowed 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.031 -1.043 . . . . 0.0 110.175 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.434 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -70.99 112.05 6.84 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.3 -0.875 . . . . 0.0 110.223 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.434 ' C ' ' O ' ' A' ' 24' ' ' ALA . 7.1 m-85 . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 118.074 -0.965 . . . . 0.0 110.413 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 0.546 ' CZ ' ' HA ' ' A' ' 23' ' ' ARG . 15.6 t80 . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.201 0.524 . . . . 0.0 110.237 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.458 ' HB2' ' O ' ' A' ' 24' ' ' ALA . 51.8 mmtt -63.01 179.79 0.35 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.246 -0.909 . . . . 0.0 110.195 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.6 OUTLIER -174.95 -157.81 0.07 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.251 -0.905 . . . . 0.0 110.552 -179.966 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.531 ' CD ' ' HB2' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -160.91 -31.81 0.05 Allowed 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 119.782 -0.767 . . . . 0.0 111.308 -179.682 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.531 ' HB2' ' CD ' ' A' ' 4' ' ' ARG . 0.2 OUTLIER -136.96 80.23 1.8 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.763 -1.211 . . . . 0.0 111.677 -179.183 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.657 ' HB3' HG12 ' A' ' 18' ' ' ILE . 73.1 m95 -65.76 97.19 0.32 Allowed 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.068 -1.02 . . . . 0.0 109.594 178.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.486 ' HB3' HG12 ' A' ' 21' ' ' VAL . 1.5 tt0 -82.84 105.05 13.54 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.071 -1.018 . . . . 0.0 110.489 -179.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.588 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 48.6 m95 -46.94 106.17 0.08 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.337 -0.852 . . . . 0.0 110.46 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.446 ' HG3' HG23 ' A' ' 19' ' ' THR . 34.7 mtp180 -79.2 -177.59 5.74 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 109.718 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 6.8 mtm -83.69 155.47 23.11 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.058 -1.026 . . . . 0.0 110.237 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.523 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -160.41 -154.87 0.4 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.457 -0.777 . . . . 0.0 110.202 179.861 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.49 ' O ' ' O ' ' A' ' 11' ' ' LYS . 6.4 mttt -52.94 -164.47 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 121.783 0.801 . . . . 0.0 110.82 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.452 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -73.12 137.19 45.05 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.452 -0.78 . . . . 0.0 111.504 -179.133 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.54 46.69 8.8 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 179.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.523 ' O ' ' CB ' ' A' ' 11' ' ' LYS . . . -162.59 96.37 1.15 Allowed Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.157 -1.202 . . . . 0.0 110.644 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.48 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.7 Cg_endo -75.99 177.61 8.52 Favored 'Trans proline' 0 C--N 1.301 -1.941 0 O-C-N 124.208 1.636 . . . . 0.0 110.192 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.477 ' CB ' ' HG3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -134.46 98.21 4.02 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.165 -0.96 . . . . 0.0 109.856 179.423 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.657 HG12 ' HB3' ' A' ' 6' ' ' TRP . 1.3 tt -75.93 114.77 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.103 -0.998 . . . . 0.0 110.288 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.592 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 6.7 t -107.48 -159.38 0.69 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.32 -0.863 . . . . 0.0 109.675 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.6 t -107.27 122.79 47.25 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.194 -0.941 . . . . 0.0 110.129 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.529 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -116.45 28.79 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.018 -1.051 . . . . 0.0 110.013 179.981 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.527 ' CG ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.09 143.84 11.01 Favored 'General case' 0 C--N 1.294 -1.828 0 O-C-N 121.808 -0.557 . . . . 0.0 110.099 179.578 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.546 ' HA ' ' CZ ' ' A' ' 1' ' ' PHE . 4.2 mtm180 -104.3 55.05 0.72 Allowed 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.154 -0.966 . . . . 0.0 110.19 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.458 ' O ' ' HB2' ' A' ' 2' ' ' LYS . . . -58.47 126.84 29.29 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.345 -0.847 . . . . 0.0 110.17 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.432 ' C ' ' O ' ' A' ' 24' ' ' ALA . 16.7 p90 . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 118.016 -0.993 . . . . 0.0 110.4 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 0.551 ' CD2' ' O ' ' A' ' 2' ' ' LYS . 66.7 t80 . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 121.264 0.554 . . . . 0.0 110.221 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.551 ' O ' ' CD2' ' A' ' 1' ' ' PHE . 4.6 mttt -44.08 154.6 0.1 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.186 -0.946 . . . . 0.0 110.172 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER -168.97 -158.2 0.2 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.174 -0.954 . . . . 0.0 110.523 -179.952 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.542 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -151.48 -32.48 0.15 Allowed 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 119.864 -0.734 . . . . 0.0 111.203 -179.782 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.523 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 24.6 ttm-85 -150.72 89.9 1.59 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.898 -1.126 . . . . 0.0 111.592 -179.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.662 ' HB3' HG12 ' A' ' 18' ' ' ILE . 86.1 m95 -67.67 99.86 0.84 Allowed 'General case' 0 C--N 1.307 -1.259 0 O-C-N 121.109 -0.994 . . . . 0.0 109.943 179.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.482 ' HB3' HG12 ' A' ' 21' ' ' VAL . 15.4 tt0 -85.97 109.57 18.86 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.146 -0.971 . . . . 0.0 110.471 -179.6 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.594 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 56.5 m95 -47.46 107.05 0.1 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.305 -0.872 . . . . 0.0 110.371 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 29.0 mtt180 -79.42 178.91 7.76 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.288 -0.882 . . . . 0.0 109.785 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.97 155.22 27.77 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.149 -0.969 . . . . 0.0 109.914 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.502 ' HD3' ' N ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -157.28 175.74 13.62 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.385 -0.822 . . . . 0.0 110.112 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.502 ' N ' ' HD3' ' A' ' 11' ' ' LYS . 0.3 OUTLIER -71.7 -166.17 0.19 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.208 -0.933 . . . . 0.0 110.077 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.423 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -53.95 156.75 2.75 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.455 -0.778 . . . . 0.0 110.429 -179.868 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 112.05 -71.01 0.22 Allowed Glycine 0 N--CA 1.487 2.086 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.52 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . . . -176.12 178.36 0.47 Allowed Pre-proline 0 N--CA 1.493 1.677 0 O-C-N 121.351 -1.088 . . . . 0.0 110.842 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.586 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 41.7 Cg_endo -72.05 -177.03 2.38 Favored 'Trans proline' 0 C--N 1.306 -1.674 0 O-C-N 124.309 1.689 . . . . 0.0 110.766 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.444 ' OG ' ' HB2' ' A' ' 11' ' ' LYS . 75.5 m -133.92 97.16 3.81 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.301 -0.874 . . . . 0.0 110.002 179.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.662 HG12 ' HB3' ' A' ' 6' ' ' TRP . 2.0 tt -75.78 116.9 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.122 -0.986 . . . . 0.0 110.465 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.531 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 62.9 m -114.69 174.99 5.69 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.331 -0.856 . . . . 0.0 109.658 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.498 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 42.9 t -79.59 122.04 26.01 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.111 -0.993 . . . . 0.0 110.27 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.523 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.1 m -110.33 25.77 3.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.105 -0.997 . . . . 0.0 109.868 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.542 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.45 137.21 6.79 Favored 'General case' 0 C--N 1.293 -1.856 0 O-C-N 121.851 -0.53 . . . . 0.0 110.164 179.829 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 41.8 mtt-85 -106.44 53.13 0.71 Allowed 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.186 -0.946 . . . . 0.0 109.981 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.466 ' O ' ' O ' ' A' ' 25' ' ' PHE . . . -67.85 90.95 0.31 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.399 -0.813 . . . . 0.0 110.23 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.466 ' O ' ' O ' ' A' ' 24' ' ' ALA . 17.1 m-85 . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 118.024 -0.988 . . . . 0.0 110.279 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 54.9 t80 . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 121.257 0.551 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.431 ' HD3' ' O ' ' A' ' 25' ' ' PHE . 40.1 mttt -69.0 112.22 5.5 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.248 -0.907 . . . . 0.0 110.227 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.507 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.5 OUTLIER -127.78 -159.75 0.96 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.265 -0.897 . . . . 0.0 110.472 -179.977 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.586 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -174.76 -64.38 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.919 -0.712 . . . . 0.0 110.902 -179.895 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.586 ' N ' ' CD ' ' A' ' 4' ' ' ARG . 4.3 ttt180 -84.06 53.85 2.74 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.256 -0.903 . . . . 0.0 110.958 -179.075 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.602 ' HB3' HG12 ' A' ' 18' ' ' ILE . 72.7 m95 -46.84 176.39 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.373 -0.829 . . . . 0.0 110.18 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 32.4 tt0 -151.53 95.27 2.11 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.051 -1.031 . . . . 0.0 110.55 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.578 ' NE1' ' CD1' ' A' ' 18' ' ' ILE . 52.8 m95 -45.12 111.63 0.35 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.236 -0.915 . . . . 0.0 110.034 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.493 ' O ' ' HA ' ' A' ' 16' ' ' PRO . 0.5 OUTLIER -79.42 -173.24 3.61 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.058 -1.026 . . . . 0.0 109.873 179.814 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 6.6 mtt -99.89 163.19 12.56 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.198 -0.939 . . . . 0.0 110.027 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.547 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -175.02 -152.52 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.168 -0.957 . . . . 0.0 111.178 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.499 ' O ' ' N ' ' A' ' 14' ' ' GLY . 6.3 mttm -52.36 -161.06 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 122.088 0.947 . . . . 0.0 111.952 -178.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -38.53 90.06 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 121.327 0.584 . . . . 0.0 112.071 -178.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' LYS . . . 43.64 34.52 2.7 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 110.594 -1.002 . . . . 0.0 110.594 178.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.547 ' O ' ' CB ' ' A' ' 11' ' ' LYS . . . -106.17 83.61 1.16 Allowed Pre-proline 0 N--CA 1.492 1.647 0 O-C-N 121.016 -1.285 . . . . 0.0 109.723 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.493 ' HA ' ' O ' ' A' ' 9' ' ' ARG . 42.6 Cg_endo -66.95 176.75 4.15 Favored 'Trans proline' 0 C--N 1.298 -2.084 0 O-C-N 124.304 1.687 . . . . 0.0 110.891 -179.447 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.3 m -144.19 96.21 2.85 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.483 -0.761 . . . . 0.0 109.644 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.602 HG12 ' HB3' ' A' ' 6' ' ' TRP . 0.7 OUTLIER -60.46 113.35 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.25 -0.906 . . . . 0.0 110.003 -179.315 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.542 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 85.3 m -106.19 173.52 6.28 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.247 -0.908 . . . . 0.0 109.972 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 50.7 t -79.71 124.55 28.68 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.133 -0.979 . . . . 0.0 110.099 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.654 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 0.2 OUTLIER -137.14 33.54 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 CA-C-O 122.834 1.302 . . . . 0.0 109.138 -179.55 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.527 ' HG3' ' CB ' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -161.09 96.15 1.08 Allowed 'General case' 0 C--N 1.296 -1.747 0 O-C-N 121.105 -0.997 . . . . 0.0 110.191 179.342 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.4 mtt-85 -79.82 90.35 5.27 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.286 -0.884 . . . . 0.0 110.269 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.413 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -101.43 104.78 15.74 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.288 -0.883 . . . . 0.0 110.272 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.431 ' O ' ' HD3' ' A' ' 2' ' ' LYS . 24.7 m-85 . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.409 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 0.466 ' CG ' ' O ' ' A' ' 1' ' ' PHE . 12.4 t80 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.226 0.536 . . . . 0.0 110.22 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.461 ' HB2' ' O ' ' A' ' 24' ' ' ALA . 11.2 mmtp -76.42 99.98 5.05 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.298 -0.877 . . . . 0.0 110.219 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER -56.69 -158.26 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.349 -0.844 . . . . 0.0 110.536 -179.995 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.544 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -149.83 -33.15 0.19 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.507 -0.745 . . . . 0.0 111.142 -179.737 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.515 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 1.5 tmm_? -152.87 92.52 1.65 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.795 -1.19 . . . . 0.0 111.673 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.665 ' HB3' HG12 ' A' ' 18' ' ' ILE . 83.6 m95 -67.62 102.1 1.12 Allowed 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.244 -0.91 . . . . 0.0 109.838 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.484 ' HB3' HG12 ' A' ' 21' ' ' VAL . 5.6 tp-100 -88.21 109.54 20.0 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.181 -0.949 . . . . 0.0 110.346 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.605 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 59.1 m95 -47.01 107.64 0.12 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.193 -0.942 . . . . 0.0 110.318 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -79.51 179.19 7.6 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.301 -0.875 . . . . 0.0 109.786 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.5 153.89 23.03 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.264 -0.897 . . . . 0.0 109.754 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.499 ' O ' ' O ' ' A' ' 12' ' ' LYS . 4.4 tptt -163.07 -154.35 0.29 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.341 -0.85 . . . . 0.0 110.614 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.556 ' O ' ' O ' ' A' ' 13' ' ' LEU . 0.4 OUTLIER -55.82 -141.78 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 121.637 0.732 . . . . 0.0 110.646 179.816 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.556 ' O ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -41.33 174.9 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.706 0 CA-C-O 121.279 0.562 . . . . 0.0 111.05 -179.616 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.486 ' C ' ' O ' ' A' ' 13' ' ' LEU . . . -34.81 -31.38 0.01 OUTLIER Glycine 0 N--CA 1.495 2.623 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.542 ' N ' ' O ' ' A' ' 13' ' ' LEU . . . -52.3 106.96 0.72 Allowed Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.242 -1.152 . . . . 0.0 110.217 179.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.591 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 42.8 Cg_endo -77.29 -176.97 3.49 Favored 'Trans proline' 0 C--N 1.307 -1.651 0 O-C-N 124.036 1.545 . . . . 0.0 110.854 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.443 ' OG ' ' CG ' ' A' ' 11' ' ' LYS . 73.9 m -133.86 96.97 3.77 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.408 -0.808 . . . . 0.0 109.986 179.526 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.665 HG12 ' HB3' ' A' ' 6' ' ' TRP . 2.1 tt -75.65 117.13 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.203 -0.935 . . . . 0.0 110.397 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.543 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 32.1 m -115.57 176.49 5.05 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.434 -0.791 . . . . 0.0 109.669 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.439 ' SG ' ' O ' ' A' ' 22' ' ' ARG . 42.4 t -79.62 123.3 27.5 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.072 -1.018 . . . . 0.0 110.21 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.515 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.2 m -111.06 25.61 3.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.181 -0.949 . . . . 0.0 109.907 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.544 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.2 OUTLIER -162.63 137.27 6.62 Favored 'General case' 0 C--N 1.292 -1.903 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.128 179.691 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.5 mtp180 -107.14 53.33 0.69 Allowed 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.15 -0.969 . . . . 0.0 110.063 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.461 ' O ' ' HB2' ' A' ' 2' ' ' LYS . . . -83.35 89.93 7.09 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.436 -0.79 . . . . 0.0 110.237 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.432 ' C ' ' O ' ' A' ' 24' ' ' ALA . 9.0 m-85 . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 117.936 -1.03 . . . . 0.0 110.389 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.276 0.56 . . . . 0.0 110.183 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.466 ' HB3' ' O ' ' A' ' 24' ' ' ALA . 16.0 mmtm -45.43 133.4 7.46 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.223 -0.923 . . . . 0.0 110.142 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.7 OUTLIER -129.57 -158.44 0.89 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.246 -0.909 . . . . 0.0 110.507 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.544 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -149.9 -34.61 0.17 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 119.945 -0.702 . . . . 0.0 111.069 -179.852 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.522 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 0.5 OUTLIER -152.63 89.85 1.44 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.945 -1.097 . . . . 0.0 111.347 -179.475 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.673 ' HB3' HG12 ' A' ' 18' ' ' ILE . 85.1 m95 -63.55 112.32 2.74 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.254 -0.904 . . . . 0.0 110.358 179.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.502 ' O ' ' CG ' ' A' ' 7' ' ' GLN . 14.1 pt20 -94.22 117.79 30.63 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.174 -0.954 . . . . 0.0 110.552 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.606 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 56.9 m95 -57.17 105.46 0.23 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.208 -0.933 . . . . 0.0 110.315 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 -79.19 -178.69 6.31 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.222 -0.924 . . . . 0.0 109.817 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 5.2 mtp -81.69 155.08 25.74 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.209 -0.932 . . . . 0.0 109.911 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.469 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -157.76 174.21 15.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.311 -0.868 . . . . 0.0 110.063 179.832 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.57 -165.89 0.12 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.138 -0.976 . . . . 0.0 110.092 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.42 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -53.56 156.5 2.54 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.519 -0.738 . . . . 0.0 110.613 -179.882 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 112.28 -71.47 0.22 Allowed Glycine 0 N--CA 1.488 2.125 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.523 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . . . -176.26 178.66 0.44 Allowed Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.333 -1.098 . . . . 0.0 110.881 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.586 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 40.9 Cg_endo -72.2 -176.62 2.24 Favored 'Trans proline' 0 C--N 1.306 -1.662 0 O-C-N 124.226 1.645 . . . . 0.0 110.729 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.465 ' OG ' ' HG3' ' A' ' 11' ' ' LYS . 4.8 m -134.26 97.05 3.74 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.378 -0.826 . . . . 0.0 109.985 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.673 HG12 ' HB3' ' A' ' 6' ' ' TRP . 2.8 tt -75.17 117.35 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.18 -0.95 . . . . 0.0 110.347 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.535 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 30.5 m -112.87 176.12 5.15 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.38 -0.825 . . . . 0.0 109.668 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.477 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 43.6 t -79.71 123.91 28.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.118 -0.989 . . . . 0.0 110.206 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.522 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.2 m -110.6 25.38 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.028 -1.045 . . . . 0.0 110.055 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.544 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 7.2 tpt85 -162.43 138.28 7.38 Favored 'General case' 0 C--N 1.293 -1.878 0 O-C-N 121.799 -0.563 . . . . 0.0 110.283 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.2 mtm-85 -109.91 53.28 0.7 Allowed 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.08 -1.013 . . . . 0.0 110.051 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.466 ' O ' ' HB3' ' A' ' 2' ' ' LYS . . . -81.02 76.33 7.98 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.405 -0.809 . . . . 0.0 110.233 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.442 ' HA ' ' HB2' ' A' ' 2' ' ' LYS . 38.2 p90 . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.319 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.221 0.534 . . . . 0.0 110.167 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' A' ' 3' ' ' CYS . 0.9 OUTLIER -98.27 62.13 1.48 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.273 -0.892 . . . . 0.0 110.246 179.967 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.462 ' O ' ' O ' ' A' ' 2' ' ' LYS . 1.2 t -55.6 -162.85 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.181 -0.949 . . . . 0.0 110.37 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.54 ' CG ' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -144.54 -32.56 0.41 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.577 -0.702 . . . . 0.0 111.098 -179.669 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.532 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 2.7 ttt180 -146.32 96.77 2.83 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.988 -1.07 . . . . 0.0 110.653 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.567 ' HB3' HG12 ' A' ' 18' ' ' ILE . 70.5 m95 -68.97 169.38 11.82 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.277 -0.889 . . . . 0.0 110.403 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.541 ' CB ' HG12 ' A' ' 21' ' ' VAL . 2.9 tt0 -146.44 93.31 2.28 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.228 -0.92 . . . . 0.0 109.836 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.587 ' NE1' ' CD1' ' A' ' 18' ' ' ILE . 42.7 m95 -39.7 95.42 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.378 -0.826 . . . . 0.0 110.638 -179.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.514 ' O ' ' N ' ' A' ' 17' ' ' SER . 17.0 mtp-105 -78.87 -170.51 2.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.305 -0.872 . . . . 0.0 109.537 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.423 ' O ' ' HD2' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -82.66 152.51 25.81 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.151 -0.968 . . . . 0.0 110.233 -179.648 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.543 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -148.64 -151.12 0.38 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.464 -0.772 . . . . 0.0 110.167 179.736 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.48 ' O ' ' O ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -52.82 -164.6 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 121.849 0.833 . . . . 0.0 110.952 -179.508 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.465 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -60.23 128.75 38.28 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.555 -0.715 . . . . 0.0 111.241 -179.294 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.42 50.72 8.01 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.977 -1.249 . . . . 0.0 109.977 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.543 ' O ' ' CB ' ' A' ' 11' ' ' LYS . . . -153.0 122.63 3.31 Favored Pre-proline 0 C--N 1.299 -1.591 0 O-C-N 121.236 -1.156 . . . . 0.0 110.388 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.561 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 50.3 Cg_endo -87.49 -174.32 1.24 Allowed 'Trans proline' 0 C--N 1.306 -1.679 0 O-C-N 123.896 1.472 . . . . 0.0 110.162 179.518 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.514 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.3 OUTLIER -146.95 93.3 2.25 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.115 -0.99 . . . . 0.0 109.943 179.505 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.587 ' CD1' ' NE1' ' A' ' 8' ' ' TRP . 1.0 OUTLIER -63.9 114.15 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.153 -0.967 . . . . 0.0 109.821 -179.657 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.539 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 22.7 m -120.61 174.37 6.61 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.32 -0.863 . . . . 0.0 109.927 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.9 t -79.27 122.51 26.41 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.093 -1.005 . . . . 0.0 109.856 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.541 HG12 ' CB ' ' A' ' 7' ' ' GLN . 0.7 OUTLIER -111.06 23.28 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.126 -0.984 . . . . 0.0 109.655 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.54 ' CB ' ' CG ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.07 89.68 0.72 Allowed 'General case' 0 C--N 1.292 -1.893 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.008 179.792 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 22.9 mtt180 -79.72 59.84 3.19 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.039 -1.038 . . . . 0.0 110.004 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.428 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -67.51 92.12 0.3 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.39 -0.818 . . . . 0.0 110.271 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.428 ' C ' ' O ' ' A' ' 24' ' ' ALA . 5.9 m-85 . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.398 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 23.0 p90 . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.236 0.541 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -109.51 113.33 26.04 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.258 -0.901 . . . . 0.0 110.194 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.52 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER -85.96 -158.35 0.39 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.23 -0.919 . . . . 0.0 110.537 179.954 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.53 ' HB3' ' CG ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -153.07 -33.24 0.12 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.599 -0.688 . . . . 0.0 111.082 -179.704 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.527 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 0.0 OUTLIER -136.31 79.93 1.79 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.856 -1.153 . . . . 0.0 111.545 -178.969 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.651 ' HB3' HG12 ' A' ' 18' ' ' ILE . 72.9 m95 -67.01 97.16 0.48 Allowed 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.093 -1.004 . . . . 0.0 109.68 179.036 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.475 ' HB3' HG12 ' A' ' 21' ' ' VAL . 6.4 tt0 -84.21 103.69 13.63 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.12 -0.988 . . . . 0.0 110.374 -179.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.595 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 54.7 m95 -42.69 105.76 0.05 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.231 -0.918 . . . . 0.0 110.415 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.463 ' HG3' HG23 ' A' ' 19' ' ' THR . 4.4 mtt180 -79.25 179.41 7.41 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.277 -0.89 . . . . 0.0 109.67 179.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 6.6 mtm -76.99 156.36 31.94 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.172 -0.955 . . . . 0.0 109.945 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.477 ' HG3' ' CB ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -157.59 168.68 26.57 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.344 -0.847 . . . . 0.0 109.993 179.924 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.9 mtmt -69.15 -165.72 0.08 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.198 -0.939 . . . . 0.0 109.964 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.444 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -52.52 154.97 2.32 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.431 -0.793 . . . . 0.0 110.436 -179.878 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 112.62 -71.13 0.22 Allowed Glycine 0 N--CA 1.487 2.071 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.532 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . . . -176.11 179.28 0.42 Allowed Pre-proline 0 N--CA 1.493 1.691 0 O-C-N 121.362 -1.081 . . . . 0.0 110.951 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.587 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 41.7 Cg_endo -72.0 -177.23 2.48 Favored 'Trans proline' 0 C--N 1.308 -1.583 0 O-C-N 124.147 1.604 . . . . 0.0 110.661 179.524 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.477 ' CB ' ' HG3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -133.05 97.39 3.99 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.239 -0.913 . . . . 0.0 109.953 179.56 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.651 HG12 ' HB3' ' A' ' 6' ' ' TRP . 1.5 tt -76.69 116.31 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.201 -0.937 . . . . 0.0 110.265 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.592 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 9.0 t -108.47 -158.32 0.65 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.343 -0.848 . . . . 0.0 109.759 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.7 t -107.1 124.44 49.68 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.169 -0.957 . . . . 0.0 110.148 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.527 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -117.88 26.74 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.042 -1.037 . . . . 0.0 110.118 -179.999 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.53 ' CG ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.56 94.6 0.88 Allowed 'General case' 0 C--N 1.292 -1.916 0 O-C-N 121.87 -0.519 . . . . 0.0 110.116 179.671 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 38.3 mtp180 -79.7 61.41 3.66 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.99 -1.069 . . . . 0.0 110.021 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -77.37 100.76 6.06 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.333 -0.854 . . . . 0.0 110.158 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.569 ' OXT' ' CD1' ' A' ' 25' ' ' PHE . 15.8 p90 . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 118.061 -0.971 . . . . 0.0 110.372 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 0.448 ' O ' ' HG3' ' A' ' 2' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.242 0.544 . . . . 0.0 110.206 . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' A' ' 1' ' ' PHE . 47.9 mtmt -153.78 82.57 1.16 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.276 -0.89 . . . . 0.0 110.237 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.528 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER -77.04 -161.48 0.21 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.209 -0.932 . . . . 0.0 110.588 179.986 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.58 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -141.8 -30.26 0.59 Allowed 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.642 -0.661 . . . . 0.0 111.448 -179.65 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.58 ' N ' ' CD ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -120.9 74.04 1.05 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.92 -1.112 . . . . 0.0 111.296 -179.157 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.643 ' HB3' HG12 ' A' ' 18' ' ' ILE . 95.3 m95 -73.54 96.26 2.4 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.1 -1.0 . . . . 0.0 110.088 179.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.502 ' OE1' ' NH2' ' A' ' 5' ' ' ARG . 2.3 tp60 -87.36 109.14 19.33 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.169 -0.957 . . . . 0.0 110.394 -179.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.597 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 54.1 m95 -46.46 103.58 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.179 -0.951 . . . . 0.0 110.383 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.446 ' HD2' ' HB ' ' A' ' 19' ' ' THR . 2.3 mtp-105 -79.19 -179.64 6.84 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.326 -0.859 . . . . 0.0 109.698 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.02 156.74 35.89 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.212 -0.93 . . . . 0.0 109.938 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.502 ' CG ' ' OG ' ' A' ' 17' ' ' SER . 1.2 tmtt? -157.74 165.49 35.24 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.345 -0.847 . . . . 0.0 110.046 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.47 -165.58 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.241 -0.912 . . . . 0.0 109.99 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.468 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -52.34 154.43 2.45 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.462 -0.773 . . . . 0.0 110.355 -179.867 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 112.67 -70.94 0.22 Allowed Glycine 0 N--CA 1.488 2.12 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.543 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . . . -176.19 179.62 0.4 Allowed Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.393 -1.063 . . . . 0.0 110.939 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.589 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 40.4 Cg_endo -71.24 -176.63 1.97 Allowed 'Trans proline' 0 C--N 1.307 -1.612 0 O-C-N 124.198 1.63 . . . . 0.0 110.562 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.502 ' OG ' ' CG ' ' A' ' 11' ' ' LYS . 0.5 OUTLIER -133.5 96.9 3.81 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.274 -0.891 . . . . 0.0 110.117 179.604 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.643 HG12 ' HB3' ' A' ' 6' ' ' TRP . 1.9 tt -75.59 115.1 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.175 -0.953 . . . . 0.0 110.097 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.538 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 8.1 m -115.91 170.4 8.51 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.31 -0.869 . . . . 0.0 109.89 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.521 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 5.4 t -78.85 113.2 16.74 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.122 -0.986 . . . . 0.0 110.005 -179.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.491 HG23 ' CG ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -102.91 21.1 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.162 -0.961 . . . . 0.0 109.836 -179.814 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.504 ' HG2' ' NE ' ' A' ' 4' ' ' ARG . 14.9 tpt85 -162.98 86.44 0.55 Allowed 'General case' 0 C--N 1.289 -2.061 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.989 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 25.0 mtt180 -79.14 65.51 4.33 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.924 -1.11 . . . . 0.0 110.126 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.428 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -54.84 111.05 0.74 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.369 -0.832 . . . . 0.0 110.213 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.428 ' C ' ' O ' ' A' ' 24' ' ' ALA . 7.0 m-85 . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 118.003 -0.999 . . . . 0.0 110.326 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 0.551 ' CE1' ' HA ' ' A' ' 23' ' ' ARG . 7.1 p90 . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.206 0.527 . . . . 0.0 110.19 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.404 ' C ' ' O ' ' A' ' 1' ' ' PHE . 0.0 OUTLIER -44.38 109.05 0.13 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.338 -0.851 . . . . 0.0 110.234 -179.983 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.481 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.5 OUTLIER -106.58 -160.17 0.73 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.262 -0.899 . . . . 0.0 110.509 179.888 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.596 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -175.08 -61.83 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 119.946 -0.701 . . . . 0.0 110.899 -179.9 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.596 ' N ' ' CD ' ' A' ' 4' ' ' ARG . 0.6 OUTLIER -85.45 53.03 2.62 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.285 -0.885 . . . . 0.0 110.94 -178.98 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.578 ' HB3' HG12 ' A' ' 18' ' ' ILE . 74.9 m95 -46.41 175.39 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.444 -0.785 . . . . 0.0 110.209 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.513 ' O ' ' N ' ' A' ' 9' ' ' ARG . 11.4 tt0 -150.77 93.62 1.98 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.952 -1.093 . . . . 0.0 110.559 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.589 ' NE1' ' CD1' ' A' ' 18' ' ' ILE . 42.7 m95 -43.32 94.4 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.206 -0.934 . . . . 0.0 109.988 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 7' ' ' GLN . 3.7 mtp180 -78.65 -170.27 2.04 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.097 -1.002 . . . . 0.0 109.815 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -82.63 151.98 26.08 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.19 -0.944 . . . . 0.0 110.171 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.55 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 4.2 tttm -152.39 -150.33 0.33 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.479 -0.763 . . . . 0.0 110.29 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.49 ' O ' ' O ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -52.72 -165.28 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 121.785 0.803 . . . . 0.0 110.814 -179.507 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.464 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -66.59 133.14 49.69 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.482 -0.761 . . . . 0.0 111.177 -179.353 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.54 48.42 8.76 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.891 -1.283 . . . . 0.0 109.891 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.55 ' O ' ' CB ' ' A' ' 11' ' ' LYS . . . -156.97 115.16 1.99 Allowed Pre-proline 0 N--CA 1.49 1.549 0 O-C-N 121.366 -1.079 . . . . 0.0 110.406 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.587 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 46.1 Cg_endo -83.94 -174.61 1.94 Allowed 'Trans proline' 0 C--N 1.307 -1.634 0 O-C-N 123.996 1.524 . . . . 0.0 110.358 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.465 ' OG ' ' HG3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -144.4 93.04 2.37 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.161 -0.962 . . . . 0.0 110.096 179.603 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.589 ' CD1' ' NE1' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -63.16 111.97 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.168 -0.958 . . . . 0.0 109.67 -179.913 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.532 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 82.9 m -109.14 173.18 6.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.167 -0.958 . . . . 0.0 110.157 -179.429 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.534 ' SG ' ' CE1' ' A' ' 1' ' ' PHE . 52.4 t -79.55 124.28 28.36 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.096 -1.003 . . . . 0.0 109.921 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.653 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 0.2 OUTLIER -136.98 33.64 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 CA-C-O 122.942 1.353 . . . . 0.0 109.068 -179.642 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.513 ' HD3' ' CZ ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -160.83 96.38 1.12 Allowed 'General case' 0 C--N 1.296 -1.75 0 O-C-N 121.075 -1.015 . . . . 0.0 110.017 179.118 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.551 ' HA ' ' CE1' ' A' ' 1' ' ' PHE . 23.1 ptt85 -79.62 94.74 5.73 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.235 -0.916 . . . . 0.0 110.275 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -101.03 104.24 15.38 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.322 -0.861 . . . . 0.0 110.136 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.436 ' C ' ' O ' ' A' ' 24' ' ' ALA . 11.2 m-85 . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 117.978 -1.011 . . . . 0.0 110.382 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.241 0.544 . . . . 0.0 110.293 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.435 ' HD2' ' O ' ' A' ' 24' ' ' ALA . 11.2 ptpt -113.44 71.38 0.74 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.215 -0.928 . . . . 0.0 110.246 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.401 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -60.77 -158.45 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.361 -0.837 . . . . 0.0 110.493 -179.982 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.517 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -148.83 -34.77 0.2 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 120.001 -0.679 . . . . 0.0 110.769 -179.784 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.523 ' O ' ' CG2' ' A' ' 21' ' ' VAL . 0.5 OUTLIER -143.59 92.24 2.34 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.063 -1.023 . . . . 0.0 111.224 -179.427 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.66 ' HB3' HG12 ' A' ' 18' ' ' ILE . 68.2 m95 -71.16 105.47 3.41 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.237 -0.914 . . . . 0.0 110.079 179.44 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.473 ' HB3' HG12 ' A' ' 21' ' ' VAL . 32.3 tp60 -89.26 108.22 19.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.053 -1.029 . . . . 0.0 110.367 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.597 ' CD2' ' HB ' ' A' ' 18' ' ' ILE . 59.4 m95 -46.33 103.68 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.283 -0.886 . . . . 0.0 110.547 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.449 ' N ' ' O ' ' A' ' 17' ' ' SER . 12.1 mtp180 -79.35 -172.1 3.04 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.262 -0.899 . . . . 0.0 109.558 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.453 ' O ' ' HD3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -81.72 151.92 27.28 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.076 -1.015 . . . . 0.0 110.098 -179.755 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.495 ' CE ' ' OG ' ' A' ' 17' ' ' SER . 1.7 tptt -163.27 -154.66 0.29 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.618 -0.676 . . . . 0.0 109.767 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.483 ' O ' ' O ' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -53.59 -167.72 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.876 179.983 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.12 153.35 21.59 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.273 -0.892 . . . . 0.0 111.427 -179.314 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 49.41 21.61 3.13 Favored Glycine 0 N--CA 1.485 1.941 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.488 ' O ' ' HB3' ' A' ' 11' ' ' LYS . . . -157.11 103.25 1.9 Allowed Pre-proline 0 N--CA 1.492 1.65 0 O-C-N 121.064 -1.257 . . . . 0.0 111.169 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.593 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 43.3 Cg_endo -77.11 -177.09 3.57 Favored 'Trans proline' 0 C--N 1.304 -1.783 0 O-C-N 124.191 1.627 . . . . 0.0 110.255 179.007 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.495 ' OG ' ' CE ' ' A' ' 11' ' ' LYS . 0.3 OUTLIER -134.44 97.13 3.74 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.083 -1.01 . . . . 0.0 110.374 179.552 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.66 HG12 ' HB3' ' A' ' 6' ' ' TRP . 1.7 tt -77.45 117.73 23.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.099 -1.001 . . . . 0.0 110.316 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.587 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 14.2 t -112.96 -158.1 0.64 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.307 -0.87 . . . . 0.0 109.79 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.7 t -101.55 129.13 47.58 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.229 -0.92 . . . . 0.0 109.919 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.523 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 0.9 OUTLIER -122.14 25.48 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.025 -1.047 . . . . 0.0 110.153 -179.697 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.517 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.7 94.86 0.88 Allowed 'General case' 0 C--N 1.292 -1.916 0 O-C-N 121.781 -0.575 . . . . 0.0 110.327 179.671 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 23.0 mtm180 -79.92 52.85 1.56 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.991 -1.068 . . . . 0.0 109.777 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.435 ' O ' ' HD2' ' A' ' 2' ' ' LYS . . . -58.63 116.98 4.05 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.465 -0.772 . . . . 0.0 110.271 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.426 ' C ' ' HD2' ' A' ' 2' ' ' LYS . 41.9 m-85 . . . . . 0 N--CA 1.488 1.463 0 CA-C-O 117.943 -1.027 . . . . 0.0 110.319 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 0.535 ' CD1' ' N ' ' A' ' 2' ' ' LYS . 9.0 t80 . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.266 0.555 . . . . 0.0 110.12 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.535 ' N ' ' CD1' ' A' ' 1' ' ' PHE . 0.7 OUTLIER -140.63 114.3 8.84 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.24 -0.912 . . . . 0.0 110.241 179.961 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.518 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER -82.85 -157.86 0.24 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.229 -0.919 . . . . 0.0 110.495 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.527 ' CD ' ' HB2' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -155.66 -32.43 0.09 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.544 -0.723 . . . . 0.0 111.286 -179.671 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.527 ' HB2' ' CD ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -136.19 78.38 1.71 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.778 -1.201 . . . . 0.0 111.625 -179.102 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.656 ' HB3' HG12 ' A' ' 18' ' ' ILE . 73.5 m95 -65.94 96.93 0.33 Allowed 'General case' 0 C--N 1.305 -1.355 0 O-C-N 120.961 -1.087 . . . . 0.0 109.64 178.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.474 ' HB3' HG12 ' A' ' 21' ' ' VAL . 28.1 tt0 -84.17 104.41 14.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.114 -0.991 . . . . 0.0 110.415 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.587 ' NE1' ' CD1' ' A' ' 18' ' ' ILE . 49.9 m95 -44.53 105.47 0.06 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.264 -0.897 . . . . 0.0 110.555 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.513 ' CD ' HG23 ' A' ' 19' ' ' THR . 28.8 mtt180 -79.23 -177.69 5.81 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.23 -0.919 . . . . 0.0 109.386 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.524 ' N ' ' SD ' ' A' ' 10' ' ' MET . 0.0 OUTLIER -107.31 135.29 49.06 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.033 -1.042 . . . . 0.0 110.016 -179.863 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.524 ' CE ' ' O ' ' A' ' 16' ' ' PRO . 0.2 OUTLIER -134.17 -166.92 1.87 Allowed 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.477 -0.764 . . . . 0.0 109.81 179.89 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -59.63 -164.58 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.319 -0.863 . . . . 0.0 109.894 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.6 167.96 4.05 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.477 -0.764 . . . . 0.0 110.52 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 110.01 -70.42 0.21 Allowed Glycine 0 N--CA 1.488 2.156 0 N-CA-C 109.724 -1.35 . . . . 0.0 109.724 179.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.534 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . . . -176.01 -178.05 0.31 Allowed Pre-proline 0 N--CA 1.492 1.668 0 O-C-N 121.485 -1.009 . . . . 0.0 110.75 -179.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.534 ' HD2' ' CB ' ' A' ' 15' ' ' ALA . 44.1 Cg_endo -74.08 179.18 6.01 Favored 'Trans proline' 0 C--N 1.308 -1.591 0 O-C-N 124.051 1.553 . . . . 0.0 110.458 179.678 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -133.88 97.95 4.03 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.264 -0.898 . . . . 0.0 109.847 179.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.656 HG12 ' HB3' ' A' ' 6' ' ' TRP . 1.5 tt -75.4 115.08 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.212 -0.93 . . . . 0.0 110.176 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.591 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 6.9 t -106.86 -159.22 0.69 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.287 -0.883 . . . . 0.0 109.732 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.2 t -107.77 119.22 38.84 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.156 -0.965 . . . . 0.0 110.246 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.527 ' CG2' ' O ' ' A' ' 5' ' ' ARG . 1.1 m -112.52 28.29 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.162 -0.961 . . . . 0.0 109.806 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.524 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.1 OUTLIER -162.15 126.96 3.32 Favored 'General case' 0 C--N 1.293 -1.891 0 O-C-N 121.918 -0.489 . . . . 0.0 110.019 179.734 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.51 ' HA ' ' CZ ' ' A' ' 1' ' ' PHE . 60.4 mtt85 -105.35 55.06 0.7 Allowed 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.078 -1.013 . . . . 0.0 110.179 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.435 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -71.77 131.66 43.41 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.366 -0.834 . . . . 0.0 110.211 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.435 ' C ' ' O ' ' A' ' 24' ' ' ALA . 12.0 m-85 . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.393 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.457 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.599 0.714 . . . . 0.0 110.545 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.556 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -153.09 -31.8 0.13 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.529 -0.732 . . . . 0.0 111.475 -179.765 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.603 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -146.64 84.41 1.61 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.779 -1.201 . . . . 0.0 111.636 -179.376 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.689 ' HB3' HG12 ' A' ' 18' ' ' ILE . 90.5 m95 -66.06 100.93 0.63 Allowed 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.104 -0.997 . . . . 0.0 109.768 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.573 ' HB3' HG11 ' A' ' 21' ' ' VAL . 28.9 tt0 -87.96 112.45 22.58 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.094 -1.004 . . . . 0.0 110.537 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 1.101 ' NE1' HD12 ' A' ' 18' ' ' ILE . 50.7 m95 -51.01 104.86 0.09 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.304 -0.873 . . . . 0.0 110.419 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.1 mtp180 -79.11 -177.15 5.48 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.247 -0.908 . . . . 0.0 109.709 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -82.9 154.85 24.38 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.154 -0.966 . . . . 0.0 110.232 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.514 ' CD ' ' OG ' ' A' ' 17' ' ' SER . 1.4 mtpt -159.1 -154.74 0.43 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.481 -0.762 . . . . 0.0 110.193 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.508 ' HG3' ' CE ' ' A' ' 11' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.496 1.829 0 CA-C-O 121.784 0.802 . . . . 0.0 110.907 -179.564 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.485 ' HB2' ' HB3' ' A' ' 8' ' ' TRP . 49.0 Cg_endo . . . . . 0 N--CA 1.483 0.877 0 N-CA-C 110.223 -0.722 . . . . 0.0 110.223 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.514 ' OG ' ' CD ' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -136.89 97.55 3.55 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.131 -0.981 . . . . 0.0 109.936 179.429 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 1.101 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.0 tt -73.96 113.94 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.125 -0.985 . . . . 0.0 110.139 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.543 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 21.2 m -111.73 173.72 6.22 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.361 -0.837 . . . . 0.0 109.752 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.571 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 44.3 t -79.57 118.65 21.61 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.095 -1.003 . . . . 0.0 110.211 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.603 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -108.56 26.78 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.103 -0.998 . . . . 0.0 109.754 -179.958 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.556 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.34 132.95 4.84 Favored 'General case' 0 C--N 1.293 -1.868 0 O-C-N 121.904 -0.497 . . . . 0.0 110.099 179.829 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.5 mtp-105 -106.73 54.09 0.68 Allowed 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.073 -1.017 . . . . 0.0 110.037 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.601 0 O-C-N 121.333 -0.854 . . . . 0.0 110.231 179.981 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.616 0.722 . . . . 0.0 110.505 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.558 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -153.12 -32.03 0.13 Allowed 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.347 -179.686 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.613 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -151.22 89.85 1.55 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.731 -1.231 . . . . 0.0 111.769 -179.257 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.688 ' HB3' HG12 ' A' ' 18' ' ' ILE . 88.6 m95 -67.67 98.45 0.7 Allowed 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.207 -0.933 . . . . 0.0 109.773 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.565 ' HB3' HG11 ' A' ' 21' ' ' VAL . 23.1 tt0 -86.06 107.3 17.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.184 -0.947 . . . . 0.0 110.584 -179.415 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 1.059 ' NE1' HD12 ' A' ' 18' ' ' ILE . 52.9 m95 -45.26 102.79 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.231 -0.918 . . . . 0.0 110.325 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.8 mmm180 -78.96 -171.77 2.77 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.167 -0.958 . . . . 0.0 109.619 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.1 mtp -80.17 152.85 28.98 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.071 -1.018 . . . . 0.0 110.362 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.543 ' CE ' ' HA ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -159.81 -156.67 0.51 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.616 -0.678 . . . . 0.0 109.667 179.667 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' A' ' 11' ' ' LYS . 3.6 mttt . . . . . 0 N--CA 1.493 1.686 0 C-N-CA 119.742 -0.783 . . . . 0.0 109.764 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.576 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.1 Cg_endo . . . . . 0 N--CA 1.48 0.678 0 N-CA-C 110.119 -0.762 . . . . 0.0 110.119 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.516 ' HB2' ' CG ' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -135.48 95.91 3.36 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.094 -1.004 . . . . 0.0 110.135 179.322 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 1.059 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.7 tt -74.75 112.39 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 120.981 -1.074 . . . . 0.0 109.769 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.538 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 7.2 m -111.14 172.84 6.64 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.347 -0.846 . . . . 0.0 109.95 -179.499 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.577 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 43.4 t -79.55 114.07 18.19 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.239 -0.913 . . . . 0.0 109.868 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.613 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.1 m -103.06 27.19 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.054 -1.029 . . . . 0.0 110.121 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.558 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.44 137.27 6.83 Favored 'General case' 0 C--N 1.291 -1.941 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.186 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 73.5 mtt-85 -108.03 53.86 0.68 Allowed 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.045 -1.034 . . . . 0.0 110.034 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.349 -0.844 . . . . 0.0 110.233 -179.946 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.554 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.657 0.741 . . . . 0.0 110.566 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.582 ' HD3' ' CB ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -154.61 -32.09 0.1 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.607 -0.683 . . . . 0.0 110.959 -179.618 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.69 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.1 OUTLIER -135.01 77.83 1.7 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.812 -1.18 . . . . 0.0 111.426 -179.392 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.673 ' HB3' HG12 ' A' ' 18' ' ' ILE . 91.2 m95 -66.66 108.87 2.62 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.014 -1.054 . . . . 0.0 110.082 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.544 ' HB3' HG11 ' A' ' 21' ' ' VAL . 14.9 tt0 -93.95 112.51 24.36 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.076 -1.015 . . . . 0.0 110.398 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 1.072 ' NE1' HD12 ' A' ' 18' ' ' ILE . 55.5 m95 -52.0 103.67 0.07 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.27 -0.894 . . . . 0.0 110.342 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 70.9 mtp180 -79.14 -179.18 6.55 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.346 -0.847 . . . . 0.0 109.748 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -77.26 156.05 31.69 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.177 -0.952 . . . . 0.0 109.934 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.494 ' CG ' ' N ' ' A' ' 12' ' ' LYS . 14.9 tttt -157.93 169.74 23.91 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.449 -0.782 . . . . 0.0 110.026 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.494 ' N ' ' CG ' ' A' ' 11' ' ' LYS . 4.3 mtmt . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.184 -0.947 . . . . 0.0 109.953 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.588 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 41.0 Cg_endo . . . . . 0 N--CA 1.486 1.088 0 N-CA-C 110.74 -0.523 . . . . 0.0 110.74 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.458 ' OG ' ' HB2' ' A' ' 11' ' ' LYS . 13.1 m -133.49 97.34 3.92 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.332 -0.855 . . . . 0.0 110.035 179.426 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 1.072 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.0 tt -75.51 115.49 17.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.121 -0.987 . . . . 0.0 110.223 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.576 HG22 ' N ' ' A' ' 20' ' ' CYS . 58.3 m -111.33 175.47 5.41 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.356 -0.84 . . . . 0.0 109.768 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.576 ' N ' HG22 ' A' ' 19' ' ' THR . 48.5 t -79.42 129.53 34.55 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.144 -0.972 . . . . 0.0 110.115 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.69 HG22 ' O ' ' A' ' 5' ' ' ARG . 0.8 OUTLIER -126.56 25.55 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.13 -0.981 . . . . 0.0 110.1 -179.818 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.468 ' HB3' ' HB3' ' A' ' 4' ' ' ARG . 1.7 tpm_? -162.65 159.08 24.03 Favored 'General case' 0 C--N 1.289 -2.023 0 O-C-N 121.801 -0.562 . . . . 0.0 110.321 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.37 155.37 19.18 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.239 -0.913 . . . . 0.0 109.817 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.609 0 O-C-N 121.274 -0.891 . . . . 0.0 110.238 -179.851 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.576 0.703 . . . . 0.0 110.486 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.556 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -146.89 -32.74 0.31 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.543 -0.723 . . . . 0.0 111.255 -179.7 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.65 ' O ' HG22 ' A' ' 21' ' ' VAL . 17.6 ttm-85 -150.6 92.07 1.81 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.859 -1.151 . . . . 0.0 111.589 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.691 ' HB3' HG12 ' A' ' 18' ' ' ILE . 82.0 m95 -70.39 106.84 3.54 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.286 -0.884 . . . . 0.0 110.049 179.165 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.556 ' HB3' HG11 ' A' ' 21' ' ' VAL . 23.7 tt0 -92.21 109.28 20.65 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.199 -0.938 . . . . 0.0 110.464 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 1.075 ' NE1' HD12 ' A' ' 18' ' ' ILE . 54.2 m95 -48.84 103.68 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.27 -0.894 . . . . 0.0 110.512 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.507 ' HG3' ' CG2' ' A' ' 19' ' ' THR . 1.0 OUTLIER -79.15 -174.72 4.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.19 -0.944 . . . . 0.0 109.603 179.702 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 mtt -82.74 153.63 25.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.084 -1.01 . . . . 0.0 110.275 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.524 ' CD ' ' HB3' ' A' ' 17' ' ' SER . 0.1 OUTLIER -158.0 -155.55 0.51 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.474 -0.766 . . . . 0.0 110.102 179.818 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.493 ' O ' ' O ' ' A' ' 11' ' ' LYS . 6.1 mtmt . . . . . 0 N--CA 1.494 1.748 0 CA-C-O 121.77 0.795 . . . . 0.0 110.73 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.56 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.6 Cg_endo . . . . . 0 N--CA 1.482 0.829 0 N-CA-C 110.252 -0.711 . . . . 0.0 110.252 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.524 ' HB3' ' CD ' ' A' ' 11' ' ' LYS . 0.2 OUTLIER -138.74 95.59 3.0 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.189 -0.944 . . . . 0.0 110.038 179.621 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 1.075 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.7 tt -74.53 117.57 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.161 -0.962 . . . . 0.0 110.111 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.542 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 0.2 OUTLIER -116.82 177.09 4.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.236 -0.915 . . . . 0.0 110.077 -179.936 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 50.9 t -79.97 118.21 21.5 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.315 -0.866 . . . . 0.0 109.558 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.65 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -109.48 24.97 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.02 -1.05 . . . . 0.0 110.147 -179.475 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.556 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.86 113.44 1.45 Allowed 'General case' 0 C--N 1.292 -1.929 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.123 179.638 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.3 mtt85 -95.09 55.07 1.75 Allowed 'General case' 0 C--N 1.302 -1.473 0 O-C-N 120.92 -1.113 . . . . 0.0 110.137 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.57 0 O-C-N 121.309 -0.869 . . . . 0.0 110.208 -179.948 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.526 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.599 0.714 . . . . 0.0 110.529 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.583 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -143.23 -33.42 0.44 Allowed 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.605 -0.685 . . . . 0.0 111.258 -179.581 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.583 ' N ' ' CD ' ' A' ' 4' ' ' ARG . 1.5 tpm_? -117.3 75.83 1.01 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.977 -1.077 . . . . 0.0 111.001 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.673 ' HB3' HG12 ' A' ' 18' ' ' ILE . 69.3 m95 -74.27 97.87 3.09 Favored 'General case' 0 C--N 1.306 -1.316 0 O-C-N 121.229 -0.919 . . . . 0.0 110.337 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.541 ' HB3' HG11 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -85.95 101.67 13.09 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.17 -0.956 . . . . 0.0 110.251 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.996 ' NE1' HD12 ' A' ' 18' ' ' ILE . 52.3 m95 -41.75 104.42 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.278 -0.888 . . . . 0.0 110.618 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.713 ' HD2' HG21 ' A' ' 19' ' ' THR . 7.6 mtp180 -79.22 -172.41 3.15 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.173 -0.954 . . . . 0.0 109.454 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.9 mmt -85.6 154.77 21.48 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.039 -1.038 . . . . 0.0 110.215 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.524 ' CD ' ' OG ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -158.77 -155.12 0.46 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.497 -0.752 . . . . 0.0 110.179 179.802 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.493 ' O ' ' O ' ' A' ' 11' ' ' LYS . 2.3 mtmp? . . . . . 0 N--CA 1.496 1.828 0 CA-C-O 121.801 0.81 . . . . 0.0 110.771 -179.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.571 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.9 Cg_endo . . . . . 0 N--CA 1.483 0.865 0 N-CA-C 110.225 -0.721 . . . . 0.0 110.225 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.524 ' OG ' ' CD ' ' A' ' 11' ' ' LYS . 0.3 OUTLIER -137.16 95.91 3.19 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.252 -0.905 . . . . 0.0 110.088 179.567 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.996 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.2 tt -75.77 115.25 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.1 -1.0 . . . . 0.0 110.132 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.713 HG21 ' HD2' ' A' ' 9' ' ' ARG . 11.9 t -112.6 -153.39 0.52 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.181 -0.95 . . . . 0.0 109.855 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.1 t -112.15 114.28 27.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.023 -1.048 . . . . 0.0 109.98 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 21' ' ' VAL . 0.8 OUTLIER -107.65 21.91 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.12 -0.987 . . . . 0.0 109.913 -179.733 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.545 ' HD3' ' NE ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.82 89.15 0.64 Allowed 'General case' 0 C--N 1.29 -1.983 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.025 179.854 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 14.4 mtt180 -79.61 76.24 6.25 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.043 -1.035 . . . . 0.0 110.143 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.326 -0.859 . . . . 0.0 110.236 179.954 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.595 0.712 . . . . 0.0 110.485 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.556 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -149.95 -34.65 0.17 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.558 -0.714 . . . . 0.0 111.055 -179.905 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.624 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.4 OUTLIER -152.52 91.38 1.57 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.994 -1.066 . . . . 0.0 111.212 -179.466 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.694 ' HB3' HG12 ' A' ' 18' ' ' ILE . 83.1 m95 -63.73 121.98 15.29 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.27 -0.893 . . . . 0.0 110.166 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.642 ' HB3' HG11 ' A' ' 21' ' ' VAL . 2.6 tt0 -104.38 124.06 48.54 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.174 -0.953 . . . . 0.0 110.221 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 1.1 ' NE1' HD12 ' A' ' 18' ' ' ILE . 64.6 m95 -61.72 106.26 0.65 Allowed 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.217 -0.927 . . . . 0.0 110.441 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -79.4 -177.06 5.56 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.352 -0.843 . . . . 0.0 109.815 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.01 153.49 21.24 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.197 -0.939 . . . . 0.0 109.749 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.519 ' CD ' ' OG ' ' A' ' 17' ' ' SER . 0.1 OUTLIER -162.9 -153.92 0.27 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.369 -0.832 . . . . 0.0 110.503 -179.741 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.516 ' O ' ' O ' ' A' ' 11' ' ' LYS . 1.3 mtpp . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 121.6 0.714 . . . . 0.0 110.578 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.585 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 42.8 Cg_endo . . . . . 0 N--CA 1.483 0.892 0 N-CA-C 110.809 -0.496 . . . . 0.0 110.809 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.519 ' OG ' ' CD ' ' A' ' 11' ' ' LYS . 2.7 m -135.58 96.73 3.51 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.374 -0.829 . . . . 0.0 110.077 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 1.1 HD12 ' NE1' ' A' ' 8' ' ' TRP . 3.7 tt -74.0 118.28 19.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.163 -0.961 . . . . 0.0 110.301 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.567 HG22 ' H ' ' A' ' 20' ' ' CYS . 26.8 m -112.45 177.49 4.62 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.291 -0.881 . . . . 0.0 109.853 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.567 ' H ' HG22 ' A' ' 19' ' ' THR . 42.9 t -79.43 118.3 21.18 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.14 -0.975 . . . . 0.0 109.983 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.642 HG11 ' HB3' ' A' ' 7' ' ' GLN . 0.9 OUTLIER -106.21 27.39 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.046 -1.034 . . . . 0.0 109.855 -179.77 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.556 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.24 134.36 5.56 Favored 'General case' 0 C--N 1.293 -1.885 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.144 179.826 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.2 mtt85 -108.2 54.27 0.67 Allowed 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.026 -1.046 . . . . 0.0 110.165 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.596 0 O-C-N 121.314 -0.866 . . . . 0.0 110.233 -179.948 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.611 0.72 . . . . 0.0 110.551 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.549 ' CZ ' ' HD2' ' A' ' 22' ' ' ARG . 0.6 OUTLIER -152.89 -30.31 0.14 Allowed 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 119.943 -0.703 . . . . 0.0 111.713 -179.545 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.58 ' O ' HG22 ' A' ' 21' ' ' VAL . 9.1 mtt-85 -135.56 77.49 1.67 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.742 -1.224 . . . . 0.0 111.534 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.684 ' HB3' HG12 ' A' ' 18' ' ' ILE . 87.6 m95 -66.17 99.26 0.51 Allowed 'General case' 0 C--N 1.305 -1.326 0 O-C-N 121.068 -1.02 . . . . 0.0 109.975 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.577 ' HB3' HG11 ' A' ' 21' ' ' VAL . 2.4 tt0 -85.84 109.21 18.53 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.158 -0.964 . . . . 0.0 110.589 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 1.065 ' NE1' HD12 ' A' ' 18' ' ' ILE . 49.2 m95 -48.07 102.6 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.255 -0.903 . . . . 0.0 110.585 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.457 ' HD2' ' HB ' ' A' ' 19' ' ' THR . 0.3 OUTLIER -78.98 -176.82 5.25 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.136 -0.978 . . . . 0.0 109.588 179.699 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.425 ' O ' ' OG ' ' A' ' 17' ' ' SER . 2.2 mtm -79.28 154.24 29.3 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.957 -1.089 . . . . 0.0 110.26 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.527 ' CG ' ' HB3' ' A' ' 17' ' ' SER . 0.1 OUTLIER -157.41 -155.77 0.54 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.413 -0.805 . . . . 0.0 110.088 179.8 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.49 ' HD2' ' HD2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 121.79 0.805 . . . . 0.0 110.683 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.555 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.6 Cg_endo . . . . . 0 N--CA 1.482 0.795 0 N-CA-C 110.208 -0.728 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.527 ' HB3' ' CG ' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -136.87 95.92 3.21 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.153 -0.967 . . . . 0.0 110.069 179.554 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 1.065 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.7 tt -74.51 114.72 14.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.048 -1.032 . . . . 0.0 110.136 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.55 HG22 ' N ' ' A' ' 20' ' ' CYS . 33.0 m -115.34 176.2 5.18 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.358 -0.839 . . . . 0.0 109.707 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.55 ' N ' HG22 ' A' ' 19' ' ' THR . 47.7 t -79.4 123.96 28.0 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.091 -1.006 . . . . 0.0 110.218 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.58 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.3 m -113.07 22.18 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.183 -0.948 . . . . 0.0 110.11 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.549 ' HD2' ' CZ ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.93 145.07 10.31 Favored 'General case' 0 C--N 1.291 -1.97 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.061 179.531 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 26.3 ptt85 -118.69 59.26 0.82 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.104 -0.998 . . . . 0.0 110.154 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.245 -0.909 . . . . 0.0 110.219 -179.962 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.535 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.568 0.699 . . . . 0.0 110.508 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.55 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -150.12 -31.72 0.2 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.6 -0.688 . . . . 0.0 111.318 -179.703 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.619 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -144.03 81.37 1.68 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 120.836 -1.165 . . . . 0.0 111.518 -179.394 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.682 ' HB3' HG12 ' A' ' 18' ' ' ILE . 91.3 m95 -66.19 101.54 0.73 Allowed 'General case' 0 C--N 1.306 -1.316 0 O-C-N 121.035 -1.041 . . . . 0.0 109.931 179.116 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.55 ' HB3' HG11 ' A' ' 21' ' ' VAL . 21.4 tt0 -88.95 113.23 24.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.108 -0.995 . . . . 0.0 110.624 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 1.104 ' NE1' HD12 ' A' ' 18' ' ' ILE . 52.6 m95 -51.63 106.47 0.14 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.258 -0.901 . . . . 0.0 110.444 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.8 mtp180 -79.21 -178.43 6.18 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.252 -0.905 . . . . 0.0 109.816 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.4 mtm -83.11 154.99 24.07 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.149 -0.969 . . . . 0.0 110.196 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -160.72 -155.04 0.4 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.488 -0.758 . . . . 0.0 110.227 179.934 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 11' ' ' LYS . 1.2 mtpt . . . . . 0 N--CA 1.495 1.802 0 CA-C-O 121.804 0.812 . . . . 0.0 110.96 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.487 ' HB2' ' HB3' ' A' ' 8' ' ' TRP . 48.4 Cg_endo . . . . . 0 N--CA 1.482 0.833 0 N-CA-C 110.215 -0.725 . . . . 0.0 110.215 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.474 ' CB ' ' HG3' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -136.67 97.83 3.64 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.162 -0.961 . . . . 0.0 109.894 179.345 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 1.104 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.1 tt -73.82 114.21 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.081 -1.012 . . . . 0.0 110.063 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.543 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 24.7 m -111.57 173.92 6.12 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.36 -0.837 . . . . 0.0 109.674 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.574 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 51.5 t -79.55 121.39 25.18 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.085 -1.009 . . . . 0.0 110.153 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.619 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -112.83 25.33 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.091 -1.006 . . . . 0.0 109.926 -179.921 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.55 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.63 93.96 0.85 Allowed 'General case' 0 C--N 1.292 -1.913 0 O-C-N 121.912 -0.492 . . . . 0.0 110.187 179.917 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -79.76 59.01 2.96 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.001 -1.062 . . . . 0.0 110.044 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.359 -0.838 . . . . 0.0 110.227 -179.9 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.523 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.617 0.722 . . . . 0.0 110.531 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.533 ' CG ' ' HD2' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -155.9 -32.18 0.09 Allowed 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.901 -0.72 . . . . 0.0 111.193 -179.729 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.67 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -136.67 78.88 1.73 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.923 -1.111 . . . . 0.0 111.623 -179.202 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.654 ' HB3' HG12 ' A' ' 18' ' ' ILE . 73.2 m95 -66.1 97.21 0.36 Allowed 'General case' 0 C--N 1.305 -1.327 0 O-C-N 120.994 -1.066 . . . . 0.0 109.625 178.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.533 ' HB3' HG11 ' A' ' 21' ' ' VAL . 31.0 tp60 -84.74 104.39 14.67 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.055 -1.028 . . . . 0.0 110.367 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 1.034 ' NE1' HD12 ' A' ' 18' ' ' ILE . 55.0 m95 -43.14 105.58 0.05 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.275 -0.891 . . . . 0.0 110.399 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.418 ' HG3' HG22 ' A' ' 19' ' ' THR . 5.2 mtp180 -79.31 179.91 7.14 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.283 -0.885 . . . . 0.0 109.721 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.48 ' O ' ' HD3' ' A' ' 11' ' ' LYS . 7.4 mtm -78.32 155.61 30.04 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.161 -0.962 . . . . 0.0 109.854 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.48 ' HD3' ' O ' ' A' ' 10' ' ' MET . 0.6 OUTLIER -157.19 171.65 20.04 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.294 -0.879 . . . . 0.0 110.08 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 O-C-N 121.198 -0.939 . . . . 0.0 110.082 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.583 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 41.6 Cg_endo . . . . . 0 N--CA 1.487 1.113 0 N-CA-C 110.629 -0.566 . . . . 0.0 110.629 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.467 ' OG ' ' CE ' ' A' ' 11' ' ' LYS . 0.4 OUTLIER -133.26 97.36 3.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.36 -0.837 . . . . 0.0 110.001 179.477 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 1.034 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.5 tt -76.27 115.74 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.221 -0.924 . . . . 0.0 110.286 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.592 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 9.3 t -107.25 -158.24 0.65 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.281 -0.887 . . . . 0.0 109.773 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.4 t -108.11 120.04 41.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.21 -0.931 . . . . 0.0 110.4 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.67 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -113.11 28.36 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.111 -0.993 . . . . 0.0 109.778 179.897 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.533 ' HD2' ' CG ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.2 128.91 3.69 Favored 'General case' 0 C--N 1.292 -1.901 0 O-C-N 121.945 -0.472 . . . . 0.0 110.08 179.81 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 53.8 mtp85 -105.44 55.1 0.69 Allowed 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.031 -1.043 . . . . 0.0 110.175 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.596 0 O-C-N 121.3 -0.875 . . . . 0.0 110.223 179.943 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.453 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 121.574 0.702 . . . . 0.0 110.552 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.546 ' HB3' ' CG ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -160.91 -31.81 0.05 Allowed 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 119.782 -0.767 . . . . 0.0 111.308 -179.682 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.652 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.2 OUTLIER -136.96 80.23 1.8 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.763 -1.211 . . . . 0.0 111.677 -179.183 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.67 ' HB3' HG12 ' A' ' 18' ' ' ILE . 73.1 m95 -65.76 97.19 0.32 Allowed 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.068 -1.02 . . . . 0.0 109.594 178.907 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.528 ' HB3' HG11 ' A' ' 21' ' ' VAL . 1.5 tt0 -82.84 105.05 13.54 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.071 -1.018 . . . . 0.0 110.489 -179.432 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 1.008 ' NE1' HD12 ' A' ' 18' ' ' ILE . 48.6 m95 -46.94 106.17 0.08 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.337 -0.852 . . . . 0.0 110.46 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.7 mtp180 -79.2 -177.59 5.74 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 109.718 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 6.8 mtm -83.69 155.47 23.11 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.058 -1.026 . . . . 0.0 110.237 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.494 ' HG3' ' CB ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -160.41 -154.87 0.4 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.457 -0.777 . . . . 0.0 110.202 179.861 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.49 ' O ' ' O ' ' A' ' 11' ' ' LYS . 6.4 mttt . . . . . 0 N--CA 1.495 1.805 0 CA-C-O 121.783 0.801 . . . . 0.0 110.82 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.476 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.7 Cg_endo . . . . . 0 N--CA 1.483 0.867 0 N-CA-C 110.192 -0.734 . . . . 0.0 110.192 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.494 ' CB ' ' HG3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -134.46 98.21 4.02 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.165 -0.96 . . . . 0.0 109.856 179.423 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 1.008 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.3 tt -75.93 114.77 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.103 -0.998 . . . . 0.0 110.288 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.592 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 6.7 t -107.48 -159.38 0.69 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.32 -0.863 . . . . 0.0 109.675 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.6 t -107.27 122.79 47.25 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.194 -0.941 . . . . 0.0 110.129 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.652 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -116.45 28.79 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.018 -1.051 . . . . 0.0 110.013 179.981 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.546 ' CG ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.09 143.84 11.01 Favored 'General case' 0 C--N 1.294 -1.828 0 O-C-N 121.808 -0.557 . . . . 0.0 110.099 179.578 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -104.3 55.05 0.72 Allowed 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.154 -0.966 . . . . 0.0 110.19 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.653 0 O-C-N 121.345 -0.847 . . . . 0.0 110.17 -179.962 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.459 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.604 0.716 . . . . 0.0 110.523 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.56 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -151.48 -32.48 0.15 Allowed 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 119.864 -0.734 . . . . 0.0 111.203 -179.782 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.612 ' O ' HG22 ' A' ' 21' ' ' VAL . 24.6 ttm-85 -150.72 89.9 1.59 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.898 -1.126 . . . . 0.0 111.592 -179.321 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.675 ' HB3' HG12 ' A' ' 18' ' ' ILE . 86.1 m95 -67.67 99.86 0.84 Allowed 'General case' 0 C--N 1.307 -1.259 0 O-C-N 121.109 -0.994 . . . . 0.0 109.943 179.031 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.573 ' HB3' HG11 ' A' ' 21' ' ' VAL . 15.4 tt0 -85.97 109.57 18.86 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.146 -0.971 . . . . 0.0 110.471 -179.6 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 1.058 ' NE1' HD12 ' A' ' 18' ' ' ILE . 56.5 m95 -47.46 107.05 0.1 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.305 -0.872 . . . . 0.0 110.371 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 29.0 mtt180 -79.42 178.91 7.76 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.288 -0.882 . . . . 0.0 109.785 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.97 155.22 27.77 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.149 -0.969 . . . . 0.0 109.914 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.484 ' HD3' ' N ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -157.28 175.74 13.62 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.385 -0.822 . . . . 0.0 110.112 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.484 ' N ' ' HD3' ' A' ' 11' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.208 -0.933 . . . . 0.0 110.077 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.582 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 41.7 Cg_endo . . . . . 0 N--CA 1.487 1.132 0 N-CA-C 110.766 -0.513 . . . . 0.0 110.766 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.445 ' OG ' ' HB2' ' A' ' 11' ' ' LYS . 75.5 m -133.92 97.16 3.81 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.301 -0.874 . . . . 0.0 110.002 179.445 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 1.058 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.0 tt -75.78 116.9 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.122 -0.986 . . . . 0.0 110.465 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.572 HG22 ' N ' ' A' ' 20' ' ' CYS . 62.9 m -114.69 174.99 5.69 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.331 -0.856 . . . . 0.0 109.658 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.572 ' N ' HG22 ' A' ' 19' ' ' THR . 42.9 t -79.59 122.04 26.01 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.111 -0.993 . . . . 0.0 110.27 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.612 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.1 m -110.33 25.77 3.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.105 -0.997 . . . . 0.0 109.868 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.56 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.45 137.21 6.79 Favored 'General case' 0 C--N 1.293 -1.856 0 O-C-N 121.851 -0.53 . . . . 0.0 110.164 179.829 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 41.8 mtt-85 -106.44 53.13 0.71 Allowed 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.186 -0.946 . . . . 0.0 109.981 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.399 -0.813 . . . . 0.0 110.23 -179.857 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.521 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.629 0.728 . . . . 0.0 110.472 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.586 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -174.76 -64.38 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.919 -0.712 . . . . 0.0 110.902 -179.895 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.883 ' O ' HG13 ' A' ' 21' ' ' VAL . 4.3 ttt180 -84.06 53.85 2.74 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.256 -0.903 . . . . 0.0 110.958 -179.075 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.634 ' HB3' HG12 ' A' ' 18' ' ' ILE . 72.7 m95 -46.84 176.39 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.373 -0.829 . . . . 0.0 110.18 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 32.4 tt0 -151.53 95.27 2.11 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.051 -1.031 . . . . 0.0 110.55 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.901 ' NE1' HD12 ' A' ' 18' ' ' ILE . 52.8 m95 -45.12 111.63 0.35 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.236 -0.915 . . . . 0.0 110.034 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.492 ' O ' ' HA ' ' A' ' 16' ' ' PRO . 0.5 OUTLIER -79.42 -173.24 3.61 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.058 -1.026 . . . . 0.0 109.873 179.814 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 6.6 mtt -99.89 163.19 12.56 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.198 -0.939 . . . . 0.0 110.027 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.471 ' O ' ' O ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -175.02 -152.52 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.168 -0.957 . . . . 0.0 111.178 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.471 ' O ' ' O ' ' A' ' 11' ' ' LYS . 6.3 mttm . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 122.088 0.947 . . . . 0.0 111.952 -178.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.498 ' HB2' ' HB3' ' A' ' 8' ' ' TRP . 42.6 Cg_endo . . . . . 0 N--CA 1.485 1.011 0 CA-C-O 121.461 0.525 . . . . 0.0 110.891 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.3 m -144.19 96.21 2.85 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.483 -0.761 . . . . 0.0 109.644 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.901 HD12 ' NE1' ' A' ' 8' ' ' TRP . 0.7 OUTLIER -60.46 113.35 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.25 -0.906 . . . . 0.0 110.003 -179.315 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.558 HG22 ' N ' ' A' ' 20' ' ' CYS . 85.3 m -106.19 173.52 6.28 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.247 -0.908 . . . . 0.0 109.972 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.558 ' N ' HG22 ' A' ' 19' ' ' THR . 50.7 t -79.71 124.55 28.68 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.133 -0.979 . . . . 0.0 110.099 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.883 HG13 ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -137.14 33.54 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 CA-C-O 122.834 1.302 . . . . 0.0 109.138 -179.55 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.552 ' CG ' ' HB3' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -161.09 96.15 1.08 Allowed 'General case' 0 C--N 1.296 -1.747 0 O-C-N 121.105 -0.997 . . . . 0.0 110.191 179.342 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.4 mtt-85 -79.82 90.35 5.27 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.286 -0.884 . . . . 0.0 110.269 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.288 -0.883 . . . . 0.0 110.272 -179.998 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.666 0.746 . . . . 0.0 110.536 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.561 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -149.83 -33.15 0.19 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.507 -0.745 . . . . 0.0 111.142 -179.737 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.583 ' O ' HG22 ' A' ' 21' ' ' VAL . 1.5 tmm_? -152.87 92.52 1.65 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.795 -1.19 . . . . 0.0 111.673 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.688 ' HB3' HG12 ' A' ' 18' ' ' ILE . 83.6 m95 -67.62 102.1 1.12 Allowed 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.244 -0.91 . . . . 0.0 109.838 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.581 ' HB3' HG11 ' A' ' 21' ' ' VAL . 5.6 tp-100 -88.21 109.54 20.0 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.181 -0.949 . . . . 0.0 110.346 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 1.071 ' NE1' HD12 ' A' ' 18' ' ' ILE . 59.1 m95 -47.01 107.64 0.12 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.193 -0.942 . . . . 0.0 110.318 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -79.51 179.19 7.6 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.301 -0.875 . . . . 0.0 109.786 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.5 153.89 23.03 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.264 -0.897 . . . . 0.0 109.754 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.499 ' O ' ' O ' ' A' ' 12' ' ' LYS . 4.4 tptt -163.07 -154.35 0.29 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.341 -0.85 . . . . 0.0 110.614 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.499 ' O ' ' O ' ' A' ' 11' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 121.637 0.732 . . . . 0.0 110.646 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.585 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 42.8 Cg_endo . . . . . 0 N--CA 1.483 0.907 0 CA-C-O 121.36 0.483 . . . . 0.0 110.854 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.443 ' OG ' ' CG ' ' A' ' 11' ' ' LYS . 73.9 m -133.86 96.97 3.77 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.408 -0.808 . . . . 0.0 109.986 179.526 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 1.071 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.1 tt -75.65 117.13 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.203 -0.935 . . . . 0.0 110.397 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.557 HG22 ' N ' ' A' ' 20' ' ' CYS . 32.1 m -115.57 176.49 5.05 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.434 -0.791 . . . . 0.0 109.669 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.557 ' N ' HG22 ' A' ' 19' ' ' THR . 42.4 t -79.62 123.3 27.5 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.072 -1.018 . . . . 0.0 110.21 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.583 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.2 m -111.06 25.61 3.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.181 -0.949 . . . . 0.0 109.907 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.561 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.2 OUTLIER -162.63 137.27 6.62 Favored 'General case' 0 C--N 1.292 -1.903 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.128 179.691 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.5 mtp180 -107.14 53.33 0.69 Allowed 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.15 -0.969 . . . . 0.0 110.063 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.436 -0.79 . . . . 0.0 110.237 179.996 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.456 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.489 0.661 . . . . 0.0 110.507 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.564 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -149.9 -34.61 0.17 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 119.945 -0.702 . . . . 0.0 111.069 -179.852 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.554 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.5 OUTLIER -152.63 89.85 1.44 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.945 -1.097 . . . . 0.0 111.347 -179.475 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.693 ' HB3' HG12 ' A' ' 18' ' ' ILE . 85.1 m95 -63.55 112.32 2.74 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.254 -0.904 . . . . 0.0 110.358 179.483 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.502 ' O ' ' CG ' ' A' ' 7' ' ' GLN . 14.1 pt20 -94.22 117.79 30.63 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.174 -0.954 . . . . 0.0 110.552 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 1.1 ' NE1' HD12 ' A' ' 18' ' ' ILE . 56.9 m95 -57.17 105.46 0.23 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.208 -0.933 . . . . 0.0 110.315 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 -79.19 -178.69 6.31 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.222 -0.924 . . . . 0.0 109.817 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 5.2 mtp -81.69 155.08 25.74 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.209 -0.932 . . . . 0.0 109.911 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.461 ' HG3' ' OG ' ' A' ' 17' ' ' SER . 0.8 OUTLIER -157.76 174.21 15.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.311 -0.868 . . . . 0.0 110.063 179.832 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.138 -0.976 . . . . 0.0 110.092 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.58 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 40.9 Cg_endo . . . . . 0 N--CA 1.487 1.124 0 N-CA-C 110.729 -0.527 . . . . 0.0 110.729 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.461 ' OG ' ' HG3' ' A' ' 11' ' ' LYS . 4.8 m -134.26 97.05 3.74 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.378 -0.826 . . . . 0.0 109.985 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 1.1 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.8 tt -75.17 117.35 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.18 -0.95 . . . . 0.0 110.347 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.542 HG22 ' N ' ' A' ' 20' ' ' CYS . 30.5 m -112.87 176.12 5.15 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.38 -0.825 . . . . 0.0 109.668 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.542 ' N ' HG22 ' A' ' 19' ' ' THR . 43.6 t -79.71 123.91 28.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.118 -0.989 . . . . 0.0 110.206 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.2 m -110.6 25.38 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.028 -1.045 . . . . 0.0 110.055 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.564 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 7.2 tpt85 -162.43 138.28 7.38 Favored 'General case' 0 C--N 1.293 -1.878 0 O-C-N 121.799 -0.563 . . . . 0.0 110.283 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.2 mtm-85 -109.91 53.28 0.7 Allowed 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.08 -1.013 . . . . 0.0 110.051 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.405 -0.809 . . . . 0.0 110.233 -179.918 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 t . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.609 0.718 . . . . 0.0 110.37 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.562 ' HG3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -144.54 -32.56 0.41 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.577 -0.702 . . . . 0.0 111.098 -179.669 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.822 ' O ' HG22 ' A' ' 21' ' ' VAL . 2.7 ttt180 -146.32 96.77 2.83 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.988 -1.07 . . . . 0.0 110.653 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.613 ' HB3' HG12 ' A' ' 18' ' ' ILE . 70.5 m95 -68.97 169.38 11.82 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.277 -0.889 . . . . 0.0 110.403 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.655 ' CB ' HG11 ' A' ' 21' ' ' VAL . 2.9 tt0 -146.44 93.31 2.28 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.228 -0.92 . . . . 0.0 109.836 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.922 ' NE1' HD12 ' A' ' 18' ' ' ILE . 42.7 m95 -39.7 95.42 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.378 -0.826 . . . . 0.0 110.638 -179.759 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.514 ' O ' ' N ' ' A' ' 17' ' ' SER . 17.0 mtp-105 -78.87 -170.51 2.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.305 -0.872 . . . . 0.0 109.537 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.423 ' O ' ' HD2' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -82.66 152.51 25.81 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.151 -0.968 . . . . 0.0 110.233 -179.648 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.518 ' CE ' ' HA ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -148.64 -151.12 0.38 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.464 -0.772 . . . . 0.0 110.167 179.736 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.48 ' O ' ' O ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.838 0 CA-C-O 121.849 0.833 . . . . 0.0 110.952 -179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.551 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 50.3 Cg_endo . . . . . 0 C--O 1.216 -0.617 0 N-CA-C 110.162 -0.745 . . . . 0.0 110.162 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.514 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.3 OUTLIER -146.95 93.3 2.25 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.115 -0.99 . . . . 0.0 109.943 179.505 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.922 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.0 OUTLIER -63.9 114.15 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.153 -0.967 . . . . 0.0 109.821 -179.657 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.539 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 22.7 m -120.61 174.37 6.61 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.32 -0.863 . . . . 0.0 109.927 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.489 ' N ' HG22 ' A' ' 19' ' ' THR . 23.9 t -79.27 122.51 26.41 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.093 -1.005 . . . . 0.0 109.856 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.822 HG22 ' O ' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -111.06 23.28 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.126 -0.984 . . . . 0.0 109.655 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.562 ' CB ' ' HG3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.07 89.68 0.72 Allowed 'General case' 0 C--N 1.292 -1.893 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.008 179.792 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 22.9 mtt180 -79.72 59.84 3.19 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.039 -1.038 . . . . 0.0 110.004 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.583 0 O-C-N 121.39 -0.818 . . . . 0.0 110.271 -179.996 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.542 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.596 0.713 . . . . 0.0 110.537 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.548 ' HB3' ' CG ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -153.07 -33.24 0.12 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.599 -0.688 . . . . 0.0 111.082 -179.704 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.663 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -136.31 79.93 1.79 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.856 -1.153 . . . . 0.0 111.545 -178.969 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.658 ' HB3' HG12 ' A' ' 18' ' ' ILE . 72.9 m95 -67.01 97.16 0.48 Allowed 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.093 -1.004 . . . . 0.0 109.68 179.036 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.52 ' HB3' HG11 ' A' ' 21' ' ' VAL . 6.4 tt0 -84.21 103.69 13.63 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.12 -0.988 . . . . 0.0 110.374 -179.614 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 1.03 ' NE1' HD12 ' A' ' 18' ' ' ILE . 54.7 m95 -42.69 105.76 0.05 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.231 -0.918 . . . . 0.0 110.415 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.45 ' HD2' HG21 ' A' ' 19' ' ' THR . 4.4 mtt180 -79.25 179.41 7.41 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.277 -0.89 . . . . 0.0 109.67 179.768 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 6.6 mtm -76.99 156.36 31.94 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.172 -0.955 . . . . 0.0 109.945 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.489 ' HG3' ' CB ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -157.59 168.68 26.57 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.344 -0.847 . . . . 0.0 109.993 179.924 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.9 mtmt . . . . . 0 N--CA 1.491 1.601 0 O-C-N 121.198 -0.939 . . . . 0.0 109.964 179.902 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.585 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 41.7 Cg_endo . . . . . 0 N--CA 1.486 1.063 0 N-CA-C 110.661 -0.553 . . . . 0.0 110.661 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.489 ' CB ' ' HG3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -133.05 97.39 3.99 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.239 -0.913 . . . . 0.0 109.953 179.56 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 1.03 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.5 tt -76.69 116.31 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.201 -0.937 . . . . 0.0 110.265 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.592 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 9.0 t -108.47 -158.32 0.65 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.343 -0.848 . . . . 0.0 109.759 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.7 t -107.1 124.44 49.68 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.169 -0.957 . . . . 0.0 110.148 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.663 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -117.88 26.74 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.042 -1.037 . . . . 0.0 110.118 -179.999 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.548 ' CG ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.56 94.6 0.88 Allowed 'General case' 0 C--N 1.292 -1.916 0 O-C-N 121.87 -0.519 . . . . 0.0 110.116 179.671 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 38.3 mtp180 -79.7 61.41 3.66 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.99 -1.069 . . . . 0.0 110.021 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.613 0 O-C-N 121.333 -0.854 . . . . 0.0 110.158 179.98 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.549 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.595 0.712 . . . . 0.0 110.588 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.58 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -141.8 -30.26 0.59 Allowed 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.642 -0.661 . . . . 0.0 111.448 -179.65 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.663 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -120.9 74.04 1.05 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.92 -1.112 . . . . 0.0 111.296 -179.157 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.653 ' HB3' HG12 ' A' ' 18' ' ' ILE . 95.3 m95 -73.54 96.26 2.4 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.1 -1.0 . . . . 0.0 110.088 179.524 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.536 ' HB3' HG11 ' A' ' 21' ' ' VAL . 2.3 tp60 -87.36 109.14 19.33 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.169 -0.957 . . . . 0.0 110.394 -179.842 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 1.065 ' NE1' HD12 ' A' ' 18' ' ' ILE . 54.1 m95 -46.46 103.58 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.179 -0.951 . . . . 0.0 110.383 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.467 ' HD2' ' HB ' ' A' ' 19' ' ' THR . 2.3 mtp-105 -79.19 -179.64 6.84 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.326 -0.859 . . . . 0.0 109.698 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.02 156.74 35.89 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.212 -0.93 . . . . 0.0 109.938 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.502 ' CG ' ' OG ' ' A' ' 17' ' ' SER . 1.2 tmtt? -157.74 165.49 35.24 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.345 -0.847 . . . . 0.0 110.046 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 O-C-N 121.241 -0.912 . . . . 0.0 109.99 179.881 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.587 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 40.4 Cg_endo . . . . . 0 N--CA 1.488 1.152 0 N-CA-C 110.562 -0.592 . . . . 0.0 110.562 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.502 ' OG ' ' CG ' ' A' ' 11' ' ' LYS . 0.5 OUTLIER -133.5 96.9 3.81 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.274 -0.891 . . . . 0.0 110.117 179.604 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 1.065 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.9 tt -75.59 115.1 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.175 -0.953 . . . . 0.0 110.097 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.542 ' O ' ' HA ' ' A' ' 6' ' ' TRP . 8.1 m -115.91 170.4 8.51 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.31 -0.869 . . . . 0.0 109.89 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.535 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 5.4 t -78.85 113.2 16.74 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.122 -0.986 . . . . 0.0 110.005 -179.828 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.663 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -102.91 21.1 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.162 -0.961 . . . . 0.0 109.836 -179.814 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.494 ' HG2' ' NE ' ' A' ' 4' ' ' ARG . 14.9 tpt85 -162.98 86.44 0.55 Allowed 'General case' 0 C--N 1.289 -2.061 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.989 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 25.0 mtt180 -79.14 65.51 4.33 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.924 -1.11 . . . . 0.0 110.126 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.617 0 O-C-N 121.369 -0.832 . . . . 0.0 110.213 -179.987 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.493 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.519 0.676 . . . . 0.0 110.509 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.596 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -175.08 -61.83 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 119.946 -0.701 . . . . 0.0 110.899 -179.9 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.887 ' O ' HG13 ' A' ' 21' ' ' VAL . 0.6 OUTLIER -85.45 53.03 2.62 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.285 -0.885 . . . . 0.0 110.94 -178.98 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.62 ' HB3' HG12 ' A' ' 18' ' ' ILE . 74.9 m95 -46.41 175.39 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.444 -0.785 . . . . 0.0 110.209 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.513 ' O ' ' N ' ' A' ' 9' ' ' ARG . 11.4 tt0 -150.77 93.62 1.98 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.952 -1.093 . . . . 0.0 110.559 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.914 ' NE1' HD12 ' A' ' 18' ' ' ILE . 42.7 m95 -43.32 94.4 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.206 -0.934 . . . . 0.0 109.988 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 7' ' ' GLN . 3.7 mtp180 -78.65 -170.27 2.04 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.097 -1.002 . . . . 0.0 109.815 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -82.63 151.98 26.08 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.19 -0.944 . . . . 0.0 110.171 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.49 ' O ' ' O ' ' A' ' 12' ' ' LYS . 4.2 tttm -152.39 -150.33 0.33 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.479 -0.763 . . . . 0.0 110.29 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.49 ' O ' ' O ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.824 0 CA-C-O 121.785 0.803 . . . . 0.0 110.814 -179.507 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.581 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 46.1 Cg_endo . . . . . 0 N--CA 1.48 0.723 0 N-CA-C 110.358 -0.67 . . . . 0.0 110.358 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.458 ' OG ' ' HG3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -144.4 93.04 2.37 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.161 -0.962 . . . . 0.0 110.096 179.603 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.914 HD12 ' NE1' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -63.16 111.97 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.168 -0.958 . . . . 0.0 109.67 -179.913 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.544 HG22 ' N ' ' A' ' 20' ' ' CYS . 82.9 m -109.14 173.18 6.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.167 -0.958 . . . . 0.0 110.157 -179.429 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.544 ' N ' HG22 ' A' ' 19' ' ' THR . 52.4 t -79.55 124.28 28.36 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.096 -1.003 . . . . 0.0 109.921 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.887 HG13 ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -136.98 33.64 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 CA-C-O 122.942 1.353 . . . . 0.0 109.068 -179.642 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.524 ' HD3' ' CZ ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -160.83 96.38 1.12 Allowed 'General case' 0 C--N 1.296 -1.75 0 O-C-N 121.075 -1.015 . . . . 0.0 110.017 179.118 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.53 ' O ' ' CG ' ' A' ' 23' ' ' ARG . 23.1 ptt85 -79.62 94.74 5.73 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.235 -0.916 . . . . 0.0 110.275 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.322 -0.861 . . . . 0.0 110.136 -179.972 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.622 0.725 . . . . 0.0 110.493 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.528 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -148.83 -34.77 0.2 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 120.001 -0.679 . . . . 0.0 110.769 -179.784 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.675 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.5 OUTLIER -143.59 92.24 2.34 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.063 -1.023 . . . . 0.0 111.224 -179.427 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.675 ' HB3' HG12 ' A' ' 18' ' ' ILE . 68.2 m95 -71.16 105.47 3.41 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.237 -0.914 . . . . 0.0 110.079 179.44 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.569 ' HB3' HG11 ' A' ' 21' ' ' VAL . 32.3 tp60 -89.26 108.22 19.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.053 -1.029 . . . . 0.0 110.367 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 1.06 ' NE1' HD12 ' A' ' 18' ' ' ILE . 59.4 m95 -46.33 103.68 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.283 -0.886 . . . . 0.0 110.547 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.406 ' HB2' ' O ' ' A' ' 17' ' ' SER . 12.1 mtp180 -79.35 -172.1 3.04 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.262 -0.899 . . . . 0.0 109.558 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.476 ' O ' ' HD3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -81.72 151.92 27.28 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.076 -1.015 . . . . 0.0 110.098 -179.755 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.495 ' CE ' ' OG ' ' A' ' 17' ' ' SER . 1.7 tptt -163.27 -154.66 0.29 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.618 -0.676 . . . . 0.0 109.767 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.483 ' HD2' ' HG3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.803 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.876 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.589 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 43.3 Cg_endo . . . . . 0 N--CA 1.484 0.933 0 N-CA-C 110.255 -0.709 . . . . 0.0 110.255 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.495 ' OG ' ' CE ' ' A' ' 11' ' ' LYS . 0.3 OUTLIER -134.44 97.13 3.74 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.083 -1.01 . . . . 0.0 110.374 179.552 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 1.06 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.7 tt -77.45 117.73 23.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.099 -1.001 . . . . 0.0 110.316 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.587 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 14.2 t -112.96 -158.1 0.64 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.307 -0.87 . . . . 0.0 109.79 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.7 t -101.55 129.13 47.58 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.229 -0.92 . . . . 0.0 109.919 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.675 HG22 ' O ' ' A' ' 5' ' ' ARG . 0.9 OUTLIER -122.14 25.48 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.025 -1.047 . . . . 0.0 110.153 -179.697 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.528 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.7 94.86 0.88 Allowed 'General case' 0 C--N 1.292 -1.916 0 O-C-N 121.781 -0.575 . . . . 0.0 110.327 179.671 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 23.0 mtm180 -79.92 52.85 1.56 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.991 -1.068 . . . . 0.0 109.777 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.586 0 O-C-N 121.465 -0.772 . . . . 0.0 110.271 -179.862 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.538 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.646 0.736 . . . . 0.0 110.495 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.531 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -155.66 -32.43 0.09 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.544 -0.723 . . . . 0.0 111.286 -179.671 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.668 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -136.19 78.38 1.71 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.778 -1.201 . . . . 0.0 111.625 -179.102 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.668 ' HB3' HG12 ' A' ' 18' ' ' ILE . 73.5 m95 -65.94 96.93 0.33 Allowed 'General case' 0 C--N 1.305 -1.355 0 O-C-N 120.961 -1.087 . . . . 0.0 109.64 178.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.536 ' HB3' HG11 ' A' ' 21' ' ' VAL . 28.1 tt0 -84.17 104.41 14.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.114 -0.991 . . . . 0.0 110.415 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 1.03 ' NE1' HD12 ' A' ' 18' ' ' ILE . 49.9 m95 -44.53 105.47 0.06 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.264 -0.897 . . . . 0.0 110.555 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.598 ' CZ ' HG21 ' A' ' 19' ' ' THR . 28.8 mtt180 -79.23 -177.69 5.81 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.23 -0.919 . . . . 0.0 109.386 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.524 ' SD ' ' N ' ' A' ' 10' ' ' MET . 0.0 OUTLIER -107.31 135.29 49.06 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.033 -1.042 . . . . 0.0 110.016 -179.863 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.524 ' CE ' ' O ' ' A' ' 16' ' ' PRO . 0.2 OUTLIER -134.17 -166.92 1.87 Allowed 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.477 -0.764 . . . . 0.0 109.81 179.89 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.319 -0.863 . . . . 0.0 109.894 179.713 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.524 ' O ' ' CE ' ' A' ' 11' ' ' LYS . 44.1 Cg_endo . . . . . 0 N--CA 1.484 0.927 0 N-CA-C 110.458 -0.632 . . . . 0.0 110.458 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -133.88 97.95 4.03 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.264 -0.898 . . . . 0.0 109.847 179.436 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 1.03 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.5 tt -75.4 115.08 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.212 -0.93 . . . . 0.0 110.176 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.598 HG21 ' CZ ' ' A' ' 9' ' ' ARG . 6.9 t -106.86 -159.22 0.69 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.287 -0.883 . . . . 0.0 109.732 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.2 t -107.77 119.22 38.84 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.156 -0.965 . . . . 0.0 110.246 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.668 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.1 m -112.52 28.29 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.162 -0.961 . . . . 0.0 109.806 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.531 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.1 OUTLIER -162.15 126.96 3.32 Favored 'General case' 0 C--N 1.293 -1.891 0 O-C-N 121.918 -0.489 . . . . 0.0 110.019 179.734 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 60.4 mtt85 -105.35 55.06 0.7 Allowed 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.078 -1.013 . . . . 0.0 110.179 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.608 0 O-C-N 121.366 -0.834 . . . . 0.0 110.211 -179.982 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.429 ' CE1' ' HA ' ' A' ' 23' ' ' ARG . 19.6 t80 . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.234 0.54 . . . . 0.0 110.171 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.423 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 0.0 OUTLIER -131.03 100.06 5.1 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.24 -0.912 . . . . 0.0 110.16 179.957 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.457 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER -66.36 -158.17 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.25 -0.906 . . . . 0.0 110.545 179.925 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.556 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -153.09 -31.8 0.13 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.529 -0.732 . . . . 0.0 111.475 -179.765 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.603 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -146.64 84.41 1.61 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.779 -1.201 . . . . 0.0 111.636 -179.376 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.689 ' HB3' HG12 ' A' ' 18' ' ' ILE . 90.5 m95 -66.06 100.93 0.63 Allowed 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.104 -0.997 . . . . 0.0 109.768 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.573 ' HB3' HG11 ' A' ' 21' ' ' VAL . 28.9 tt0 -87.96 112.45 22.58 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.094 -1.004 . . . . 0.0 110.537 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 1.101 ' NE1' HD12 ' A' ' 18' ' ' ILE . 50.7 m95 -51.01 104.86 0.09 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.304 -0.873 . . . . 0.0 110.419 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.1 mtp180 -79.11 -177.15 5.48 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.247 -0.908 . . . . 0.0 109.709 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -82.9 154.85 24.38 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.154 -0.966 . . . . 0.0 110.232 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.526 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 1.4 mtpt -159.1 -154.74 0.43 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.481 -0.762 . . . . 0.0 110.193 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.508 ' HG3' ' CE ' ' A' ' 11' ' ' LYS . 0.5 OUTLIER -52.59 -164.71 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.784 0.802 . . . . 0.0 110.907 -179.564 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.473 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -72.75 137.02 45.62 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.535 -0.728 . . . . 0.0 111.414 -179.12 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.57 46.74 8.87 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.526 ' O ' ' HB3' ' A' ' 11' ' ' LYS . . . -162.45 98.31 1.13 Allowed Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 121.092 -1.24 . . . . 0.0 110.641 179.69 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.485 ' HB2' ' HB3' ' A' ' 8' ' ' TRP . 49.0 Cg_endo -76.34 177.96 8.13 Favored 'Trans proline' 0 C--N 1.301 -1.924 0 O-C-N 124.124 1.591 . . . . 0.0 110.223 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.514 ' OG ' ' CD ' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -136.89 97.55 3.55 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.131 -0.981 . . . . 0.0 109.936 179.429 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 1.101 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.0 tt -73.96 113.94 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.125 -0.985 . . . . 0.0 110.139 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.543 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 21.2 m -111.73 173.72 6.22 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.361 -0.837 . . . . 0.0 109.752 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.571 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 44.3 t -79.57 118.65 21.61 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.095 -1.003 . . . . 0.0 110.211 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.603 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -108.56 26.78 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.103 -0.998 . . . . 0.0 109.754 -179.958 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.556 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.34 132.95 4.84 Favored 'General case' 0 C--N 1.293 -1.868 0 O-C-N 121.904 -0.497 . . . . 0.0 110.099 179.829 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.429 ' HA ' ' CE1' ' A' ' 1' ' ' PHE . 1.5 mtp-105 -106.73 54.09 0.68 Allowed 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.073 -1.017 . . . . 0.0 110.037 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.423 ' HB3' ' O ' ' A' ' 2' ' ' LYS . . . -75.88 120.03 20.67 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.333 -0.854 . . . . 0.0 110.231 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.42 ' C ' ' O ' ' A' ' 24' ' ' ALA . 7.6 m-85 . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.352 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 72.3 t80 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.241 0.543 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.48 ' HD2' ' O ' ' A' ' 25' ' ' PHE . 0.1 OUTLIER -79.88 159.67 26.33 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.258 -0.901 . . . . 0.0 110.207 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.5 OUTLIER -163.21 -158.03 0.46 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.195 -0.941 . . . . 0.0 110.505 179.949 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.558 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -153.12 -32.03 0.13 Allowed 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.347 -179.686 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.613 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -151.22 89.85 1.55 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.731 -1.231 . . . . 0.0 111.769 -179.257 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.688 ' HB3' HG12 ' A' ' 18' ' ' ILE . 88.6 m95 -67.67 98.45 0.7 Allowed 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.207 -0.933 . . . . 0.0 109.773 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.565 ' HB3' HG11 ' A' ' 21' ' ' VAL . 23.1 tt0 -86.06 107.3 17.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.184 -0.947 . . . . 0.0 110.584 -179.415 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 1.059 ' NE1' HD12 ' A' ' 18' ' ' ILE . 52.9 m95 -45.26 102.79 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.231 -0.918 . . . . 0.0 110.325 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.8 mmm180 -78.96 -171.77 2.77 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.167 -0.958 . . . . 0.0 109.619 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.1 mtp -80.17 152.85 28.98 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.071 -1.018 . . . . 0.0 110.362 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.543 ' CE ' ' HA ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -159.81 -156.67 0.51 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.616 -0.678 . . . . 0.0 109.667 179.667 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' A' ' 11' ' ' LYS . 3.6 mttt -54.28 -166.64 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 119.742 -0.783 . . . . 0.0 109.764 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.89 146.1 30.99 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.197 -0.939 . . . . 0.0 111.33 -179.326 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 52.01 19.81 5.79 Favored Glycine 0 N--CA 1.487 2.07 0 N-CA-C 109.174 -1.57 . . . . 0.0 109.174 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.522 ' O ' ' HB3' ' A' ' 11' ' ' LYS . . . -146.31 110.32 4.28 Favored Pre-proline 0 N--CA 1.493 1.689 0 O-C-N 121.15 -1.206 . . . . 0.0 111.207 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.576 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.1 Cg_endo -85.45 -178.56 3.09 Favored 'Trans proline' 0 C--N 1.306 -1.672 0 O-C-N 124.065 1.561 . . . . 0.0 110.119 179.028 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.516 ' HB2' ' CG ' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -135.48 95.91 3.36 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.094 -1.004 . . . . 0.0 110.135 179.322 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 1.059 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.7 tt -74.75 112.39 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 120.981 -1.074 . . . . 0.0 109.769 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.538 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 7.2 m -111.14 172.84 6.64 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.347 -0.846 . . . . 0.0 109.95 -179.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.577 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 43.4 t -79.55 114.07 18.19 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.239 -0.913 . . . . 0.0 109.868 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.613 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.1 m -103.06 27.19 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.054 -1.029 . . . . 0.0 110.121 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.558 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.44 137.27 6.83 Favored 'General case' 0 C--N 1.291 -1.941 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.186 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 73.5 mtt-85 -108.03 53.86 0.68 Allowed 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.045 -1.034 . . . . 0.0 110.034 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.453 ' O ' ' OXT' ' A' ' 25' ' ' PHE . . . -77.39 88.3 3.77 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.349 -0.844 . . . . 0.0 110.233 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.48 ' O ' ' HD2' ' A' ' 2' ' ' LYS . 39.8 p90 . . . . . 0 N--CA 1.49 1.55 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.367 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.535 ' CZ ' ' SG ' ' A' ' 20' ' ' CYS . 46.2 p90 . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.231 0.539 . . . . 0.0 110.172 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.594 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 0.2 OUTLIER -86.15 112.85 21.7 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.345 -0.847 . . . . 0.0 110.223 179.974 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.554 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 1.0 OUTLIER -95.93 -157.77 0.6 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.259 -0.901 . . . . 0.0 110.566 -179.983 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.582 ' HD3' ' CB ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -154.61 -32.09 0.1 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.607 -0.683 . . . . 0.0 110.959 -179.618 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.69 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.1 OUTLIER -135.01 77.83 1.7 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.812 -1.18 . . . . 0.0 111.426 -179.392 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.673 ' HB3' HG12 ' A' ' 18' ' ' ILE . 91.2 m95 -66.66 108.87 2.62 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.014 -1.054 . . . . 0.0 110.082 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.544 ' HB3' HG11 ' A' ' 21' ' ' VAL . 14.9 tt0 -93.95 112.51 24.36 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.076 -1.015 . . . . 0.0 110.398 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 1.072 ' NE1' HD12 ' A' ' 18' ' ' ILE . 55.5 m95 -52.0 103.67 0.07 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.27 -0.894 . . . . 0.0 110.342 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 70.9 mtp180 -79.14 -179.18 6.55 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.346 -0.847 . . . . 0.0 109.748 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -77.26 156.05 31.69 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.177 -0.952 . . . . 0.0 109.934 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.494 ' CG ' ' N ' ' A' ' 12' ' ' LYS . 14.9 tttt -157.93 169.74 23.91 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.449 -0.782 . . . . 0.0 110.026 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.494 ' N ' ' CG ' ' A' ' 11' ' ' LYS . 4.3 mtmt -69.43 -165.78 0.08 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.184 -0.947 . . . . 0.0 109.953 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.442 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -52.92 155.04 2.56 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.421 -0.799 . . . . 0.0 110.451 -179.887 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.418 ' O ' ' HB2' ' A' ' 15' ' ' ALA . . . 112.58 -71.0 0.22 Allowed Glycine 0 N--CA 1.489 2.186 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.653 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.931 ' HB1' ' HD2' ' A' ' 16' ' ' PRO . . . -176.2 178.93 0.43 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.42 -1.047 . . . . 0.0 110.948 -179.821 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.931 ' HD2' ' HB1' ' A' ' 15' ' ' ALA . 41.0 Cg_endo -71.47 -176.57 2.01 Favored 'Trans proline' 0 C--N 1.307 -1.607 0 O-C-N 124.166 1.613 . . . . 0.0 110.74 179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.458 ' OG ' ' HB2' ' A' ' 11' ' ' LYS . 13.1 m -133.49 97.34 3.92 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.332 -0.855 . . . . 0.0 110.035 179.426 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 1.072 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.0 tt -75.51 115.49 17.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.121 -0.987 . . . . 0.0 110.223 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.576 HG22 ' N ' ' A' ' 20' ' ' CYS . 58.3 m -111.33 175.47 5.41 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.356 -0.84 . . . . 0.0 109.768 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.576 ' N ' HG22 ' A' ' 19' ' ' THR . 48.5 t -79.42 129.53 34.55 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.144 -0.972 . . . . 0.0 110.115 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.69 HG22 ' O ' ' A' ' 5' ' ' ARG . 0.8 OUTLIER -126.56 25.55 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.13 -0.981 . . . . 0.0 110.1 -179.818 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.468 ' HB3' ' HB3' ' A' ' 4' ' ' ARG . 1.7 tpm_? -162.65 159.08 24.03 Favored 'General case' 0 C--N 1.289 -2.023 0 O-C-N 121.801 -0.562 . . . . 0.0 110.321 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.37 155.37 19.18 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.239 -0.913 . . . . 0.0 109.817 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.594 ' HB3' ' O ' ' A' ' 2' ' ' LYS . . . -175.27 76.43 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.274 -0.891 . . . . 0.0 110.238 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.422 ' O ' ' O ' ' A' ' 24' ' ' ALA . 28.6 p90 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.339 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 27.5 t80 . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.231 0.539 . . . . 0.0 110.244 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.536 ' HB2' ' CE2' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -100.39 115.01 29.0 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.249 -0.907 . . . . 0.0 110.193 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -122.72 -158.13 0.77 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.223 -0.923 . . . . 0.0 110.486 -179.991 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.556 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -146.89 -32.74 0.31 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.543 -0.723 . . . . 0.0 111.255 -179.7 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.65 ' O ' HG22 ' A' ' 21' ' ' VAL . 17.6 ttm-85 -150.6 92.07 1.81 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.859 -1.151 . . . . 0.0 111.589 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.691 ' HB3' HG12 ' A' ' 18' ' ' ILE . 82.0 m95 -70.39 106.84 3.54 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.286 -0.884 . . . . 0.0 110.049 179.165 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.556 ' HB3' HG11 ' A' ' 21' ' ' VAL . 23.7 tt0 -92.21 109.28 20.65 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.199 -0.938 . . . . 0.0 110.464 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 1.075 ' NE1' HD12 ' A' ' 18' ' ' ILE . 54.2 m95 -48.84 103.68 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.27 -0.894 . . . . 0.0 110.512 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.507 ' HG3' ' CG2' ' A' ' 19' ' ' THR . 1.0 OUTLIER -79.15 -174.72 4.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.19 -0.944 . . . . 0.0 109.603 179.702 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 mtt -82.74 153.63 25.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.084 -1.01 . . . . 0.0 110.275 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.525 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -158.0 -155.55 0.51 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.474 -0.766 . . . . 0.0 110.102 179.818 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.493 ' O ' ' O ' ' A' ' 11' ' ' LYS . 6.1 mtmt -53.12 -164.72 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 121.77 0.795 . . . . 0.0 110.73 -179.587 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.471 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -73.86 139.27 44.93 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.458 -0.776 . . . . 0.0 111.292 -179.177 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.61 45.91 8.75 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 110.27 -1.132 . . . . 0.0 110.27 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.525 ' O ' ' HB3' ' A' ' 11' ' ' LYS . . . -164.01 100.96 0.91 Allowed Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.185 -1.185 . . . . 0.0 110.609 179.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.56 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.6 Cg_endo -77.45 -178.47 4.62 Favored 'Trans proline' 0 C--N 1.303 -1.827 0 O-C-N 124.109 1.584 . . . . 0.0 110.252 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.524 ' HB3' ' CD ' ' A' ' 11' ' ' LYS . 0.2 OUTLIER -138.74 95.59 3.0 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.189 -0.944 . . . . 0.0 110.038 179.621 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 1.075 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.7 tt -74.53 117.57 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.161 -0.962 . . . . 0.0 110.111 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.542 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 0.2 OUTLIER -116.82 177.09 4.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.236 -0.915 . . . . 0.0 110.077 -179.936 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 50.9 t -79.97 118.21 21.5 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.315 -0.866 . . . . 0.0 109.558 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.65 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -109.48 24.97 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.02 -1.05 . . . . 0.0 110.147 -179.475 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.556 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.86 113.44 1.45 Allowed 'General case' 0 C--N 1.292 -1.929 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.123 179.638 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.3 mtt85 -95.09 55.07 1.75 Allowed 'General case' 0 C--N 1.302 -1.473 0 O-C-N 120.92 -1.113 . . . . 0.0 110.137 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.32 134.6 53.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.309 -0.869 . . . . 0.0 110.208 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.536 ' CE2' ' HB2' ' A' ' 2' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.305 -1.364 0 CA-C-O 118.065 -0.969 . . . . 0.0 110.273 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 18.7 t80 . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.23 0.538 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.0 mttp -76.42 74.21 3.18 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.207 -0.933 . . . . 0.0 110.208 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.526 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 1.0 OUTLIER -72.5 -161.12 0.08 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.225 -0.922 . . . . 0.0 110.529 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.583 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -143.23 -33.42 0.44 Allowed 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.605 -0.685 . . . . 0.0 111.258 -179.581 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.583 ' N ' ' CD ' ' A' ' 4' ' ' ARG . 1.5 tpm_? -117.3 75.83 1.01 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.977 -1.077 . . . . 0.0 111.001 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.673 ' HB3' HG12 ' A' ' 18' ' ' ILE . 69.3 m95 -74.27 97.87 3.09 Favored 'General case' 0 C--N 1.306 -1.316 0 O-C-N 121.229 -0.919 . . . . 0.0 110.337 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.541 ' HB3' HG11 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -85.95 101.67 13.09 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.17 -0.956 . . . . 0.0 110.251 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.996 ' NE1' HD12 ' A' ' 18' ' ' ILE . 52.3 m95 -41.75 104.42 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.278 -0.888 . . . . 0.0 110.618 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.713 ' HD2' HG21 ' A' ' 19' ' ' THR . 7.6 mtp180 -79.22 -172.41 3.15 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.173 -0.954 . . . . 0.0 109.454 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.9 mmt -85.6 154.77 21.48 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.039 -1.038 . . . . 0.0 110.215 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -158.77 -155.12 0.46 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.497 -0.752 . . . . 0.0 110.179 179.802 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.493 ' O ' ' O ' ' A' ' 11' ' ' LYS . 2.3 mtmp? -53.02 -164.62 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.801 0.81 . . . . 0.0 110.771 -179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.472 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 0.9 OUTLIER -73.63 139.13 45.26 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.467 -0.77 . . . . 0.0 111.339 -179.237 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.64 45.97 8.81 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 179.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.529 ' O ' ' CB ' ' A' ' 11' ' ' LYS . . . -163.62 101.14 0.95 Allowed Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.158 -1.201 . . . . 0.0 110.593 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.571 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.9 Cg_endo -77.38 -178.52 4.65 Favored 'Trans proline' 0 C--N 1.302 -1.896 0 O-C-N 124.062 1.559 . . . . 0.0 110.225 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.524 ' OG ' ' CD ' ' A' ' 11' ' ' LYS . 0.3 OUTLIER -137.16 95.91 3.19 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.252 -0.905 . . . . 0.0 110.088 179.567 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.996 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.2 tt -75.77 115.25 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.1 -1.0 . . . . 0.0 110.132 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.713 HG21 ' HD2' ' A' ' 9' ' ' ARG . 11.9 t -112.6 -153.39 0.52 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.181 -0.95 . . . . 0.0 109.855 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.1 t -112.15 114.28 27.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.023 -1.048 . . . . 0.0 109.98 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 21' ' ' VAL . 0.8 OUTLIER -107.65 21.91 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.12 -0.987 . . . . 0.0 109.913 -179.733 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.545 ' HD3' ' NE ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.82 89.15 0.64 Allowed 'General case' 0 C--N 1.29 -1.983 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.025 179.854 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 14.4 mtt180 -79.61 76.24 6.25 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.043 -1.035 . . . . 0.0 110.143 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.445 ' O ' ' OXT' ' A' ' 25' ' ' PHE . . . -84.95 123.32 30.38 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.326 -0.859 . . . . 0.0 110.236 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.445 ' OXT' ' O ' ' A' ' 24' ' ' ALA . 6.2 m-85 . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.438 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 42.3 t80 . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.258 0.552 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.486 ' HB3' ' O ' ' A' ' 24' ' ' ALA . 0.0 OUTLIER -80.12 125.65 30.08 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.236 -0.915 . . . . 0.0 110.228 179.959 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.7 OUTLIER -134.66 -158.62 0.89 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.311 -0.868 . . . . 0.0 110.485 -179.976 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.556 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -149.95 -34.65 0.17 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.558 -0.714 . . . . 0.0 111.055 -179.905 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.624 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.4 OUTLIER -152.52 91.38 1.57 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.994 -1.066 . . . . 0.0 111.212 -179.466 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.694 ' HB3' HG12 ' A' ' 18' ' ' ILE . 83.1 m95 -63.73 121.98 15.29 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.27 -0.893 . . . . 0.0 110.166 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.642 ' HB3' HG11 ' A' ' 21' ' ' VAL . 2.6 tt0 -104.38 124.06 48.54 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.174 -0.953 . . . . 0.0 110.221 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 1.1 ' NE1' HD12 ' A' ' 18' ' ' ILE . 64.6 m95 -61.72 106.26 0.65 Allowed 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.217 -0.927 . . . . 0.0 110.441 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -79.4 -177.06 5.56 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.352 -0.843 . . . . 0.0 109.815 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.01 153.49 21.24 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.197 -0.939 . . . . 0.0 109.749 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.519 ' CD ' ' OG ' ' A' ' 17' ' ' SER . 0.1 OUTLIER -162.9 -153.92 0.27 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.369 -0.832 . . . . 0.0 110.503 -179.741 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.555 ' O ' ' O ' ' A' ' 13' ' ' LEU . 1.3 mtpp -56.0 -141.58 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 121.6 0.714 . . . . 0.0 110.578 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.555 ' O ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -41.31 174.46 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.708 0 O-C-N 121.784 -0.572 . . . . 0.0 110.982 -179.682 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.489 ' C ' ' O ' ' A' ' 13' ' ' LEU . . . -34.77 -31.34 0.01 OUTLIER Glycine 0 N--CA 1.496 2.663 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.538 ' N ' ' O ' ' A' ' 13' ' ' LEU . . . -51.47 106.62 0.67 Allowed Pre-proline 0 N--CA 1.492 1.668 0 O-C-N 121.233 -1.157 . . . . 0.0 110.183 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.585 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 42.8 Cg_endo -78.43 -176.45 3.26 Favored 'Trans proline' 0 C--N 1.306 -1.659 0 O-C-N 123.93 1.49 . . . . 0.0 110.809 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.519 ' OG ' ' CD ' ' A' ' 11' ' ' LYS . 2.7 m -135.58 96.73 3.51 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.374 -0.829 . . . . 0.0 110.077 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 1.1 HD12 ' NE1' ' A' ' 8' ' ' TRP . 3.7 tt -74.0 118.28 19.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.163 -0.961 . . . . 0.0 110.301 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.567 HG22 ' H ' ' A' ' 20' ' ' CYS . 26.8 m -112.45 177.49 4.62 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.291 -0.881 . . . . 0.0 109.853 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.567 ' H ' HG22 ' A' ' 19' ' ' THR . 42.9 t -79.43 118.3 21.18 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.14 -0.975 . . . . 0.0 109.983 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.642 HG11 ' HB3' ' A' ' 7' ' ' GLN . 0.9 OUTLIER -106.21 27.39 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.046 -1.034 . . . . 0.0 109.855 -179.77 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.556 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.24 134.36 5.56 Favored 'General case' 0 C--N 1.293 -1.885 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.144 179.826 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.2 mtt85 -108.2 54.27 0.67 Allowed 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.026 -1.046 . . . . 0.0 110.165 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.486 ' O ' ' HB3' ' A' ' 2' ' ' LYS . . . -72.1 98.53 2.13 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.314 -0.866 . . . . 0.0 110.233 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.346 -179.881 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.571 ' O ' ' CD2' ' A' ' 1' ' ' PHE . 87.2 t80 . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.246 0.546 . . . . 0.0 110.197 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.441 ' CG ' ' O ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -42.86 102.94 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.26 -0.9 . . . . 0.0 110.178 179.955 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.5 OUTLIER -56.93 -161.48 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.227 -0.92 . . . . 0.0 110.551 -179.946 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.549 ' CZ ' ' HD2' ' A' ' 22' ' ' ARG . 0.6 OUTLIER -152.89 -30.31 0.14 Allowed 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 119.943 -0.703 . . . . 0.0 111.713 -179.545 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.58 ' O ' HG22 ' A' ' 21' ' ' VAL . 9.1 mtt-85 -135.56 77.49 1.67 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.742 -1.224 . . . . 0.0 111.534 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.684 ' HB3' HG12 ' A' ' 18' ' ' ILE . 87.6 m95 -66.17 99.26 0.51 Allowed 'General case' 0 C--N 1.305 -1.326 0 O-C-N 121.068 -1.02 . . . . 0.0 109.975 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.577 ' HB3' HG11 ' A' ' 21' ' ' VAL . 2.4 tt0 -85.84 109.21 18.53 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.158 -0.964 . . . . 0.0 110.589 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 1.065 ' NE1' HD12 ' A' ' 18' ' ' ILE . 49.2 m95 -48.07 102.6 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.255 -0.903 . . . . 0.0 110.585 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.457 ' HD2' ' HB ' ' A' ' 19' ' ' THR . 0.3 OUTLIER -78.98 -176.82 5.25 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.136 -0.978 . . . . 0.0 109.588 179.699 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.425 ' O ' ' OG ' ' A' ' 17' ' ' SER . 2.2 mtm -79.28 154.24 29.3 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.957 -1.089 . . . . 0.0 110.26 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.527 ' CG ' ' HB3' ' A' ' 17' ' ' SER . 0.1 OUTLIER -157.41 -155.77 0.54 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.413 -0.805 . . . . 0.0 110.088 179.8 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.49 ' HD2' ' HD2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -53.31 -164.62 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.773 0 CA-C-O 121.79 0.805 . . . . 0.0 110.683 -179.681 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.47 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -74.42 140.45 44.7 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.371 -0.831 . . . . 0.0 111.216 -179.291 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.51 45.71 8.55 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.521 ' O ' ' CB ' ' A' ' 11' ' ' LYS . . . -165.02 103.67 0.79 Allowed Pre-proline 0 N--CA 1.492 1.648 0 O-C-N 121.198 -1.178 . . . . 0.0 110.566 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.555 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.6 Cg_endo -78.08 -179.54 5.54 Favored 'Trans proline' 0 C--N 1.303 -1.826 0 O-C-N 124.15 1.605 . . . . 0.0 110.208 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.527 ' HB3' ' CG ' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -136.87 95.92 3.21 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.153 -0.967 . . . . 0.0 110.069 179.554 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 1.065 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.7 tt -74.51 114.72 14.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.048 -1.032 . . . . 0.0 110.136 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.55 HG22 ' N ' ' A' ' 20' ' ' CYS . 33.0 m -115.34 176.2 5.18 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.358 -0.839 . . . . 0.0 109.707 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.553 ' SG ' ' CE2' ' A' ' 1' ' ' PHE . 47.7 t -79.4 123.96 28.0 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.091 -1.006 . . . . 0.0 110.218 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.58 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.3 m -113.07 22.18 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.183 -0.948 . . . . 0.0 110.11 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.549 ' HD2' ' CZ ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.93 145.07 10.31 Favored 'General case' 0 C--N 1.291 -1.97 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.061 179.531 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 26.3 ptt85 -118.69 59.26 0.82 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.104 -0.998 . . . . 0.0 110.154 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.431 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -65.65 96.84 0.29 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.245 -0.909 . . . . 0.0 110.219 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.431 ' C ' ' O ' ' A' ' 24' ' ' ALA . 2.4 m-85 . . . . . 0 N--CA 1.49 1.542 0 CA-C-O 118.055 -0.974 . . . . 0.0 110.319 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.303 0.573 . . . . 0.0 110.171 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 10.2 mtpp -97.3 88.37 4.41 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.236 -0.915 . . . . 0.0 110.219 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.535 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER -85.53 -158.87 0.41 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.257 -0.902 . . . . 0.0 110.508 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.55 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -150.12 -31.72 0.2 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.6 -0.688 . . . . 0.0 111.318 -179.703 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.619 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -144.03 81.37 1.68 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 120.836 -1.165 . . . . 0.0 111.518 -179.394 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.682 ' HB3' HG12 ' A' ' 18' ' ' ILE . 91.3 m95 -66.19 101.54 0.73 Allowed 'General case' 0 C--N 1.306 -1.316 0 O-C-N 121.035 -1.041 . . . . 0.0 109.931 179.116 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.55 ' HB3' HG11 ' A' ' 21' ' ' VAL . 21.4 tt0 -88.95 113.23 24.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.108 -0.995 . . . . 0.0 110.624 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 1.104 ' NE1' HD12 ' A' ' 18' ' ' ILE . 52.6 m95 -51.63 106.47 0.14 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.258 -0.901 . . . . 0.0 110.444 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.8 mtp180 -79.21 -178.43 6.18 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.252 -0.905 . . . . 0.0 109.816 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.4 mtm -83.11 154.99 24.07 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.149 -0.969 . . . . 0.0 110.196 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.526 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -160.72 -155.04 0.4 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.488 -0.758 . . . . 0.0 110.227 179.934 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 11' ' ' LYS . 1.2 mtpt -52.58 -164.38 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.804 0.812 . . . . 0.0 110.96 -179.519 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.468 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 1.1 pp -73.15 135.95 44.74 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.466 -0.771 . . . . 0.0 111.476 -179.074 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.58 46.93 8.93 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 110.502 -1.039 . . . . 0.0 110.502 179.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.526 ' O ' ' CB ' ' A' ' 11' ' ' LYS . . . -161.88 94.14 1.32 Allowed Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 121.086 -1.243 . . . . 0.0 110.657 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.487 ' HB2' ' HB3' ' A' ' 8' ' ' TRP . 48.4 Cg_endo -74.96 177.25 8.83 Favored 'Trans proline' 0 C--N 1.3 -1.987 0 O-C-N 124.194 1.628 . . . . 0.0 110.215 179.528 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.474 ' CB ' ' HG3' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -136.67 97.83 3.64 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.162 -0.961 . . . . 0.0 109.894 179.345 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 1.104 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.1 tt -73.82 114.21 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.081 -1.012 . . . . 0.0 110.063 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.543 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 24.7 m -111.57 173.92 6.12 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.36 -0.837 . . . . 0.0 109.674 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.574 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 51.5 t -79.55 121.39 25.18 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.085 -1.009 . . . . 0.0 110.153 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.619 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -112.83 25.33 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.091 -1.006 . . . . 0.0 109.926 -179.921 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.55 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.63 93.96 0.85 Allowed 'General case' 0 C--N 1.292 -1.913 0 O-C-N 121.912 -0.492 . . . . 0.0 110.187 179.917 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -79.76 59.01 2.96 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.001 -1.062 . . . . 0.0 110.044 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.41 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -80.13 74.11 6.93 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.359 -0.838 . . . . 0.0 110.227 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.41 ' C ' ' O ' ' A' ' 24' ' ' ALA . 22.6 m-85 . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.403 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.449 ' C ' ' CD1' ' A' ' 1' ' ' PHE . 15.8 p90 . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 121.238 0.542 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.4 mtpp -117.51 96.37 5.37 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.272 -0.893 . . . . 0.0 110.198 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.523 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER -61.34 -158.0 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.173 -0.954 . . . . 0.0 110.531 179.969 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.533 ' CG ' ' HD2' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -155.9 -32.18 0.09 Allowed 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.901 -0.72 . . . . 0.0 111.193 -179.729 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.67 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -136.67 78.88 1.73 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.923 -1.111 . . . . 0.0 111.623 -179.202 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.654 ' HB3' HG12 ' A' ' 18' ' ' ILE . 73.2 m95 -66.1 97.21 0.36 Allowed 'General case' 0 C--N 1.305 -1.327 0 O-C-N 120.994 -1.066 . . . . 0.0 109.625 178.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.533 ' HB3' HG11 ' A' ' 21' ' ' VAL . 31.0 tp60 -84.74 104.39 14.67 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.055 -1.028 . . . . 0.0 110.367 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 1.034 ' NE1' HD12 ' A' ' 18' ' ' ILE . 55.0 m95 -43.14 105.58 0.05 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.275 -0.891 . . . . 0.0 110.399 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.418 ' HG3' HG22 ' A' ' 19' ' ' THR . 5.2 mtp180 -79.31 179.91 7.14 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.283 -0.885 . . . . 0.0 109.721 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.48 ' O ' ' HD3' ' A' ' 11' ' ' LYS . 7.4 mtm -78.32 155.61 30.04 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.161 -0.962 . . . . 0.0 109.854 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.48 ' HD3' ' O ' ' A' ' 10' ' ' MET . 0.6 OUTLIER -157.19 171.65 20.04 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.294 -0.879 . . . . 0.0 110.08 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.27 -165.96 0.11 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.198 -0.939 . . . . 0.0 110.082 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.438 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -52.97 155.43 2.45 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.435 -0.791 . . . . 0.0 110.477 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.41 ' O ' ' HB2' ' A' ' 15' ' ' ALA . . . 112.53 -71.01 0.22 Allowed Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.927 ' HB1' ' HD2' ' A' ' 16' ' ' PRO . . . -176.1 179.28 0.42 Allowed Pre-proline 0 N--CA 1.493 1.72 0 O-C-N 121.423 -1.045 . . . . 0.0 110.881 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.927 ' HD2' ' HB1' ' A' ' 15' ' ' ALA . 41.6 Cg_endo -71.87 -177.11 2.37 Favored 'Trans proline' 0 C--N 1.307 -1.636 0 O-C-N 124.216 1.64 . . . . 0.0 110.629 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.467 ' OG ' ' CE ' ' A' ' 11' ' ' LYS . 0.4 OUTLIER -133.26 97.36 3.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.36 -0.837 . . . . 0.0 110.001 179.477 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 1.034 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.5 tt -76.27 115.74 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.221 -0.924 . . . . 0.0 110.286 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.592 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 9.3 t -107.25 -158.24 0.65 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.281 -0.887 . . . . 0.0 109.773 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.4 t -108.11 120.04 41.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.21 -0.931 . . . . 0.0 110.4 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.67 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -113.11 28.36 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.111 -0.993 . . . . 0.0 109.778 179.897 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.533 ' HD2' ' CG ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.2 128.91 3.69 Favored 'General case' 0 C--N 1.292 -1.901 0 O-C-N 121.945 -0.472 . . . . 0.0 110.08 179.81 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 53.8 mtp85 -105.44 55.1 0.69 Allowed 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.031 -1.043 . . . . 0.0 110.175 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.434 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -70.99 112.05 6.84 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.3 -0.875 . . . . 0.0 110.223 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.434 ' C ' ' O ' ' A' ' 24' ' ' ALA . 7.1 m-85 . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 118.074 -0.965 . . . . 0.0 110.413 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.534 ' CZ ' ' HA ' ' A' ' 23' ' ' ARG . 15.6 t80 . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.201 0.524 . . . . 0.0 110.237 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.48 ' HB2' ' O ' ' A' ' 24' ' ' ALA . 51.8 mmtt -63.01 179.79 0.35 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.246 -0.909 . . . . 0.0 110.195 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.453 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.6 OUTLIER -174.95 -157.81 0.07 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.251 -0.905 . . . . 0.0 110.552 -179.966 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.546 ' HB3' ' CG ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -160.91 -31.81 0.05 Allowed 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 119.782 -0.767 . . . . 0.0 111.308 -179.682 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.652 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.2 OUTLIER -136.96 80.23 1.8 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.763 -1.211 . . . . 0.0 111.677 -179.183 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.67 ' HB3' HG12 ' A' ' 18' ' ' ILE . 73.1 m95 -65.76 97.19 0.32 Allowed 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.068 -1.02 . . . . 0.0 109.594 178.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.528 ' HB3' HG11 ' A' ' 21' ' ' VAL . 1.5 tt0 -82.84 105.05 13.54 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.071 -1.018 . . . . 0.0 110.489 -179.432 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 1.008 ' NE1' HD12 ' A' ' 18' ' ' ILE . 48.6 m95 -46.94 106.17 0.08 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.337 -0.852 . . . . 0.0 110.46 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.7 mtp180 -79.2 -177.59 5.74 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 109.718 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 6.8 mtm -83.69 155.47 23.11 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.058 -1.026 . . . . 0.0 110.237 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.527 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -160.41 -154.87 0.4 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.457 -0.777 . . . . 0.0 110.202 179.861 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.49 ' O ' ' O ' ' A' ' 11' ' ' LYS . 6.4 mttt -52.94 -164.47 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 121.783 0.801 . . . . 0.0 110.82 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.459 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -73.12 137.19 45.05 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.452 -0.78 . . . . 0.0 111.504 -179.133 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.54 46.69 8.8 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 179.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.527 ' O ' ' HB3' ' A' ' 11' ' ' LYS . . . -162.59 96.37 1.15 Allowed Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.157 -1.202 . . . . 0.0 110.644 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.476 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.7 Cg_endo -75.99 177.61 8.52 Favored 'Trans proline' 0 C--N 1.301 -1.941 0 O-C-N 124.208 1.636 . . . . 0.0 110.192 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.494 ' CB ' ' HG3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -134.46 98.21 4.02 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.165 -0.96 . . . . 0.0 109.856 179.423 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 1.008 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.3 tt -75.93 114.77 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.103 -0.998 . . . . 0.0 110.288 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.592 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 6.7 t -107.48 -159.38 0.69 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.32 -0.863 . . . . 0.0 109.675 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.6 t -107.27 122.79 47.25 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.194 -0.941 . . . . 0.0 110.129 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.652 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -116.45 28.79 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.018 -1.051 . . . . 0.0 110.013 179.981 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.546 ' CG ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.09 143.84 11.01 Favored 'General case' 0 C--N 1.294 -1.828 0 O-C-N 121.808 -0.557 . . . . 0.0 110.099 179.578 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.534 ' HA ' ' CZ ' ' A' ' 1' ' ' PHE . 4.2 mtm180 -104.3 55.05 0.72 Allowed 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.154 -0.966 . . . . 0.0 110.19 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.48 ' O ' ' HB2' ' A' ' 2' ' ' LYS . . . -58.47 126.84 29.29 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.345 -0.847 . . . . 0.0 110.17 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.432 ' C ' ' O ' ' A' ' 24' ' ' ALA . 16.7 p90 . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 118.016 -0.993 . . . . 0.0 110.4 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.551 ' CD2' ' O ' ' A' ' 2' ' ' LYS . 66.7 t80 . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 121.264 0.554 . . . . 0.0 110.221 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.551 ' O ' ' CD2' ' A' ' 1' ' ' PHE . 4.6 mttt -44.08 154.6 0.1 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.186 -0.946 . . . . 0.0 110.172 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.459 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER -168.97 -158.2 0.2 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.174 -0.954 . . . . 0.0 110.523 -179.952 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.56 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -151.48 -32.48 0.15 Allowed 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 119.864 -0.734 . . . . 0.0 111.203 -179.782 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.612 ' O ' HG22 ' A' ' 21' ' ' VAL . 24.6 ttm-85 -150.72 89.9 1.59 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.898 -1.126 . . . . 0.0 111.592 -179.321 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.675 ' HB3' HG12 ' A' ' 18' ' ' ILE . 86.1 m95 -67.67 99.86 0.84 Allowed 'General case' 0 C--N 1.307 -1.259 0 O-C-N 121.109 -0.994 . . . . 0.0 109.943 179.031 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.573 ' HB3' HG11 ' A' ' 21' ' ' VAL . 15.4 tt0 -85.97 109.57 18.86 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.146 -0.971 . . . . 0.0 110.471 -179.6 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 1.058 ' NE1' HD12 ' A' ' 18' ' ' ILE . 56.5 m95 -47.46 107.05 0.1 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.305 -0.872 . . . . 0.0 110.371 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 29.0 mtt180 -79.42 178.91 7.76 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.288 -0.882 . . . . 0.0 109.785 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.97 155.22 27.77 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.149 -0.969 . . . . 0.0 109.914 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.484 ' HD3' ' N ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -157.28 175.74 13.62 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.385 -0.822 . . . . 0.0 110.112 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.484 ' N ' ' HD3' ' A' ' 11' ' ' LYS . 0.3 OUTLIER -71.7 -166.17 0.19 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.208 -0.933 . . . . 0.0 110.077 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.429 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -53.95 156.75 2.75 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.455 -0.778 . . . . 0.0 110.429 -179.868 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.406 ' O ' ' HB2' ' A' ' 15' ' ' ALA . . . 112.05 -71.01 0.22 Allowed Glycine 0 N--CA 1.487 2.086 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.93 ' HB1' ' HD2' ' A' ' 16' ' ' PRO . . . -176.12 178.36 0.47 Allowed Pre-proline 0 N--CA 1.493 1.677 0 O-C-N 121.351 -1.088 . . . . 0.0 110.842 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.93 ' HD2' ' HB1' ' A' ' 15' ' ' ALA . 41.7 Cg_endo -72.05 -177.03 2.38 Favored 'Trans proline' 0 C--N 1.306 -1.674 0 O-C-N 124.309 1.689 . . . . 0.0 110.766 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.445 ' OG ' ' HB2' ' A' ' 11' ' ' LYS . 75.5 m -133.92 97.16 3.81 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.301 -0.874 . . . . 0.0 110.002 179.445 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 1.058 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.0 tt -75.78 116.9 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.122 -0.986 . . . . 0.0 110.465 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.572 HG22 ' N ' ' A' ' 20' ' ' CYS . 62.9 m -114.69 174.99 5.69 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.331 -0.856 . . . . 0.0 109.658 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.572 ' N ' HG22 ' A' ' 19' ' ' THR . 42.9 t -79.59 122.04 26.01 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.111 -0.993 . . . . 0.0 110.27 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.612 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.1 m -110.33 25.77 3.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.105 -0.997 . . . . 0.0 109.868 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.56 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.45 137.21 6.79 Favored 'General case' 0 C--N 1.293 -1.856 0 O-C-N 121.851 -0.53 . . . . 0.0 110.164 179.829 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 41.8 mtt-85 -106.44 53.13 0.71 Allowed 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.186 -0.946 . . . . 0.0 109.981 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.466 ' O ' ' O ' ' A' ' 25' ' ' PHE . . . -67.85 90.95 0.31 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.399 -0.813 . . . . 0.0 110.23 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.476 ' OXT' ' HD3' ' A' ' 2' ' ' LYS . 17.1 m-85 . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 118.024 -0.988 . . . . 0.0 110.279 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 54.9 t80 . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 121.257 0.551 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.457 ' HD3' ' O ' ' A' ' 25' ' ' PHE . 40.1 mttt -69.0 112.22 5.5 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.248 -0.907 . . . . 0.0 110.227 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.521 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.5 OUTLIER -127.78 -159.75 0.96 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.265 -0.897 . . . . 0.0 110.472 -179.977 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.586 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -174.76 -64.38 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.919 -0.712 . . . . 0.0 110.902 -179.895 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.883 ' O ' HG13 ' A' ' 21' ' ' VAL . 4.3 ttt180 -84.06 53.85 2.74 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.256 -0.903 . . . . 0.0 110.958 -179.075 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.634 ' HB3' HG12 ' A' ' 18' ' ' ILE . 72.7 m95 -46.84 176.39 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.373 -0.829 . . . . 0.0 110.18 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 32.4 tt0 -151.53 95.27 2.11 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.051 -1.031 . . . . 0.0 110.55 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.901 ' NE1' HD12 ' A' ' 18' ' ' ILE . 52.8 m95 -45.12 111.63 0.35 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.236 -0.915 . . . . 0.0 110.034 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.492 ' O ' ' HA ' ' A' ' 16' ' ' PRO . 0.5 OUTLIER -79.42 -173.24 3.61 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.058 -1.026 . . . . 0.0 109.873 179.814 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 6.6 mtt -99.89 163.19 12.56 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.198 -0.939 . . . . 0.0 110.027 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.547 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -175.02 -152.52 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.168 -0.957 . . . . 0.0 111.178 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.499 ' O ' ' N ' ' A' ' 14' ' ' GLY . 6.3 mttm -52.36 -161.06 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 122.088 0.947 . . . . 0.0 111.952 -178.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -38.53 90.06 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 121.327 0.584 . . . . 0.0 112.071 -178.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.516 ' O ' ' HD3' ' A' ' 16' ' ' PRO . . . 43.64 34.52 2.7 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 110.594 -1.002 . . . . 0.0 110.594 178.343 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.547 ' O ' ' CB ' ' A' ' 11' ' ' LYS . . . -106.17 83.61 1.16 Allowed Pre-proline 0 N--CA 1.492 1.647 0 O-C-N 121.016 -1.285 . . . . 0.0 109.723 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.516 ' HD3' ' O ' ' A' ' 14' ' ' GLY . 42.6 Cg_endo -66.95 176.75 4.15 Favored 'Trans proline' 0 C--N 1.298 -2.084 0 O-C-N 124.304 1.687 . . . . 0.0 110.891 -179.447 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.3 m -144.19 96.21 2.85 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.483 -0.761 . . . . 0.0 109.644 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.901 HD12 ' NE1' ' A' ' 8' ' ' TRP . 0.7 OUTLIER -60.46 113.35 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.25 -0.906 . . . . 0.0 110.003 -179.315 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.558 HG22 ' N ' ' A' ' 20' ' ' CYS . 85.3 m -106.19 173.52 6.28 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.247 -0.908 . . . . 0.0 109.972 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.558 ' N ' HG22 ' A' ' 19' ' ' THR . 50.7 t -79.71 124.55 28.68 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.133 -0.979 . . . . 0.0 110.099 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.883 HG13 ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -137.14 33.54 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 CA-C-O 122.834 1.302 . . . . 0.0 109.138 -179.55 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.552 ' CG ' ' HB3' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -161.09 96.15 1.08 Allowed 'General case' 0 C--N 1.296 -1.747 0 O-C-N 121.105 -0.997 . . . . 0.0 110.191 179.342 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.4 mtt-85 -79.82 90.35 5.27 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.286 -0.884 . . . . 0.0 110.269 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.413 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -101.43 104.78 15.74 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.288 -0.883 . . . . 0.0 110.272 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.457 ' O ' ' HD3' ' A' ' 2' ' ' LYS . 24.7 m-85 . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.409 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.466 ' CG ' ' O ' ' A' ' 1' ' ' PHE . 12.4 t80 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.226 0.536 . . . . 0.0 110.22 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.49 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 11.2 mmtp -76.42 99.98 5.05 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.298 -0.877 . . . . 0.0 110.219 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER -56.69 -158.26 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.349 -0.844 . . . . 0.0 110.536 -179.995 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.561 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -149.83 -33.15 0.19 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.507 -0.745 . . . . 0.0 111.142 -179.737 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.583 ' O ' HG22 ' A' ' 21' ' ' VAL . 1.5 tmm_? -152.87 92.52 1.65 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.795 -1.19 . . . . 0.0 111.673 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.688 ' HB3' HG12 ' A' ' 18' ' ' ILE . 83.6 m95 -67.62 102.1 1.12 Allowed 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.244 -0.91 . . . . 0.0 109.838 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.581 ' HB3' HG11 ' A' ' 21' ' ' VAL . 5.6 tp-100 -88.21 109.54 20.0 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.181 -0.949 . . . . 0.0 110.346 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 1.071 ' NE1' HD12 ' A' ' 18' ' ' ILE . 59.1 m95 -47.01 107.64 0.12 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.193 -0.942 . . . . 0.0 110.318 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -79.51 179.19 7.6 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.301 -0.875 . . . . 0.0 109.786 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.5 153.89 23.03 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.264 -0.897 . . . . 0.0 109.754 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.499 ' O ' ' O ' ' A' ' 12' ' ' LYS . 4.4 tptt -163.07 -154.35 0.29 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.341 -0.85 . . . . 0.0 110.614 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.556 ' O ' ' O ' ' A' ' 13' ' ' LEU . 0.4 OUTLIER -55.82 -141.78 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 121.637 0.732 . . . . 0.0 110.646 179.816 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.556 ' O ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -41.33 174.9 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.706 0 CA-C-O 121.279 0.562 . . . . 0.0 111.05 -179.616 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.486 ' C ' ' O ' ' A' ' 13' ' ' LEU . . . -34.81 -31.38 0.01 OUTLIER Glycine 0 N--CA 1.495 2.623 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.542 ' N ' ' O ' ' A' ' 13' ' ' LEU . . . -52.3 106.96 0.72 Allowed Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.242 -1.152 . . . . 0.0 110.217 179.541 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.585 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 42.8 Cg_endo -77.29 -176.97 3.49 Favored 'Trans proline' 0 C--N 1.307 -1.651 0 O-C-N 124.036 1.545 . . . . 0.0 110.854 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.443 ' OG ' ' CG ' ' A' ' 11' ' ' LYS . 73.9 m -133.86 96.97 3.77 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.408 -0.808 . . . . 0.0 109.986 179.526 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 1.071 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.1 tt -75.65 117.13 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.203 -0.935 . . . . 0.0 110.397 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.557 HG22 ' N ' ' A' ' 20' ' ' CYS . 32.1 m -115.57 176.49 5.05 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.434 -0.791 . . . . 0.0 109.669 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.557 ' N ' HG22 ' A' ' 19' ' ' THR . 42.4 t -79.62 123.3 27.5 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.072 -1.018 . . . . 0.0 110.21 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.583 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.2 m -111.06 25.61 3.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.181 -0.949 . . . . 0.0 109.907 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.561 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.2 OUTLIER -162.63 137.27 6.62 Favored 'General case' 0 C--N 1.292 -1.903 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.128 179.691 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.5 mtp180 -107.14 53.33 0.69 Allowed 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.15 -0.969 . . . . 0.0 110.063 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.49 ' HB3' ' O ' ' A' ' 2' ' ' LYS . . . -83.35 89.93 7.09 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.436 -0.79 . . . . 0.0 110.237 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.432 ' C ' ' O ' ' A' ' 24' ' ' ALA . 9.0 m-85 . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 117.936 -1.03 . . . . 0.0 110.389 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.276 0.56 . . . . 0.0 110.183 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.492 ' HB3' ' O ' ' A' ' 24' ' ' ALA . 16.0 mmtm -45.43 133.4 7.46 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.223 -0.923 . . . . 0.0 110.142 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.456 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.7 OUTLIER -129.57 -158.44 0.89 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.246 -0.909 . . . . 0.0 110.507 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.564 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -149.9 -34.61 0.17 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 119.945 -0.702 . . . . 0.0 111.069 -179.852 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.554 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.5 OUTLIER -152.63 89.85 1.44 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.945 -1.097 . . . . 0.0 111.347 -179.475 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.693 ' HB3' HG12 ' A' ' 18' ' ' ILE . 85.1 m95 -63.55 112.32 2.74 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.254 -0.904 . . . . 0.0 110.358 179.483 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.502 ' O ' ' CG ' ' A' ' 7' ' ' GLN . 14.1 pt20 -94.22 117.79 30.63 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.174 -0.954 . . . . 0.0 110.552 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 1.1 ' NE1' HD12 ' A' ' 18' ' ' ILE . 56.9 m95 -57.17 105.46 0.23 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.208 -0.933 . . . . 0.0 110.315 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 -79.19 -178.69 6.31 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.222 -0.924 . . . . 0.0 109.817 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 5.2 mtp -81.69 155.08 25.74 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.209 -0.932 . . . . 0.0 109.911 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.488 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -157.76 174.21 15.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.311 -0.868 . . . . 0.0 110.063 179.832 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.57 -165.89 0.12 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.138 -0.976 . . . . 0.0 110.092 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.427 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -53.56 156.5 2.54 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.519 -0.738 . . . . 0.0 110.613 -179.882 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.407 ' O ' ' HB2' ' A' ' 15' ' ' ALA . . . 112.28 -71.47 0.22 Allowed Glycine 0 N--CA 1.488 2.125 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.916 ' HB1' ' HD2' ' A' ' 16' ' ' PRO . . . -176.26 178.66 0.44 Allowed Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.333 -1.098 . . . . 0.0 110.881 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.916 ' HD2' ' HB1' ' A' ' 15' ' ' ALA . 40.9 Cg_endo -72.2 -176.62 2.24 Favored 'Trans proline' 0 C--N 1.306 -1.662 0 O-C-N 124.226 1.645 . . . . 0.0 110.729 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.461 ' OG ' ' HG3' ' A' ' 11' ' ' LYS . 4.8 m -134.26 97.05 3.74 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.378 -0.826 . . . . 0.0 109.985 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 1.1 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.8 tt -75.17 117.35 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.18 -0.95 . . . . 0.0 110.347 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.542 HG22 ' N ' ' A' ' 20' ' ' CYS . 30.5 m -112.87 176.12 5.15 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.38 -0.825 . . . . 0.0 109.668 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.542 ' N ' HG22 ' A' ' 19' ' ' THR . 43.6 t -79.71 123.91 28.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.118 -0.989 . . . . 0.0 110.206 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.2 m -110.6 25.38 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.028 -1.045 . . . . 0.0 110.055 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.564 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 7.2 tpt85 -162.43 138.28 7.38 Favored 'General case' 0 C--N 1.293 -1.878 0 O-C-N 121.799 -0.563 . . . . 0.0 110.283 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.2 mtm-85 -109.91 53.28 0.7 Allowed 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.08 -1.013 . . . . 0.0 110.051 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.492 ' O ' ' HB3' ' A' ' 2' ' ' LYS . . . -81.02 76.33 7.98 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.405 -0.809 . . . . 0.0 110.233 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.47 ' HA ' ' HB2' ' A' ' 2' ' ' LYS . 38.2 p90 . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.319 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.221 0.534 . . . . 0.0 110.167 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' A' ' 3' ' ' CYS . 0.9 OUTLIER -98.27 62.13 1.48 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.273 -0.892 . . . . 0.0 110.246 179.967 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.462 ' O ' ' O ' ' A' ' 2' ' ' LYS . 1.2 t -55.6 -162.85 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.181 -0.949 . . . . 0.0 110.37 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.562 ' HG3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -144.54 -32.56 0.41 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.577 -0.702 . . . . 0.0 111.098 -179.669 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.822 ' O ' HG22 ' A' ' 21' ' ' VAL . 2.7 ttt180 -146.32 96.77 2.83 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.988 -1.07 . . . . 0.0 110.653 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.613 ' HB3' HG12 ' A' ' 18' ' ' ILE . 70.5 m95 -68.97 169.38 11.82 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.277 -0.889 . . . . 0.0 110.403 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.655 ' CB ' HG11 ' A' ' 21' ' ' VAL . 2.9 tt0 -146.44 93.31 2.28 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.228 -0.92 . . . . 0.0 109.836 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.922 ' NE1' HD12 ' A' ' 18' ' ' ILE . 42.7 m95 -39.7 95.42 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.378 -0.826 . . . . 0.0 110.638 -179.759 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.514 ' O ' ' N ' ' A' ' 17' ' ' SER . 17.0 mtp-105 -78.87 -170.51 2.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.305 -0.872 . . . . 0.0 109.537 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.423 ' O ' ' HD2' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -82.66 152.51 25.81 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.151 -0.968 . . . . 0.0 110.233 -179.648 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.543 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -148.64 -151.12 0.38 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.464 -0.772 . . . . 0.0 110.167 179.736 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.48 ' O ' ' O ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -52.82 -164.6 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 121.849 0.833 . . . . 0.0 110.952 -179.508 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.47 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -60.23 128.75 38.28 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.555 -0.715 . . . . 0.0 111.241 -179.294 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.42 50.72 8.01 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.977 -1.249 . . . . 0.0 109.977 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.543 ' O ' ' CB ' ' A' ' 11' ' ' LYS . . . -153.0 122.63 3.31 Favored Pre-proline 0 C--N 1.299 -1.591 0 O-C-N 121.236 -1.156 . . . . 0.0 110.388 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.551 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 50.3 Cg_endo -87.49 -174.32 1.24 Allowed 'Trans proline' 0 C--N 1.306 -1.679 0 O-C-N 123.896 1.472 . . . . 0.0 110.162 179.518 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.514 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.3 OUTLIER -146.95 93.3 2.25 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.115 -0.99 . . . . 0.0 109.943 179.505 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.922 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.0 OUTLIER -63.9 114.15 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.153 -0.967 . . . . 0.0 109.821 -179.657 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.539 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 22.7 m -120.61 174.37 6.61 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.32 -0.863 . . . . 0.0 109.927 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.489 ' N ' HG22 ' A' ' 19' ' ' THR . 23.9 t -79.27 122.51 26.41 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.093 -1.005 . . . . 0.0 109.856 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.822 HG22 ' O ' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -111.06 23.28 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.126 -0.984 . . . . 0.0 109.655 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.562 ' CB ' ' HG3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.07 89.68 0.72 Allowed 'General case' 0 C--N 1.292 -1.893 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.008 179.792 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 22.9 mtt180 -79.72 59.84 3.19 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.039 -1.038 . . . . 0.0 110.004 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.428 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -67.51 92.12 0.3 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.39 -0.818 . . . . 0.0 110.271 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.428 ' C ' ' O ' ' A' ' 24' ' ' ALA . 5.9 m-85 . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.398 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 23.0 p90 . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.236 0.541 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -109.51 113.33 26.04 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.258 -0.901 . . . . 0.0 110.194 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.542 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER -85.96 -158.35 0.39 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.23 -0.919 . . . . 0.0 110.537 179.954 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.548 ' HB3' ' CG ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -153.07 -33.24 0.12 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.599 -0.688 . . . . 0.0 111.082 -179.704 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.663 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -136.31 79.93 1.79 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.856 -1.153 . . . . 0.0 111.545 -178.969 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.658 ' HB3' HG12 ' A' ' 18' ' ' ILE . 72.9 m95 -67.01 97.16 0.48 Allowed 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.093 -1.004 . . . . 0.0 109.68 179.036 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.52 ' HB3' HG11 ' A' ' 21' ' ' VAL . 6.4 tt0 -84.21 103.69 13.63 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.12 -0.988 . . . . 0.0 110.374 -179.614 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 1.03 ' NE1' HD12 ' A' ' 18' ' ' ILE . 54.7 m95 -42.69 105.76 0.05 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.231 -0.918 . . . . 0.0 110.415 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.45 ' HD2' HG21 ' A' ' 19' ' ' THR . 4.4 mtt180 -79.25 179.41 7.41 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.277 -0.89 . . . . 0.0 109.67 179.768 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 6.6 mtm -76.99 156.36 31.94 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.172 -0.955 . . . . 0.0 109.945 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.489 ' HG3' ' CB ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -157.59 168.68 26.57 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.344 -0.847 . . . . 0.0 109.993 179.924 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.9 mtmt -69.15 -165.72 0.08 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.198 -0.939 . . . . 0.0 109.964 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.45 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -52.52 154.97 2.32 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.431 -0.793 . . . . 0.0 110.436 -179.878 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.413 ' O ' ' HB2' ' A' ' 15' ' ' ALA . . . 112.62 -71.13 0.22 Allowed Glycine 0 N--CA 1.487 2.071 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 179.663 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.939 ' HB1' ' HD2' ' A' ' 16' ' ' PRO . . . -176.11 179.28 0.42 Allowed Pre-proline 0 N--CA 1.493 1.691 0 O-C-N 121.362 -1.081 . . . . 0.0 110.951 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.939 ' HD2' ' HB1' ' A' ' 15' ' ' ALA . 41.7 Cg_endo -72.0 -177.23 2.48 Favored 'Trans proline' 0 C--N 1.308 -1.583 0 O-C-N 124.147 1.604 . . . . 0.0 110.661 179.524 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.489 ' CB ' ' HG3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -133.05 97.39 3.99 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.239 -0.913 . . . . 0.0 109.953 179.56 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 1.03 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.5 tt -76.69 116.31 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.201 -0.937 . . . . 0.0 110.265 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.592 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 9.0 t -108.47 -158.32 0.65 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.343 -0.848 . . . . 0.0 109.759 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.7 t -107.1 124.44 49.68 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.169 -0.957 . . . . 0.0 110.148 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.663 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -117.88 26.74 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.042 -1.037 . . . . 0.0 110.118 -179.999 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.548 ' CG ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.56 94.6 0.88 Allowed 'General case' 0 C--N 1.292 -1.916 0 O-C-N 121.87 -0.519 . . . . 0.0 110.116 179.671 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 38.3 mtp180 -79.7 61.41 3.66 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.99 -1.069 . . . . 0.0 110.021 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -77.37 100.76 6.06 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.333 -0.854 . . . . 0.0 110.158 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.569 ' OXT' ' CD1' ' A' ' 25' ' ' PHE . 15.8 p90 . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 118.061 -0.971 . . . . 0.0 110.372 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.47 ' O ' ' HG3' ' A' ' 2' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.242 0.544 . . . . 0.0 110.206 . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' A' ' 1' ' ' PHE . 47.9 mtmt -153.78 82.57 1.16 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.276 -0.89 . . . . 0.0 110.237 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.549 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER -77.04 -161.48 0.21 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.209 -0.932 . . . . 0.0 110.588 179.986 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.58 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -141.8 -30.26 0.59 Allowed 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.642 -0.661 . . . . 0.0 111.448 -179.65 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.663 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -120.9 74.04 1.05 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.92 -1.112 . . . . 0.0 111.296 -179.157 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.653 ' HB3' HG12 ' A' ' 18' ' ' ILE . 95.3 m95 -73.54 96.26 2.4 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.1 -1.0 . . . . 0.0 110.088 179.524 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.536 ' HB3' HG11 ' A' ' 21' ' ' VAL . 2.3 tp60 -87.36 109.14 19.33 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.169 -0.957 . . . . 0.0 110.394 -179.842 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 1.065 ' NE1' HD12 ' A' ' 18' ' ' ILE . 54.1 m95 -46.46 103.58 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.179 -0.951 . . . . 0.0 110.383 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.467 ' HD2' ' HB ' ' A' ' 19' ' ' THR . 2.3 mtp-105 -79.19 -179.64 6.84 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.326 -0.859 . . . . 0.0 109.698 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.02 156.74 35.89 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.212 -0.93 . . . . 0.0 109.938 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.502 ' CG ' ' OG ' ' A' ' 17' ' ' SER . 1.2 tmtt? -157.74 165.49 35.24 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.345 -0.847 . . . . 0.0 110.046 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.47 -165.58 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.241 -0.912 . . . . 0.0 109.99 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.473 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -52.34 154.43 2.45 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.462 -0.773 . . . . 0.0 110.355 -179.867 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.425 ' O ' ' HB2' ' A' ' 15' ' ' ALA . . . 112.67 -70.94 0.22 Allowed Glycine 0 N--CA 1.488 2.12 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.971 ' HB1' ' HD2' ' A' ' 16' ' ' PRO . . . -176.19 179.62 0.4 Allowed Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.393 -1.063 . . . . 0.0 110.939 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.971 ' HD2' ' HB1' ' A' ' 15' ' ' ALA . 40.4 Cg_endo -71.24 -176.63 1.97 Allowed 'Trans proline' 0 C--N 1.307 -1.612 0 O-C-N 124.198 1.63 . . . . 0.0 110.562 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.502 ' OG ' ' CG ' ' A' ' 11' ' ' LYS . 0.5 OUTLIER -133.5 96.9 3.81 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.274 -0.891 . . . . 0.0 110.117 179.604 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 1.065 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.9 tt -75.59 115.1 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.175 -0.953 . . . . 0.0 110.097 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.542 ' O ' ' HA ' ' A' ' 6' ' ' TRP . 8.1 m -115.91 170.4 8.51 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.31 -0.869 . . . . 0.0 109.89 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.535 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 5.4 t -78.85 113.2 16.74 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.122 -0.986 . . . . 0.0 110.005 -179.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.663 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -102.91 21.1 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.162 -0.961 . . . . 0.0 109.836 -179.814 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.494 ' HG2' ' NE ' ' A' ' 4' ' ' ARG . 14.9 tpt85 -162.98 86.44 0.55 Allowed 'General case' 0 C--N 1.289 -2.061 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.989 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 25.0 mtt180 -79.14 65.51 4.33 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.924 -1.11 . . . . 0.0 110.126 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.428 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -54.84 111.05 0.74 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.369 -0.832 . . . . 0.0 110.213 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.428 ' C ' ' O ' ' A' ' 24' ' ' ALA . 7.0 m-85 . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 118.003 -0.999 . . . . 0.0 110.326 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.534 ' CE1' ' SG ' ' A' ' 20' ' ' CYS . 7.1 p90 . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.206 0.527 . . . . 0.0 110.19 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.404 ' C ' ' O ' ' A' ' 1' ' ' PHE . 0.0 OUTLIER -44.38 109.05 0.13 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.338 -0.851 . . . . 0.0 110.234 -179.983 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.493 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.5 OUTLIER -106.58 -160.17 0.73 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.262 -0.899 . . . . 0.0 110.509 179.888 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.596 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -175.08 -61.83 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 119.946 -0.701 . . . . 0.0 110.899 -179.9 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.887 ' O ' HG13 ' A' ' 21' ' ' VAL . 0.6 OUTLIER -85.45 53.03 2.62 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.285 -0.885 . . . . 0.0 110.94 -178.98 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.62 ' HB3' HG12 ' A' ' 18' ' ' ILE . 74.9 m95 -46.41 175.39 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.444 -0.785 . . . . 0.0 110.209 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.513 ' O ' ' N ' ' A' ' 9' ' ' ARG . 11.4 tt0 -150.77 93.62 1.98 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.952 -1.093 . . . . 0.0 110.559 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.914 ' NE1' HD12 ' A' ' 18' ' ' ILE . 42.7 m95 -43.32 94.4 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.206 -0.934 . . . . 0.0 109.988 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 7' ' ' GLN . 3.7 mtp180 -78.65 -170.27 2.04 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.097 -1.002 . . . . 0.0 109.815 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -82.63 151.98 26.08 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.19 -0.944 . . . . 0.0 110.171 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.55 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 4.2 tttm -152.39 -150.33 0.33 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.479 -0.763 . . . . 0.0 110.29 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.49 ' O ' ' O ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -52.72 -165.28 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 121.785 0.803 . . . . 0.0 110.814 -179.507 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.467 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -66.59 133.14 49.69 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.482 -0.761 . . . . 0.0 111.177 -179.353 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.54 48.42 8.76 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.891 -1.283 . . . . 0.0 109.891 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.55 ' O ' ' CB ' ' A' ' 11' ' ' LYS . . . -156.97 115.16 1.99 Allowed Pre-proline 0 N--CA 1.49 1.549 0 O-C-N 121.366 -1.079 . . . . 0.0 110.406 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.581 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 46.1 Cg_endo -83.94 -174.61 1.94 Allowed 'Trans proline' 0 C--N 1.307 -1.634 0 O-C-N 123.996 1.524 . . . . 0.0 110.358 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.458 ' OG ' ' HG3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -144.4 93.04 2.37 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.161 -0.962 . . . . 0.0 110.096 179.603 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.914 HD12 ' NE1' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -63.16 111.97 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.168 -0.958 . . . . 0.0 109.67 -179.913 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.544 HG22 ' N ' ' A' ' 20' ' ' CYS . 82.9 m -109.14 173.18 6.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.167 -0.958 . . . . 0.0 110.157 -179.429 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.544 ' N ' HG22 ' A' ' 19' ' ' THR . 52.4 t -79.55 124.28 28.36 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.096 -1.003 . . . . 0.0 109.921 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.887 HG13 ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -136.98 33.64 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 CA-C-O 122.942 1.353 . . . . 0.0 109.068 -179.642 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.524 ' HD3' ' CZ ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -160.83 96.38 1.12 Allowed 'General case' 0 C--N 1.296 -1.75 0 O-C-N 121.075 -1.015 . . . . 0.0 110.017 179.118 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.53 ' O ' ' CG ' ' A' ' 23' ' ' ARG . 23.1 ptt85 -79.62 94.74 5.73 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.235 -0.916 . . . . 0.0 110.275 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -101.03 104.24 15.38 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.322 -0.861 . . . . 0.0 110.136 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.436 ' C ' ' O ' ' A' ' 24' ' ' ALA . 11.2 m-85 . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 117.978 -1.011 . . . . 0.0 110.382 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.241 0.544 . . . . 0.0 110.293 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.439 ' HD2' ' O ' ' A' ' 24' ' ' ALA . 11.2 ptpt -113.44 71.38 0.74 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.215 -0.928 . . . . 0.0 110.246 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -60.77 -158.45 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.361 -0.837 . . . . 0.0 110.493 -179.982 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.528 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -148.83 -34.77 0.2 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 120.001 -0.679 . . . . 0.0 110.769 -179.784 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.675 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.5 OUTLIER -143.59 92.24 2.34 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.063 -1.023 . . . . 0.0 111.224 -179.427 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.675 ' HB3' HG12 ' A' ' 18' ' ' ILE . 68.2 m95 -71.16 105.47 3.41 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.237 -0.914 . . . . 0.0 110.079 179.44 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.569 ' HB3' HG11 ' A' ' 21' ' ' VAL . 32.3 tp60 -89.26 108.22 19.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.053 -1.029 . . . . 0.0 110.367 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 1.06 ' NE1' HD12 ' A' ' 18' ' ' ILE . 59.4 m95 -46.33 103.68 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.283 -0.886 . . . . 0.0 110.547 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.406 ' HB2' ' O ' ' A' ' 17' ' ' SER . 12.1 mtp180 -79.35 -172.1 3.04 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.262 -0.899 . . . . 0.0 109.558 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.476 ' O ' ' HD3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -81.72 151.92 27.28 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.076 -1.015 . . . . 0.0 110.098 -179.755 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.511 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 1.7 tptt -163.27 -154.66 0.29 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.618 -0.676 . . . . 0.0 109.767 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.483 ' HD2' ' HG3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -53.59 -167.72 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.876 179.983 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.12 153.35 21.59 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.273 -0.892 . . . . 0.0 111.427 -179.314 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 49.41 21.61 3.13 Favored Glycine 0 N--CA 1.485 1.941 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.511 ' O ' ' HB3' ' A' ' 11' ' ' LYS . . . -157.11 103.25 1.9 Allowed Pre-proline 0 N--CA 1.492 1.65 0 O-C-N 121.064 -1.257 . . . . 0.0 111.169 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.589 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 43.3 Cg_endo -77.11 -177.09 3.57 Favored 'Trans proline' 0 C--N 1.304 -1.783 0 O-C-N 124.191 1.627 . . . . 0.0 110.255 179.007 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.495 ' OG ' ' CE ' ' A' ' 11' ' ' LYS . 0.3 OUTLIER -134.44 97.13 3.74 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.083 -1.01 . . . . 0.0 110.374 179.552 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 1.06 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.7 tt -77.45 117.73 23.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.099 -1.001 . . . . 0.0 110.316 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.587 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 14.2 t -112.96 -158.1 0.64 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.307 -0.87 . . . . 0.0 109.79 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.7 t -101.55 129.13 47.58 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.229 -0.92 . . . . 0.0 109.919 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.675 HG22 ' O ' ' A' ' 5' ' ' ARG . 0.9 OUTLIER -122.14 25.48 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.025 -1.047 . . . . 0.0 110.153 -179.697 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.528 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.7 94.86 0.88 Allowed 'General case' 0 C--N 1.292 -1.916 0 O-C-N 121.781 -0.575 . . . . 0.0 110.327 179.671 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 23.0 mtm180 -79.92 52.85 1.56 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.991 -1.068 . . . . 0.0 109.777 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.439 ' O ' ' HD2' ' A' ' 2' ' ' LYS . . . -58.63 116.98 4.05 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.465 -0.772 . . . . 0.0 110.271 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.427 ' C ' ' HD2' ' A' ' 2' ' ' LYS . 41.9 m-85 . . . . . 0 N--CA 1.488 1.463 0 CA-C-O 117.943 -1.027 . . . . 0.0 110.319 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.535 ' CD1' ' N ' ' A' ' 2' ' ' LYS . 9.0 t80 . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.266 0.555 . . . . 0.0 110.12 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.535 ' N ' ' CD1' ' A' ' 1' ' ' PHE . 0.7 OUTLIER -140.63 114.3 8.84 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.24 -0.912 . . . . 0.0 110.241 179.961 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.538 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER -82.85 -157.86 0.24 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.229 -0.919 . . . . 0.0 110.495 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.531 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -155.66 -32.43 0.09 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.544 -0.723 . . . . 0.0 111.286 -179.671 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.668 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -136.19 78.38 1.71 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.778 -1.201 . . . . 0.0 111.625 -179.102 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.668 ' HB3' HG12 ' A' ' 18' ' ' ILE . 73.5 m95 -65.94 96.93 0.33 Allowed 'General case' 0 C--N 1.305 -1.355 0 O-C-N 120.961 -1.087 . . . . 0.0 109.64 178.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.536 ' HB3' HG11 ' A' ' 21' ' ' VAL . 28.1 tt0 -84.17 104.41 14.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.114 -0.991 . . . . 0.0 110.415 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 1.03 ' NE1' HD12 ' A' ' 18' ' ' ILE . 49.9 m95 -44.53 105.47 0.06 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.264 -0.897 . . . . 0.0 110.555 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.598 ' CZ ' HG21 ' A' ' 19' ' ' THR . 28.8 mtt180 -79.23 -177.69 5.81 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.23 -0.919 . . . . 0.0 109.386 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.524 ' SD ' ' N ' ' A' ' 10' ' ' MET . 0.0 OUTLIER -107.31 135.29 49.06 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.033 -1.042 . . . . 0.0 110.016 -179.863 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.524 ' CE ' ' O ' ' A' ' 16' ' ' PRO . 0.2 OUTLIER -134.17 -166.92 1.87 Allowed 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.477 -0.764 . . . . 0.0 109.81 179.89 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -59.63 -164.58 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.319 -0.863 . . . . 0.0 109.894 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.6 167.96 4.05 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.477 -0.764 . . . . 0.0 110.52 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.416 ' O ' ' HB2' ' A' ' 15' ' ' ALA . . . 110.01 -70.42 0.21 Allowed Glycine 0 N--CA 1.488 2.156 0 N-CA-C 109.724 -1.35 . . . . 0.0 109.724 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.988 ' HB1' ' HD2' ' A' ' 16' ' ' PRO . . . -176.01 -178.05 0.31 Allowed Pre-proline 0 N--CA 1.492 1.668 0 O-C-N 121.485 -1.009 . . . . 0.0 110.75 -179.778 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.988 ' HD2' ' HB1' ' A' ' 15' ' ' ALA . 44.1 Cg_endo -74.08 179.18 6.01 Favored 'Trans proline' 0 C--N 1.308 -1.591 0 O-C-N 124.051 1.553 . . . . 0.0 110.458 179.678 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -133.88 97.95 4.03 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.264 -0.898 . . . . 0.0 109.847 179.436 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 1.03 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.5 tt -75.4 115.08 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.212 -0.93 . . . . 0.0 110.176 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.598 HG21 ' CZ ' ' A' ' 9' ' ' ARG . 6.9 t -106.86 -159.22 0.69 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.287 -0.883 . . . . 0.0 109.732 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.2 t -107.77 119.22 38.84 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.156 -0.965 . . . . 0.0 110.246 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.668 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.1 m -112.52 28.29 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.162 -0.961 . . . . 0.0 109.806 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.531 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.1 OUTLIER -162.15 126.96 3.32 Favored 'General case' 0 C--N 1.293 -1.891 0 O-C-N 121.918 -0.489 . . . . 0.0 110.019 179.734 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.503 ' HA ' ' CZ ' ' A' ' 1' ' ' PHE . 60.4 mtt85 -105.35 55.06 0.7 Allowed 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.078 -1.013 . . . . 0.0 110.179 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.435 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -71.77 131.66 43.41 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.366 -0.834 . . . . 0.0 110.211 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.435 ' C ' ' O ' ' A' ' 24' ' ' ALA . 12.0 m-85 . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.393 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.457 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.599 0.714 . . . . 0.0 110.545 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.556 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -153.09 -31.8 0.13 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.529 -0.732 . . . . 0.0 111.475 -179.765 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.603 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -146.64 84.41 1.61 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.779 -1.201 . . . . 0.0 111.636 -179.376 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.689 ' HB3' HG12 ' A' ' 18' ' ' ILE . 90.5 m95 -66.06 100.93 0.63 Allowed 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.104 -0.997 . . . . 0.0 109.768 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.573 ' HB3' HG11 ' A' ' 21' ' ' VAL . 28.9 tt0 -87.96 112.45 22.58 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.094 -1.004 . . . . 0.0 110.537 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 1.101 ' NE1' HD12 ' A' ' 18' ' ' ILE . 50.7 m95 -51.01 104.86 0.09 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.304 -0.873 . . . . 0.0 110.419 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.1 mtp180 -79.11 -177.15 5.48 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.247 -0.908 . . . . 0.0 109.709 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -82.9 154.85 24.38 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.154 -0.966 . . . . 0.0 110.232 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.514 ' CD ' ' OG ' ' A' ' 17' ' ' SER . 1.4 mtpt -159.1 -154.74 0.43 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.481 -0.762 . . . . 0.0 110.193 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.508 ' HG3' ' CE ' ' A' ' 11' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.496 1.829 0 CA-C-O 121.784 0.802 . . . . 0.0 110.907 -179.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.485 ' HB2' ' HB3' ' A' ' 8' ' ' TRP . 49.0 Cg_endo . . . . . 0 N--CA 1.483 0.877 0 N-CA-C 110.223 -0.722 . . . . 0.0 110.223 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.514 ' OG ' ' CD ' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -136.89 97.55 3.55 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.131 -0.981 . . . . 0.0 109.936 179.429 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 1.101 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.0 tt -73.96 113.94 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.125 -0.985 . . . . 0.0 110.139 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.543 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 21.2 m -111.73 173.72 6.22 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.361 -0.837 . . . . 0.0 109.752 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.571 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 44.3 t -79.57 118.65 21.61 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.095 -1.003 . . . . 0.0 110.211 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.603 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -108.56 26.78 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.103 -0.998 . . . . 0.0 109.754 -179.958 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.556 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.34 132.95 4.84 Favored 'General case' 0 C--N 1.293 -1.868 0 O-C-N 121.904 -0.497 . . . . 0.0 110.099 179.829 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 1.5 mtp-105 -106.73 54.09 0.68 Allowed 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.073 -1.017 . . . . 0.0 110.037 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.601 0 O-C-N 121.333 -0.854 . . . . 0.0 110.231 179.981 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.616 0.722 . . . . 0.0 110.505 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.558 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -153.12 -32.03 0.13 Allowed 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.347 -179.686 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.613 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -151.22 89.85 1.55 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.731 -1.231 . . . . 0.0 111.769 -179.257 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.688 ' HB3' HG12 ' A' ' 18' ' ' ILE . 88.6 m95 -67.67 98.45 0.7 Allowed 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.207 -0.933 . . . . 0.0 109.773 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.565 ' HB3' HG11 ' A' ' 21' ' ' VAL . 23.1 tt0 -86.06 107.3 17.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.184 -0.947 . . . . 0.0 110.584 -179.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 1.059 ' NE1' HD12 ' A' ' 18' ' ' ILE . 52.9 m95 -45.26 102.79 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.231 -0.918 . . . . 0.0 110.325 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.8 mmm180 -78.96 -171.77 2.77 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.167 -0.958 . . . . 0.0 109.619 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.1 mtp -80.17 152.85 28.98 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.071 -1.018 . . . . 0.0 110.362 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.543 ' CE ' ' HA ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -159.81 -156.67 0.51 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.616 -0.678 . . . . 0.0 109.667 179.667 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' A' ' 11' ' ' LYS . 3.6 mttt . . . . . 0 N--CA 1.493 1.686 0 C-N-CA 119.742 -0.783 . . . . 0.0 109.764 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.576 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.1 Cg_endo . . . . . 0 N--CA 1.48 0.678 0 N-CA-C 110.119 -0.762 . . . . 0.0 110.119 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.516 ' HB2' ' CG ' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -135.48 95.91 3.36 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.094 -1.004 . . . . 0.0 110.135 179.322 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 1.059 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.7 tt -74.75 112.39 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 120.981 -1.074 . . . . 0.0 109.769 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.538 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 7.2 m -111.14 172.84 6.64 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.347 -0.846 . . . . 0.0 109.95 -179.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.577 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 43.4 t -79.55 114.07 18.19 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.239 -0.913 . . . . 0.0 109.868 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.613 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.1 m -103.06 27.19 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.054 -1.029 . . . . 0.0 110.121 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.558 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.44 137.27 6.83 Favored 'General case' 0 C--N 1.291 -1.941 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.186 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 73.5 mtt-85 -108.03 53.86 0.68 Allowed 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.045 -1.034 . . . . 0.0 110.034 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.607 0 O-C-N 121.349 -0.844 . . . . 0.0 110.233 -179.946 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.554 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.657 0.741 . . . . 0.0 110.566 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.582 ' HD3' ' CB ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -154.61 -32.09 0.1 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.607 -0.683 . . . . 0.0 110.959 -179.618 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.69 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.1 OUTLIER -135.01 77.83 1.7 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.812 -1.18 . . . . 0.0 111.426 -179.392 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.673 ' HB3' HG12 ' A' ' 18' ' ' ILE . 91.2 m95 -66.66 108.87 2.62 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.014 -1.054 . . . . 0.0 110.082 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.544 ' HB3' HG11 ' A' ' 21' ' ' VAL . 14.9 tt0 -93.95 112.51 24.36 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.076 -1.015 . . . . 0.0 110.398 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 1.072 ' NE1' HD12 ' A' ' 18' ' ' ILE . 55.5 m95 -52.0 103.67 0.07 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.27 -0.894 . . . . 0.0 110.342 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 70.9 mtp180 -79.14 -179.18 6.55 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.346 -0.847 . . . . 0.0 109.748 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -77.26 156.05 31.69 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.177 -0.952 . . . . 0.0 109.934 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.494 ' CG ' ' N ' ' A' ' 12' ' ' LYS . 14.9 tttt -157.93 169.74 23.91 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.449 -0.782 . . . . 0.0 110.026 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.494 ' N ' ' CG ' ' A' ' 11' ' ' LYS . 4.3 mtmt . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.184 -0.947 . . . . 0.0 109.953 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.588 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 41.0 Cg_endo . . . . . 0 N--CA 1.486 1.088 0 N-CA-C 110.74 -0.523 . . . . 0.0 110.74 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.458 ' OG ' ' HB2' ' A' ' 11' ' ' LYS . 13.1 m -133.49 97.34 3.92 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.332 -0.855 . . . . 0.0 110.035 179.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 1.072 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.0 tt -75.51 115.49 17.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.121 -0.987 . . . . 0.0 110.223 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.576 HG22 ' N ' ' A' ' 20' ' ' CYS . 58.3 m -111.33 175.47 5.41 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.356 -0.84 . . . . 0.0 109.768 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.576 ' N ' HG22 ' A' ' 19' ' ' THR . 48.5 t -79.42 129.53 34.55 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.144 -0.972 . . . . 0.0 110.115 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.69 HG22 ' O ' ' A' ' 5' ' ' ARG . 0.8 OUTLIER -126.56 25.55 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.13 -0.981 . . . . 0.0 110.1 -179.818 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.468 ' HB3' ' HB3' ' A' ' 4' ' ' ARG . 1.7 tpm_? -162.65 159.08 24.03 Favored 'General case' 0 C--N 1.289 -2.023 0 O-C-N 121.801 -0.562 . . . . 0.0 110.321 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.37 155.37 19.18 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.239 -0.913 . . . . 0.0 109.817 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.609 0 O-C-N 121.274 -0.891 . . . . 0.0 110.238 -179.851 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.576 0.703 . . . . 0.0 110.486 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.556 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -146.89 -32.74 0.31 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.543 -0.723 . . . . 0.0 111.255 -179.7 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.65 ' O ' HG22 ' A' ' 21' ' ' VAL . 17.6 ttm-85 -150.6 92.07 1.81 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.859 -1.151 . . . . 0.0 111.589 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.691 ' HB3' HG12 ' A' ' 18' ' ' ILE . 82.0 m95 -70.39 106.84 3.54 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.286 -0.884 . . . . 0.0 110.049 179.165 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.556 ' HB3' HG11 ' A' ' 21' ' ' VAL . 23.7 tt0 -92.21 109.28 20.65 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.199 -0.938 . . . . 0.0 110.464 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 1.075 ' NE1' HD12 ' A' ' 18' ' ' ILE . 54.2 m95 -48.84 103.68 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.27 -0.894 . . . . 0.0 110.512 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.507 ' HG3' ' CG2' ' A' ' 19' ' ' THR . 1.0 OUTLIER -79.15 -174.72 4.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.19 -0.944 . . . . 0.0 109.603 179.702 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 mtt -82.74 153.63 25.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.084 -1.01 . . . . 0.0 110.275 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.524 ' CD ' ' HB3' ' A' ' 17' ' ' SER . 0.1 OUTLIER -158.0 -155.55 0.51 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.474 -0.766 . . . . 0.0 110.102 179.818 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.493 ' O ' ' O ' ' A' ' 11' ' ' LYS . 6.1 mtmt . . . . . 0 N--CA 1.494 1.748 0 CA-C-O 121.77 0.795 . . . . 0.0 110.73 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.56 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.6 Cg_endo . . . . . 0 N--CA 1.482 0.829 0 N-CA-C 110.252 -0.711 . . . . 0.0 110.252 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.524 ' HB3' ' CD ' ' A' ' 11' ' ' LYS . 0.2 OUTLIER -138.74 95.59 3.0 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.189 -0.944 . . . . 0.0 110.038 179.621 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 1.075 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.7 tt -74.53 117.57 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.161 -0.962 . . . . 0.0 110.111 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.542 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 0.2 OUTLIER -116.82 177.09 4.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.236 -0.915 . . . . 0.0 110.077 -179.936 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 50.9 t -79.97 118.21 21.5 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.315 -0.866 . . . . 0.0 109.558 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.65 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -109.48 24.97 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.02 -1.05 . . . . 0.0 110.147 -179.475 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.556 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.86 113.44 1.45 Allowed 'General case' 0 C--N 1.292 -1.929 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.123 179.638 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.3 mtt85 -95.09 55.07 1.75 Allowed 'General case' 0 C--N 1.302 -1.473 0 O-C-N 120.92 -1.113 . . . . 0.0 110.137 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.57 0 O-C-N 121.309 -0.869 . . . . 0.0 110.208 -179.948 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.526 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.599 0.714 . . . . 0.0 110.529 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.583 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -143.23 -33.42 0.44 Allowed 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.605 -0.685 . . . . 0.0 111.258 -179.581 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.583 ' N ' ' CD ' ' A' ' 4' ' ' ARG . 1.5 tpm_? -117.3 75.83 1.01 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.977 -1.077 . . . . 0.0 111.001 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.673 ' HB3' HG12 ' A' ' 18' ' ' ILE . 69.3 m95 -74.27 97.87 3.09 Favored 'General case' 0 C--N 1.306 -1.316 0 O-C-N 121.229 -0.919 . . . . 0.0 110.337 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.541 ' HB3' HG11 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -85.95 101.67 13.09 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.17 -0.956 . . . . 0.0 110.251 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.996 ' NE1' HD12 ' A' ' 18' ' ' ILE . 52.3 m95 -41.75 104.42 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.278 -0.888 . . . . 0.0 110.618 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.713 ' HD2' HG21 ' A' ' 19' ' ' THR . 7.6 mtp180 -79.22 -172.41 3.15 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.173 -0.954 . . . . 0.0 109.454 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.9 mmt -85.6 154.77 21.48 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.039 -1.038 . . . . 0.0 110.215 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.524 ' CD ' ' OG ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -158.77 -155.12 0.46 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.497 -0.752 . . . . 0.0 110.179 179.802 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.493 ' O ' ' O ' ' A' ' 11' ' ' LYS . 2.3 mtmp? . . . . . 0 N--CA 1.496 1.828 0 CA-C-O 121.801 0.81 . . . . 0.0 110.771 -179.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.571 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.9 Cg_endo . . . . . 0 N--CA 1.483 0.865 0 N-CA-C 110.225 -0.721 . . . . 0.0 110.225 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.524 ' OG ' ' CD ' ' A' ' 11' ' ' LYS . 0.3 OUTLIER -137.16 95.91 3.19 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.252 -0.905 . . . . 0.0 110.088 179.567 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.996 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.2 tt -75.77 115.25 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.1 -1.0 . . . . 0.0 110.132 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.713 HG21 ' HD2' ' A' ' 9' ' ' ARG . 11.9 t -112.6 -153.39 0.52 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.181 -0.95 . . . . 0.0 109.855 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.1 t -112.15 114.28 27.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.023 -1.048 . . . . 0.0 109.98 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 21' ' ' VAL . 0.8 OUTLIER -107.65 21.91 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.12 -0.987 . . . . 0.0 109.913 -179.733 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.545 ' HD3' ' NE ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.82 89.15 0.64 Allowed 'General case' 0 C--N 1.29 -1.983 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.025 179.854 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 14.4 mtt180 -79.61 76.24 6.25 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.043 -1.035 . . . . 0.0 110.143 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.326 -0.859 . . . . 0.0 110.236 179.954 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.595 0.712 . . . . 0.0 110.485 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.556 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -149.95 -34.65 0.17 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.558 -0.714 . . . . 0.0 111.055 -179.905 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.624 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.4 OUTLIER -152.52 91.38 1.57 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.994 -1.066 . . . . 0.0 111.212 -179.466 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.694 ' HB3' HG12 ' A' ' 18' ' ' ILE . 83.1 m95 -63.73 121.98 15.29 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.27 -0.893 . . . . 0.0 110.166 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.642 ' HB3' HG11 ' A' ' 21' ' ' VAL . 2.6 tt0 -104.38 124.06 48.54 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.174 -0.953 . . . . 0.0 110.221 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 1.1 ' NE1' HD12 ' A' ' 18' ' ' ILE . 64.6 m95 -61.72 106.26 0.65 Allowed 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.217 -0.927 . . . . 0.0 110.441 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -79.4 -177.06 5.56 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.352 -0.843 . . . . 0.0 109.815 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.01 153.49 21.24 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.197 -0.939 . . . . 0.0 109.749 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.519 ' CD ' ' OG ' ' A' ' 17' ' ' SER . 0.1 OUTLIER -162.9 -153.92 0.27 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.369 -0.832 . . . . 0.0 110.503 -179.741 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.516 ' O ' ' O ' ' A' ' 11' ' ' LYS . 1.3 mtpp . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 121.6 0.714 . . . . 0.0 110.578 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.585 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 42.8 Cg_endo . . . . . 0 N--CA 1.483 0.892 0 N-CA-C 110.809 -0.496 . . . . 0.0 110.809 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.519 ' OG ' ' CD ' ' A' ' 11' ' ' LYS . 2.7 m -135.58 96.73 3.51 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.374 -0.829 . . . . 0.0 110.077 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 1.1 HD12 ' NE1' ' A' ' 8' ' ' TRP . 3.7 tt -74.0 118.28 19.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.163 -0.961 . . . . 0.0 110.301 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.567 HG22 ' H ' ' A' ' 20' ' ' CYS . 26.8 m -112.45 177.49 4.62 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.291 -0.881 . . . . 0.0 109.853 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.567 ' H ' HG22 ' A' ' 19' ' ' THR . 42.9 t -79.43 118.3 21.18 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.14 -0.975 . . . . 0.0 109.983 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.642 HG11 ' HB3' ' A' ' 7' ' ' GLN . 0.9 OUTLIER -106.21 27.39 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.046 -1.034 . . . . 0.0 109.855 -179.77 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.556 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.24 134.36 5.56 Favored 'General case' 0 C--N 1.293 -1.885 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.144 179.826 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.2 mtt85 -108.2 54.27 0.67 Allowed 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.026 -1.046 . . . . 0.0 110.165 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.596 0 O-C-N 121.314 -0.866 . . . . 0.0 110.233 -179.948 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.611 0.72 . . . . 0.0 110.551 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.549 ' CZ ' ' HD2' ' A' ' 22' ' ' ARG . 0.6 OUTLIER -152.89 -30.31 0.14 Allowed 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 119.943 -0.703 . . . . 0.0 111.713 -179.545 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.58 ' O ' HG22 ' A' ' 21' ' ' VAL . 9.1 mtt-85 -135.56 77.49 1.67 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.742 -1.224 . . . . 0.0 111.534 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.684 ' HB3' HG12 ' A' ' 18' ' ' ILE . 87.6 m95 -66.17 99.26 0.51 Allowed 'General case' 0 C--N 1.305 -1.326 0 O-C-N 121.068 -1.02 . . . . 0.0 109.975 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.577 ' HB3' HG11 ' A' ' 21' ' ' VAL . 2.4 tt0 -85.84 109.21 18.53 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.158 -0.964 . . . . 0.0 110.589 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 1.065 ' NE1' HD12 ' A' ' 18' ' ' ILE . 49.2 m95 -48.07 102.6 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.255 -0.903 . . . . 0.0 110.585 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.457 ' HD2' ' HB ' ' A' ' 19' ' ' THR . 0.3 OUTLIER -78.98 -176.82 5.25 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.136 -0.978 . . . . 0.0 109.588 179.699 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.425 ' O ' ' OG ' ' A' ' 17' ' ' SER . 2.2 mtm -79.28 154.24 29.3 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.957 -1.089 . . . . 0.0 110.26 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.527 ' CG ' ' HB3' ' A' ' 17' ' ' SER . 0.1 OUTLIER -157.41 -155.77 0.54 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.413 -0.805 . . . . 0.0 110.088 179.8 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.49 ' HD2' ' HD2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 121.79 0.805 . . . . 0.0 110.683 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.555 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.6 Cg_endo . . . . . 0 N--CA 1.482 0.795 0 N-CA-C 110.208 -0.728 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.527 ' HB3' ' CG ' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -136.87 95.92 3.21 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.153 -0.967 . . . . 0.0 110.069 179.554 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 1.065 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.7 tt -74.51 114.72 14.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.048 -1.032 . . . . 0.0 110.136 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.55 HG22 ' N ' ' A' ' 20' ' ' CYS . 33.0 m -115.34 176.2 5.18 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.358 -0.839 . . . . 0.0 109.707 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.55 ' N ' HG22 ' A' ' 19' ' ' THR . 47.7 t -79.4 123.96 28.0 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.091 -1.006 . . . . 0.0 110.218 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.58 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.3 m -113.07 22.18 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.183 -0.948 . . . . 0.0 110.11 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.549 ' HD2' ' CZ ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.93 145.07 10.31 Favored 'General case' 0 C--N 1.291 -1.97 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.061 179.531 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 26.3 ptt85 -118.69 59.26 0.82 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.104 -0.998 . . . . 0.0 110.154 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.245 -0.909 . . . . 0.0 110.219 -179.962 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.535 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.568 0.699 . . . . 0.0 110.508 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.55 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -150.12 -31.72 0.2 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.6 -0.688 . . . . 0.0 111.318 -179.703 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.619 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -144.03 81.37 1.68 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 120.836 -1.165 . . . . 0.0 111.518 -179.394 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.682 ' HB3' HG12 ' A' ' 18' ' ' ILE . 91.3 m95 -66.19 101.54 0.73 Allowed 'General case' 0 C--N 1.306 -1.316 0 O-C-N 121.035 -1.041 . . . . 0.0 109.931 179.116 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.55 ' HB3' HG11 ' A' ' 21' ' ' VAL . 21.4 tt0 -88.95 113.23 24.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.108 -0.995 . . . . 0.0 110.624 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 1.104 ' NE1' HD12 ' A' ' 18' ' ' ILE . 52.6 m95 -51.63 106.47 0.14 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.258 -0.901 . . . . 0.0 110.444 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.8 mtp180 -79.21 -178.43 6.18 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.252 -0.905 . . . . 0.0 109.816 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.4 mtm -83.11 154.99 24.07 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.149 -0.969 . . . . 0.0 110.196 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -160.72 -155.04 0.4 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.488 -0.758 . . . . 0.0 110.227 179.934 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 11' ' ' LYS . 1.2 mtpt . . . . . 0 N--CA 1.495 1.802 0 CA-C-O 121.804 0.812 . . . . 0.0 110.96 -179.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.487 ' HB2' ' HB3' ' A' ' 8' ' ' TRP . 48.4 Cg_endo . . . . . 0 N--CA 1.482 0.833 0 N-CA-C 110.215 -0.725 . . . . 0.0 110.215 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.474 ' CB ' ' HG3' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -136.67 97.83 3.64 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.162 -0.961 . . . . 0.0 109.894 179.345 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 1.104 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.1 tt -73.82 114.21 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.081 -1.012 . . . . 0.0 110.063 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.543 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 24.7 m -111.57 173.92 6.12 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.36 -0.837 . . . . 0.0 109.674 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.574 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 51.5 t -79.55 121.39 25.18 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.085 -1.009 . . . . 0.0 110.153 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.619 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -112.83 25.33 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.091 -1.006 . . . . 0.0 109.926 -179.921 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.55 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.63 93.96 0.85 Allowed 'General case' 0 C--N 1.292 -1.913 0 O-C-N 121.912 -0.492 . . . . 0.0 110.187 179.917 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -79.76 59.01 2.96 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.001 -1.062 . . . . 0.0 110.044 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.359 -0.838 . . . . 0.0 110.227 -179.9 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.523 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.617 0.722 . . . . 0.0 110.531 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.533 ' CG ' ' HD2' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -155.9 -32.18 0.09 Allowed 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.901 -0.72 . . . . 0.0 111.193 -179.729 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.67 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -136.67 78.88 1.73 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.923 -1.111 . . . . 0.0 111.623 -179.202 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.654 ' HB3' HG12 ' A' ' 18' ' ' ILE . 73.2 m95 -66.1 97.21 0.36 Allowed 'General case' 0 C--N 1.305 -1.327 0 O-C-N 120.994 -1.066 . . . . 0.0 109.625 178.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.533 ' HB3' HG11 ' A' ' 21' ' ' VAL . 31.0 tp60 -84.74 104.39 14.67 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.055 -1.028 . . . . 0.0 110.367 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 1.034 ' NE1' HD12 ' A' ' 18' ' ' ILE . 55.0 m95 -43.14 105.58 0.05 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.275 -0.891 . . . . 0.0 110.399 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.418 ' HG3' HG22 ' A' ' 19' ' ' THR . 5.2 mtp180 -79.31 179.91 7.14 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.283 -0.885 . . . . 0.0 109.721 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.48 ' O ' ' HD3' ' A' ' 11' ' ' LYS . 7.4 mtm -78.32 155.61 30.04 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.161 -0.962 . . . . 0.0 109.854 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.48 ' HD3' ' O ' ' A' ' 10' ' ' MET . 0.6 OUTLIER -157.19 171.65 20.04 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.294 -0.879 . . . . 0.0 110.08 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 O-C-N 121.198 -0.939 . . . . 0.0 110.082 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.583 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 41.6 Cg_endo . . . . . 0 N--CA 1.487 1.113 0 N-CA-C 110.629 -0.566 . . . . 0.0 110.629 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.467 ' OG ' ' CE ' ' A' ' 11' ' ' LYS . 0.4 OUTLIER -133.26 97.36 3.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.36 -0.837 . . . . 0.0 110.001 179.477 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 1.034 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.5 tt -76.27 115.74 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.221 -0.924 . . . . 0.0 110.286 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.592 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 9.3 t -107.25 -158.24 0.65 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.281 -0.887 . . . . 0.0 109.773 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.4 t -108.11 120.04 41.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.21 -0.931 . . . . 0.0 110.4 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.67 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -113.11 28.36 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.111 -0.993 . . . . 0.0 109.778 179.897 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.533 ' HD2' ' CG ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.2 128.91 3.69 Favored 'General case' 0 C--N 1.292 -1.901 0 O-C-N 121.945 -0.472 . . . . 0.0 110.08 179.81 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 53.8 mtp85 -105.44 55.1 0.69 Allowed 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.031 -1.043 . . . . 0.0 110.175 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.596 0 O-C-N 121.3 -0.875 . . . . 0.0 110.223 179.943 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.453 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 121.574 0.702 . . . . 0.0 110.552 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.546 ' HB3' ' CG ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -160.91 -31.81 0.05 Allowed 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 119.782 -0.767 . . . . 0.0 111.308 -179.682 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.652 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.2 OUTLIER -136.96 80.23 1.8 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.763 -1.211 . . . . 0.0 111.677 -179.183 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.67 ' HB3' HG12 ' A' ' 18' ' ' ILE . 73.1 m95 -65.76 97.19 0.32 Allowed 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.068 -1.02 . . . . 0.0 109.594 178.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.528 ' HB3' HG11 ' A' ' 21' ' ' VAL . 1.5 tt0 -82.84 105.05 13.54 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.071 -1.018 . . . . 0.0 110.489 -179.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 1.008 ' NE1' HD12 ' A' ' 18' ' ' ILE . 48.6 m95 -46.94 106.17 0.08 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.337 -0.852 . . . . 0.0 110.46 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.7 mtp180 -79.2 -177.59 5.74 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 109.718 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 6.8 mtm -83.69 155.47 23.11 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.058 -1.026 . . . . 0.0 110.237 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.494 ' HG3' ' CB ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -160.41 -154.87 0.4 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.457 -0.777 . . . . 0.0 110.202 179.861 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.49 ' O ' ' O ' ' A' ' 11' ' ' LYS . 6.4 mttt . . . . . 0 N--CA 1.495 1.805 0 CA-C-O 121.783 0.801 . . . . 0.0 110.82 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.476 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.7 Cg_endo . . . . . 0 N--CA 1.483 0.867 0 N-CA-C 110.192 -0.734 . . . . 0.0 110.192 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.494 ' CB ' ' HG3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -134.46 98.21 4.02 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.165 -0.96 . . . . 0.0 109.856 179.423 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 1.008 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.3 tt -75.93 114.77 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.103 -0.998 . . . . 0.0 110.288 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.592 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 6.7 t -107.48 -159.38 0.69 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.32 -0.863 . . . . 0.0 109.675 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.6 t -107.27 122.79 47.25 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.194 -0.941 . . . . 0.0 110.129 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.652 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -116.45 28.79 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.018 -1.051 . . . . 0.0 110.013 179.981 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.546 ' CG ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.09 143.84 11.01 Favored 'General case' 0 C--N 1.294 -1.828 0 O-C-N 121.808 -0.557 . . . . 0.0 110.099 179.578 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -104.3 55.05 0.72 Allowed 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.154 -0.966 . . . . 0.0 110.19 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.653 0 O-C-N 121.345 -0.847 . . . . 0.0 110.17 -179.962 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.459 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.604 0.716 . . . . 0.0 110.523 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.56 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -151.48 -32.48 0.15 Allowed 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 119.864 -0.734 . . . . 0.0 111.203 -179.782 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.612 ' O ' HG22 ' A' ' 21' ' ' VAL . 24.6 ttm-85 -150.72 89.9 1.59 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.898 -1.126 . . . . 0.0 111.592 -179.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.675 ' HB3' HG12 ' A' ' 18' ' ' ILE . 86.1 m95 -67.67 99.86 0.84 Allowed 'General case' 0 C--N 1.307 -1.259 0 O-C-N 121.109 -0.994 . . . . 0.0 109.943 179.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.573 ' HB3' HG11 ' A' ' 21' ' ' VAL . 15.4 tt0 -85.97 109.57 18.86 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.146 -0.971 . . . . 0.0 110.471 -179.6 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 1.058 ' NE1' HD12 ' A' ' 18' ' ' ILE . 56.5 m95 -47.46 107.05 0.1 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.305 -0.872 . . . . 0.0 110.371 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 29.0 mtt180 -79.42 178.91 7.76 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.288 -0.882 . . . . 0.0 109.785 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.97 155.22 27.77 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.149 -0.969 . . . . 0.0 109.914 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.484 ' HD3' ' N ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -157.28 175.74 13.62 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.385 -0.822 . . . . 0.0 110.112 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.484 ' N ' ' HD3' ' A' ' 11' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.208 -0.933 . . . . 0.0 110.077 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.582 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 41.7 Cg_endo . . . . . 0 N--CA 1.487 1.132 0 N-CA-C 110.766 -0.513 . . . . 0.0 110.766 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.445 ' OG ' ' HB2' ' A' ' 11' ' ' LYS . 75.5 m -133.92 97.16 3.81 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.301 -0.874 . . . . 0.0 110.002 179.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 1.058 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.0 tt -75.78 116.9 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.122 -0.986 . . . . 0.0 110.465 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.572 HG22 ' N ' ' A' ' 20' ' ' CYS . 62.9 m -114.69 174.99 5.69 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.331 -0.856 . . . . 0.0 109.658 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.572 ' N ' HG22 ' A' ' 19' ' ' THR . 42.9 t -79.59 122.04 26.01 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.111 -0.993 . . . . 0.0 110.27 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.612 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.1 m -110.33 25.77 3.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.105 -0.997 . . . . 0.0 109.868 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.56 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.45 137.21 6.79 Favored 'General case' 0 C--N 1.293 -1.856 0 O-C-N 121.851 -0.53 . . . . 0.0 110.164 179.829 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 41.8 mtt-85 -106.44 53.13 0.71 Allowed 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.186 -0.946 . . . . 0.0 109.981 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.399 -0.813 . . . . 0.0 110.23 -179.857 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.521 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.629 0.728 . . . . 0.0 110.472 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.586 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -174.76 -64.38 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.919 -0.712 . . . . 0.0 110.902 -179.895 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.883 ' O ' HG13 ' A' ' 21' ' ' VAL . 4.3 ttt180 -84.06 53.85 2.74 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.256 -0.903 . . . . 0.0 110.958 -179.075 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.634 ' HB3' HG12 ' A' ' 18' ' ' ILE . 72.7 m95 -46.84 176.39 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.373 -0.829 . . . . 0.0 110.18 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 32.4 tt0 -151.53 95.27 2.11 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.051 -1.031 . . . . 0.0 110.55 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.901 ' NE1' HD12 ' A' ' 18' ' ' ILE . 52.8 m95 -45.12 111.63 0.35 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.236 -0.915 . . . . 0.0 110.034 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.492 ' O ' ' HA ' ' A' ' 16' ' ' PRO . 0.5 OUTLIER -79.42 -173.24 3.61 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.058 -1.026 . . . . 0.0 109.873 179.814 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 6.6 mtt -99.89 163.19 12.56 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.198 -0.939 . . . . 0.0 110.027 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.471 ' O ' ' O ' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -175.02 -152.52 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.168 -0.957 . . . . 0.0 111.178 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.471 ' O ' ' O ' ' A' ' 11' ' ' LYS . 6.3 mttm . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 122.088 0.947 . . . . 0.0 111.952 -178.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.498 ' HB2' ' HB3' ' A' ' 8' ' ' TRP . 42.6 Cg_endo . . . . . 0 N--CA 1.485 1.011 0 CA-C-O 121.461 0.525 . . . . 0.0 110.891 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.3 m -144.19 96.21 2.85 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.483 -0.761 . . . . 0.0 109.644 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.901 HD12 ' NE1' ' A' ' 8' ' ' TRP . 0.7 OUTLIER -60.46 113.35 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.25 -0.906 . . . . 0.0 110.003 -179.315 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.558 HG22 ' N ' ' A' ' 20' ' ' CYS . 85.3 m -106.19 173.52 6.28 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.247 -0.908 . . . . 0.0 109.972 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.558 ' N ' HG22 ' A' ' 19' ' ' THR . 50.7 t -79.71 124.55 28.68 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.133 -0.979 . . . . 0.0 110.099 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.883 HG13 ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -137.14 33.54 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 CA-C-O 122.834 1.302 . . . . 0.0 109.138 -179.55 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.552 ' CG ' ' HB3' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -161.09 96.15 1.08 Allowed 'General case' 0 C--N 1.296 -1.747 0 O-C-N 121.105 -0.997 . . . . 0.0 110.191 179.342 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.4 mtt-85 -79.82 90.35 5.27 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.286 -0.884 . . . . 0.0 110.269 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.595 0 O-C-N 121.288 -0.883 . . . . 0.0 110.272 -179.998 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.666 0.746 . . . . 0.0 110.536 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.561 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -149.83 -33.15 0.19 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.507 -0.745 . . . . 0.0 111.142 -179.737 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.583 ' O ' HG22 ' A' ' 21' ' ' VAL . 1.5 tmm_? -152.87 92.52 1.65 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.795 -1.19 . . . . 0.0 111.673 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.688 ' HB3' HG12 ' A' ' 18' ' ' ILE . 83.6 m95 -67.62 102.1 1.12 Allowed 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.244 -0.91 . . . . 0.0 109.838 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.581 ' HB3' HG11 ' A' ' 21' ' ' VAL . 5.6 tp-100 -88.21 109.54 20.0 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.181 -0.949 . . . . 0.0 110.346 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 1.071 ' NE1' HD12 ' A' ' 18' ' ' ILE . 59.1 m95 -47.01 107.64 0.12 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.193 -0.942 . . . . 0.0 110.318 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -79.51 179.19 7.6 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.301 -0.875 . . . . 0.0 109.786 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.5 153.89 23.03 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.264 -0.897 . . . . 0.0 109.754 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.499 ' O ' ' O ' ' A' ' 12' ' ' LYS . 4.4 tptt -163.07 -154.35 0.29 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.341 -0.85 . . . . 0.0 110.614 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.499 ' O ' ' O ' ' A' ' 11' ' ' LYS . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 121.637 0.732 . . . . 0.0 110.646 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.585 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 42.8 Cg_endo . . . . . 0 N--CA 1.483 0.907 0 CA-C-O 121.36 0.483 . . . . 0.0 110.854 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.443 ' OG ' ' CG ' ' A' ' 11' ' ' LYS . 73.9 m -133.86 96.97 3.77 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.408 -0.808 . . . . 0.0 109.986 179.526 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 1.071 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.1 tt -75.65 117.13 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.203 -0.935 . . . . 0.0 110.397 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.557 HG22 ' N ' ' A' ' 20' ' ' CYS . 32.1 m -115.57 176.49 5.05 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.434 -0.791 . . . . 0.0 109.669 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.557 ' N ' HG22 ' A' ' 19' ' ' THR . 42.4 t -79.62 123.3 27.5 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.072 -1.018 . . . . 0.0 110.21 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.583 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.2 m -111.06 25.61 3.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.181 -0.949 . . . . 0.0 109.907 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.561 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.2 OUTLIER -162.63 137.27 6.62 Favored 'General case' 0 C--N 1.292 -1.903 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.128 179.691 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.5 mtp180 -107.14 53.33 0.69 Allowed 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.15 -0.969 . . . . 0.0 110.063 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.436 -0.79 . . . . 0.0 110.237 179.996 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.456 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.489 0.661 . . . . 0.0 110.507 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.564 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -149.9 -34.61 0.17 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 119.945 -0.702 . . . . 0.0 111.069 -179.852 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.554 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.5 OUTLIER -152.63 89.85 1.44 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.945 -1.097 . . . . 0.0 111.347 -179.475 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.693 ' HB3' HG12 ' A' ' 18' ' ' ILE . 85.1 m95 -63.55 112.32 2.74 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.254 -0.904 . . . . 0.0 110.358 179.483 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.502 ' O ' ' CG ' ' A' ' 7' ' ' GLN . 14.1 pt20 -94.22 117.79 30.63 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.174 -0.954 . . . . 0.0 110.552 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 1.1 ' NE1' HD12 ' A' ' 18' ' ' ILE . 56.9 m95 -57.17 105.46 0.23 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.208 -0.933 . . . . 0.0 110.315 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 -79.19 -178.69 6.31 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.222 -0.924 . . . . 0.0 109.817 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 5.2 mtp -81.69 155.08 25.74 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.209 -0.932 . . . . 0.0 109.911 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.461 ' HG3' ' OG ' ' A' ' 17' ' ' SER . 0.8 OUTLIER -157.76 174.21 15.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.311 -0.868 . . . . 0.0 110.063 179.832 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.138 -0.976 . . . . 0.0 110.092 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.58 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 40.9 Cg_endo . . . . . 0 N--CA 1.487 1.124 0 N-CA-C 110.729 -0.527 . . . . 0.0 110.729 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.461 ' OG ' ' HG3' ' A' ' 11' ' ' LYS . 4.8 m -134.26 97.05 3.74 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.378 -0.826 . . . . 0.0 109.985 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 1.1 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.8 tt -75.17 117.35 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.18 -0.95 . . . . 0.0 110.347 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.542 HG22 ' N ' ' A' ' 20' ' ' CYS . 30.5 m -112.87 176.12 5.15 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.38 -0.825 . . . . 0.0 109.668 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.542 ' N ' HG22 ' A' ' 19' ' ' THR . 43.6 t -79.71 123.91 28.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.118 -0.989 . . . . 0.0 110.206 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.2 m -110.6 25.38 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.028 -1.045 . . . . 0.0 110.055 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.564 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 7.2 tpt85 -162.43 138.28 7.38 Favored 'General case' 0 C--N 1.293 -1.878 0 O-C-N 121.799 -0.563 . . . . 0.0 110.283 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.2 mtm-85 -109.91 53.28 0.7 Allowed 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.08 -1.013 . . . . 0.0 110.051 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.405 -0.809 . . . . 0.0 110.233 -179.918 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 t . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.609 0.718 . . . . 0.0 110.37 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.562 ' HG3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -144.54 -32.56 0.41 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.577 -0.702 . . . . 0.0 111.098 -179.669 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.822 ' O ' HG22 ' A' ' 21' ' ' VAL . 2.7 ttt180 -146.32 96.77 2.83 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.988 -1.07 . . . . 0.0 110.653 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.613 ' HB3' HG12 ' A' ' 18' ' ' ILE . 70.5 m95 -68.97 169.38 11.82 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.277 -0.889 . . . . 0.0 110.403 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.655 ' CB ' HG11 ' A' ' 21' ' ' VAL . 2.9 tt0 -146.44 93.31 2.28 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.228 -0.92 . . . . 0.0 109.836 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.922 ' NE1' HD12 ' A' ' 18' ' ' ILE . 42.7 m95 -39.7 95.42 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.378 -0.826 . . . . 0.0 110.638 -179.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.514 ' O ' ' N ' ' A' ' 17' ' ' SER . 17.0 mtp-105 -78.87 -170.51 2.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.305 -0.872 . . . . 0.0 109.537 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.423 ' O ' ' HD2' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -82.66 152.51 25.81 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.151 -0.968 . . . . 0.0 110.233 -179.648 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.518 ' CE ' ' HA ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -148.64 -151.12 0.38 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.464 -0.772 . . . . 0.0 110.167 179.736 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.48 ' O ' ' O ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.838 0 CA-C-O 121.849 0.833 . . . . 0.0 110.952 -179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.551 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 50.3 Cg_endo . . . . . 0 C--O 1.216 -0.617 0 N-CA-C 110.162 -0.745 . . . . 0.0 110.162 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.514 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.3 OUTLIER -146.95 93.3 2.25 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.115 -0.99 . . . . 0.0 109.943 179.505 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.922 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.0 OUTLIER -63.9 114.15 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.153 -0.967 . . . . 0.0 109.821 -179.657 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.539 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 22.7 m -120.61 174.37 6.61 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.32 -0.863 . . . . 0.0 109.927 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.489 ' N ' HG22 ' A' ' 19' ' ' THR . 23.9 t -79.27 122.51 26.41 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.093 -1.005 . . . . 0.0 109.856 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.822 HG22 ' O ' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -111.06 23.28 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.126 -0.984 . . . . 0.0 109.655 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.562 ' CB ' ' HG3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.07 89.68 0.72 Allowed 'General case' 0 C--N 1.292 -1.893 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.008 179.792 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 22.9 mtt180 -79.72 59.84 3.19 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.039 -1.038 . . . . 0.0 110.004 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.583 0 O-C-N 121.39 -0.818 . . . . 0.0 110.271 -179.996 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.542 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.596 0.713 . . . . 0.0 110.537 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.548 ' HB3' ' CG ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -153.07 -33.24 0.12 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.599 -0.688 . . . . 0.0 111.082 -179.704 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.663 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -136.31 79.93 1.79 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.856 -1.153 . . . . 0.0 111.545 -178.969 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.658 ' HB3' HG12 ' A' ' 18' ' ' ILE . 72.9 m95 -67.01 97.16 0.48 Allowed 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.093 -1.004 . . . . 0.0 109.68 179.036 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.52 ' HB3' HG11 ' A' ' 21' ' ' VAL . 6.4 tt0 -84.21 103.69 13.63 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.12 -0.988 . . . . 0.0 110.374 -179.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 1.03 ' NE1' HD12 ' A' ' 18' ' ' ILE . 54.7 m95 -42.69 105.76 0.05 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.231 -0.918 . . . . 0.0 110.415 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.45 ' HD2' HG21 ' A' ' 19' ' ' THR . 4.4 mtt180 -79.25 179.41 7.41 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.277 -0.89 . . . . 0.0 109.67 179.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 6.6 mtm -76.99 156.36 31.94 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.172 -0.955 . . . . 0.0 109.945 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.489 ' HG3' ' CB ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -157.59 168.68 26.57 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.344 -0.847 . . . . 0.0 109.993 179.924 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.9 mtmt . . . . . 0 N--CA 1.491 1.601 0 O-C-N 121.198 -0.939 . . . . 0.0 109.964 179.902 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.585 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 41.7 Cg_endo . . . . . 0 N--CA 1.486 1.063 0 N-CA-C 110.661 -0.553 . . . . 0.0 110.661 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.489 ' CB ' ' HG3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -133.05 97.39 3.99 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.239 -0.913 . . . . 0.0 109.953 179.56 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 1.03 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.5 tt -76.69 116.31 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.201 -0.937 . . . . 0.0 110.265 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.592 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 9.0 t -108.47 -158.32 0.65 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.343 -0.848 . . . . 0.0 109.759 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.7 t -107.1 124.44 49.68 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.169 -0.957 . . . . 0.0 110.148 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.663 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -117.88 26.74 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.042 -1.037 . . . . 0.0 110.118 -179.999 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.548 ' CG ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.56 94.6 0.88 Allowed 'General case' 0 C--N 1.292 -1.916 0 O-C-N 121.87 -0.519 . . . . 0.0 110.116 179.671 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 38.3 mtp180 -79.7 61.41 3.66 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.99 -1.069 . . . . 0.0 110.021 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.613 0 O-C-N 121.333 -0.854 . . . . 0.0 110.158 179.98 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.549 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.595 0.712 . . . . 0.0 110.588 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.58 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -141.8 -30.26 0.59 Allowed 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.642 -0.661 . . . . 0.0 111.448 -179.65 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.663 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -120.9 74.04 1.05 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.92 -1.112 . . . . 0.0 111.296 -179.157 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.653 ' HB3' HG12 ' A' ' 18' ' ' ILE . 95.3 m95 -73.54 96.26 2.4 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.1 -1.0 . . . . 0.0 110.088 179.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.536 ' HB3' HG11 ' A' ' 21' ' ' VAL . 2.3 tp60 -87.36 109.14 19.33 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.169 -0.957 . . . . 0.0 110.394 -179.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 1.065 ' NE1' HD12 ' A' ' 18' ' ' ILE . 54.1 m95 -46.46 103.58 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.179 -0.951 . . . . 0.0 110.383 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.467 ' HD2' ' HB ' ' A' ' 19' ' ' THR . 2.3 mtp-105 -79.19 -179.64 6.84 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.326 -0.859 . . . . 0.0 109.698 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.02 156.74 35.89 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.212 -0.93 . . . . 0.0 109.938 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.502 ' CG ' ' OG ' ' A' ' 17' ' ' SER . 1.2 tmtt? -157.74 165.49 35.24 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.345 -0.847 . . . . 0.0 110.046 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 O-C-N 121.241 -0.912 . . . . 0.0 109.99 179.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.587 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 40.4 Cg_endo . . . . . 0 N--CA 1.488 1.152 0 N-CA-C 110.562 -0.592 . . . . 0.0 110.562 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.502 ' OG ' ' CG ' ' A' ' 11' ' ' LYS . 0.5 OUTLIER -133.5 96.9 3.81 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.274 -0.891 . . . . 0.0 110.117 179.604 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 1.065 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.9 tt -75.59 115.1 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.175 -0.953 . . . . 0.0 110.097 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.542 ' O ' ' HA ' ' A' ' 6' ' ' TRP . 8.1 m -115.91 170.4 8.51 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.31 -0.869 . . . . 0.0 109.89 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.535 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 5.4 t -78.85 113.2 16.74 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.122 -0.986 . . . . 0.0 110.005 -179.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.663 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -102.91 21.1 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.162 -0.961 . . . . 0.0 109.836 -179.814 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.494 ' HG2' ' NE ' ' A' ' 4' ' ' ARG . 14.9 tpt85 -162.98 86.44 0.55 Allowed 'General case' 0 C--N 1.289 -2.061 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.989 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 25.0 mtt180 -79.14 65.51 4.33 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.924 -1.11 . . . . 0.0 110.126 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.617 0 O-C-N 121.369 -0.832 . . . . 0.0 110.213 -179.987 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.493 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.519 0.676 . . . . 0.0 110.509 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.596 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -175.08 -61.83 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 119.946 -0.701 . . . . 0.0 110.899 -179.9 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.887 ' O ' HG13 ' A' ' 21' ' ' VAL . 0.6 OUTLIER -85.45 53.03 2.62 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.285 -0.885 . . . . 0.0 110.94 -178.98 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.62 ' HB3' HG12 ' A' ' 18' ' ' ILE . 74.9 m95 -46.41 175.39 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.444 -0.785 . . . . 0.0 110.209 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.513 ' O ' ' N ' ' A' ' 9' ' ' ARG . 11.4 tt0 -150.77 93.62 1.98 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.952 -1.093 . . . . 0.0 110.559 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.914 ' NE1' HD12 ' A' ' 18' ' ' ILE . 42.7 m95 -43.32 94.4 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.206 -0.934 . . . . 0.0 109.988 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 7' ' ' GLN . 3.7 mtp180 -78.65 -170.27 2.04 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.097 -1.002 . . . . 0.0 109.815 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -82.63 151.98 26.08 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.19 -0.944 . . . . 0.0 110.171 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.49 ' O ' ' O ' ' A' ' 12' ' ' LYS . 4.2 tttm -152.39 -150.33 0.33 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.479 -0.763 . . . . 0.0 110.29 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.49 ' O ' ' O ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.824 0 CA-C-O 121.785 0.803 . . . . 0.0 110.814 -179.507 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.581 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 46.1 Cg_endo . . . . . 0 N--CA 1.48 0.723 0 N-CA-C 110.358 -0.67 . . . . 0.0 110.358 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.458 ' OG ' ' HG3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -144.4 93.04 2.37 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.161 -0.962 . . . . 0.0 110.096 179.603 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.914 HD12 ' NE1' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -63.16 111.97 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.168 -0.958 . . . . 0.0 109.67 -179.913 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.544 HG22 ' N ' ' A' ' 20' ' ' CYS . 82.9 m -109.14 173.18 6.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.167 -0.958 . . . . 0.0 110.157 -179.429 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.544 ' N ' HG22 ' A' ' 19' ' ' THR . 52.4 t -79.55 124.28 28.36 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.096 -1.003 . . . . 0.0 109.921 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.887 HG13 ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -136.98 33.64 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 CA-C-O 122.942 1.353 . . . . 0.0 109.068 -179.642 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.524 ' HD3' ' CZ ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -160.83 96.38 1.12 Allowed 'General case' 0 C--N 1.296 -1.75 0 O-C-N 121.075 -1.015 . . . . 0.0 110.017 179.118 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.53 ' O ' ' CG ' ' A' ' 23' ' ' ARG . 23.1 ptt85 -79.62 94.74 5.73 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.235 -0.916 . . . . 0.0 110.275 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.322 -0.861 . . . . 0.0 110.136 -179.972 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.622 0.725 . . . . 0.0 110.493 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.528 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -148.83 -34.77 0.2 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 120.001 -0.679 . . . . 0.0 110.769 -179.784 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.675 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.5 OUTLIER -143.59 92.24 2.34 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.063 -1.023 . . . . 0.0 111.224 -179.427 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.675 ' HB3' HG12 ' A' ' 18' ' ' ILE . 68.2 m95 -71.16 105.47 3.41 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.237 -0.914 . . . . 0.0 110.079 179.44 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.569 ' HB3' HG11 ' A' ' 21' ' ' VAL . 32.3 tp60 -89.26 108.22 19.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.053 -1.029 . . . . 0.0 110.367 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 1.06 ' NE1' HD12 ' A' ' 18' ' ' ILE . 59.4 m95 -46.33 103.68 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.283 -0.886 . . . . 0.0 110.547 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.406 ' HB2' ' O ' ' A' ' 17' ' ' SER . 12.1 mtp180 -79.35 -172.1 3.04 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.262 -0.899 . . . . 0.0 109.558 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.476 ' O ' ' HD3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -81.72 151.92 27.28 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.076 -1.015 . . . . 0.0 110.098 -179.755 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.495 ' CE ' ' OG ' ' A' ' 17' ' ' SER . 1.7 tptt -163.27 -154.66 0.29 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.618 -0.676 . . . . 0.0 109.767 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.483 ' HD2' ' HG3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.803 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.876 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.589 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 43.3 Cg_endo . . . . . 0 N--CA 1.484 0.933 0 N-CA-C 110.255 -0.709 . . . . 0.0 110.255 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.495 ' OG ' ' CE ' ' A' ' 11' ' ' LYS . 0.3 OUTLIER -134.44 97.13 3.74 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.083 -1.01 . . . . 0.0 110.374 179.552 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 1.06 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.7 tt -77.45 117.73 23.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.099 -1.001 . . . . 0.0 110.316 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.587 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 14.2 t -112.96 -158.1 0.64 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.307 -0.87 . . . . 0.0 109.79 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.7 t -101.55 129.13 47.58 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.229 -0.92 . . . . 0.0 109.919 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.675 HG22 ' O ' ' A' ' 5' ' ' ARG . 0.9 OUTLIER -122.14 25.48 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.025 -1.047 . . . . 0.0 110.153 -179.697 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.528 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.7 94.86 0.88 Allowed 'General case' 0 C--N 1.292 -1.916 0 O-C-N 121.781 -0.575 . . . . 0.0 110.327 179.671 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 23.0 mtm180 -79.92 52.85 1.56 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.991 -1.068 . . . . 0.0 109.777 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.586 0 O-C-N 121.465 -0.772 . . . . 0.0 110.271 -179.862 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.538 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.646 0.736 . . . . 0.0 110.495 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.531 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -155.66 -32.43 0.09 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.544 -0.723 . . . . 0.0 111.286 -179.671 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.668 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -136.19 78.38 1.71 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.778 -1.201 . . . . 0.0 111.625 -179.102 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.668 ' HB3' HG12 ' A' ' 18' ' ' ILE . 73.5 m95 -65.94 96.93 0.33 Allowed 'General case' 0 C--N 1.305 -1.355 0 O-C-N 120.961 -1.087 . . . . 0.0 109.64 178.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.536 ' HB3' HG11 ' A' ' 21' ' ' VAL . 28.1 tt0 -84.17 104.41 14.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.114 -0.991 . . . . 0.0 110.415 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 1.03 ' NE1' HD12 ' A' ' 18' ' ' ILE . 49.9 m95 -44.53 105.47 0.06 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.264 -0.897 . . . . 0.0 110.555 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.598 ' CZ ' HG21 ' A' ' 19' ' ' THR . 28.8 mtt180 -79.23 -177.69 5.81 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.23 -0.919 . . . . 0.0 109.386 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.524 ' SD ' ' N ' ' A' ' 10' ' ' MET . 0.0 OUTLIER -107.31 135.29 49.06 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.033 -1.042 . . . . 0.0 110.016 -179.863 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.524 ' CE ' ' O ' ' A' ' 16' ' ' PRO . 0.2 OUTLIER -134.17 -166.92 1.87 Allowed 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.477 -0.764 . . . . 0.0 109.81 179.89 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.319 -0.863 . . . . 0.0 109.894 179.713 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.524 ' O ' ' CE ' ' A' ' 11' ' ' LYS . 44.1 Cg_endo . . . . . 0 N--CA 1.484 0.927 0 N-CA-C 110.458 -0.632 . . . . 0.0 110.458 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -133.88 97.95 4.03 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.264 -0.898 . . . . 0.0 109.847 179.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 1.03 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.5 tt -75.4 115.08 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.212 -0.93 . . . . 0.0 110.176 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.598 HG21 ' CZ ' ' A' ' 9' ' ' ARG . 6.9 t -106.86 -159.22 0.69 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.287 -0.883 . . . . 0.0 109.732 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.2 t -107.77 119.22 38.84 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.156 -0.965 . . . . 0.0 110.246 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.668 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.1 m -112.52 28.29 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.162 -0.961 . . . . 0.0 109.806 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.531 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.1 OUTLIER -162.15 126.96 3.32 Favored 'General case' 0 C--N 1.293 -1.891 0 O-C-N 121.918 -0.489 . . . . 0.0 110.019 179.734 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 60.4 mtt85 -105.35 55.06 0.7 Allowed 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.078 -1.013 . . . . 0.0 110.179 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.608 0 O-C-N 121.366 -0.834 . . . . 0.0 110.211 -179.982 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.429 ' CE1' ' HA ' ' A' ' 23' ' ' ARG . 19.6 t80 . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.234 0.54 . . . . 0.0 110.171 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.423 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 0.0 OUTLIER -131.03 100.06 5.1 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.24 -0.912 . . . . 0.0 110.16 179.957 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.457 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER -66.36 -158.17 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.25 -0.906 . . . . 0.0 110.545 179.925 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.556 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -153.09 -31.8 0.13 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.529 -0.732 . . . . 0.0 111.475 -179.765 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.603 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -146.64 84.41 1.61 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.779 -1.201 . . . . 0.0 111.636 -179.376 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.689 ' HB3' HG12 ' A' ' 18' ' ' ILE . 90.5 m95 -66.06 100.93 0.63 Allowed 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.104 -0.997 . . . . 0.0 109.768 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.573 ' HB3' HG11 ' A' ' 21' ' ' VAL . 28.9 tt0 -87.96 112.45 22.58 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.094 -1.004 . . . . 0.0 110.537 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 1.101 ' NE1' HD12 ' A' ' 18' ' ' ILE . 50.7 m95 -51.01 104.86 0.09 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.304 -0.873 . . . . 0.0 110.419 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.1 mtp180 -79.11 -177.15 5.48 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.247 -0.908 . . . . 0.0 109.709 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -82.9 154.85 24.38 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.154 -0.966 . . . . 0.0 110.232 -179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.526 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 1.4 mtpt -159.1 -154.74 0.43 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.481 -0.762 . . . . 0.0 110.193 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.508 ' HG3' ' CE ' ' A' ' 11' ' ' LYS . 0.5 OUTLIER -52.59 -164.71 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.829 0 CA-C-O 121.784 0.802 . . . . 0.0 110.907 -179.564 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.473 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -72.75 137.02 45.62 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.535 -0.728 . . . . 0.0 111.414 -179.12 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.57 46.74 8.87 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.526 ' O ' ' HB3' ' A' ' 11' ' ' LYS . . . -162.45 98.31 1.13 Allowed Pre-proline 0 N--CA 1.49 1.552 0 O-C-N 121.092 -1.24 . . . . 0.0 110.641 179.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.485 ' HB2' ' HB3' ' A' ' 8' ' ' TRP . 49.0 Cg_endo -76.34 177.96 8.13 Favored 'Trans proline' 0 C--N 1.301 -1.924 0 O-C-N 124.124 1.591 . . . . 0.0 110.223 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.514 ' OG ' ' CD ' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -136.89 97.55 3.55 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.131 -0.981 . . . . 0.0 109.936 179.429 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 1.101 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.0 tt -73.96 113.94 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.125 -0.985 . . . . 0.0 110.139 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.543 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 21.2 m -111.73 173.72 6.22 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.361 -0.837 . . . . 0.0 109.752 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.571 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 44.3 t -79.57 118.65 21.61 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.095 -1.003 . . . . 0.0 110.211 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.603 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -108.56 26.78 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.103 -0.998 . . . . 0.0 109.754 -179.958 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.556 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.34 132.95 4.84 Favored 'General case' 0 C--N 1.293 -1.868 0 O-C-N 121.904 -0.497 . . . . 0.0 110.099 179.829 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.429 ' HA ' ' CE1' ' A' ' 1' ' ' PHE . 1.5 mtp-105 -106.73 54.09 0.68 Allowed 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.073 -1.017 . . . . 0.0 110.037 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.423 ' HB3' ' O ' ' A' ' 2' ' ' LYS . . . -75.88 120.03 20.67 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.333 -0.854 . . . . 0.0 110.231 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.42 ' C ' ' O ' ' A' ' 24' ' ' ALA . 7.6 m-85 . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.352 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 72.3 t80 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.241 0.543 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.48 ' HD2' ' O ' ' A' ' 25' ' ' PHE . 0.1 OUTLIER -79.88 159.67 26.33 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.258 -0.901 . . . . 0.0 110.207 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.5 OUTLIER -163.21 -158.03 0.46 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.195 -0.941 . . . . 0.0 110.505 179.949 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.558 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -153.12 -32.03 0.13 Allowed 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.347 -179.686 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.613 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -151.22 89.85 1.55 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.731 -1.231 . . . . 0.0 111.769 -179.257 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.688 ' HB3' HG12 ' A' ' 18' ' ' ILE . 88.6 m95 -67.67 98.45 0.7 Allowed 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.207 -0.933 . . . . 0.0 109.773 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.565 ' HB3' HG11 ' A' ' 21' ' ' VAL . 23.1 tt0 -86.06 107.3 17.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.184 -0.947 . . . . 0.0 110.584 -179.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 1.059 ' NE1' HD12 ' A' ' 18' ' ' ILE . 52.9 m95 -45.26 102.79 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.231 -0.918 . . . . 0.0 110.325 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.8 mmm180 -78.96 -171.77 2.77 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.167 -0.958 . . . . 0.0 109.619 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.1 mtp -80.17 152.85 28.98 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.071 -1.018 . . . . 0.0 110.362 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.543 ' CE ' ' HA ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -159.81 -156.67 0.51 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.616 -0.678 . . . . 0.0 109.667 179.667 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' A' ' 11' ' ' LYS . 3.6 mttt -54.28 -166.64 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 119.742 -0.783 . . . . 0.0 109.764 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.89 146.1 30.99 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.197 -0.939 . . . . 0.0 111.33 -179.326 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 52.01 19.81 5.79 Favored Glycine 0 N--CA 1.487 2.07 0 N-CA-C 109.174 -1.57 . . . . 0.0 109.174 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.522 ' O ' ' HB3' ' A' ' 11' ' ' LYS . . . -146.31 110.32 4.28 Favored Pre-proline 0 N--CA 1.493 1.689 0 O-C-N 121.15 -1.206 . . . . 0.0 111.207 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.576 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.1 Cg_endo -85.45 -178.56 3.09 Favored 'Trans proline' 0 C--N 1.306 -1.672 0 O-C-N 124.065 1.561 . . . . 0.0 110.119 179.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.516 ' HB2' ' CG ' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -135.48 95.91 3.36 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.094 -1.004 . . . . 0.0 110.135 179.322 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 1.059 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.7 tt -74.75 112.39 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 120.981 -1.074 . . . . 0.0 109.769 179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.538 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 7.2 m -111.14 172.84 6.64 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.347 -0.846 . . . . 0.0 109.95 -179.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.577 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 43.4 t -79.55 114.07 18.19 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.239 -0.913 . . . . 0.0 109.868 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.613 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.1 m -103.06 27.19 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.054 -1.029 . . . . 0.0 110.121 -179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.558 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.44 137.27 6.83 Favored 'General case' 0 C--N 1.291 -1.941 0 C-N-CA 120.369 -0.532 . . . . 0.0 110.186 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 73.5 mtt-85 -108.03 53.86 0.68 Allowed 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.045 -1.034 . . . . 0.0 110.034 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.453 ' O ' ' OXT' ' A' ' 25' ' ' PHE . . . -77.39 88.3 3.77 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.349 -0.844 . . . . 0.0 110.233 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.48 ' O ' ' HD2' ' A' ' 2' ' ' LYS . 39.8 p90 . . . . . 0 N--CA 1.49 1.55 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.367 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.535 ' CZ ' ' SG ' ' A' ' 20' ' ' CYS . 46.2 p90 . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.231 0.539 . . . . 0.0 110.172 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.594 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 0.2 OUTLIER -86.15 112.85 21.7 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.345 -0.847 . . . . 0.0 110.223 179.974 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.554 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 1.0 OUTLIER -95.93 -157.77 0.6 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.259 -0.901 . . . . 0.0 110.566 -179.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.582 ' HD3' ' CB ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -154.61 -32.09 0.1 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.607 -0.683 . . . . 0.0 110.959 -179.618 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.69 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.1 OUTLIER -135.01 77.83 1.7 Allowed 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.812 -1.18 . . . . 0.0 111.426 -179.392 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.673 ' HB3' HG12 ' A' ' 18' ' ' ILE . 91.2 m95 -66.66 108.87 2.62 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.014 -1.054 . . . . 0.0 110.082 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.544 ' HB3' HG11 ' A' ' 21' ' ' VAL . 14.9 tt0 -93.95 112.51 24.36 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.076 -1.015 . . . . 0.0 110.398 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 1.072 ' NE1' HD12 ' A' ' 18' ' ' ILE . 55.5 m95 -52.0 103.67 0.07 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.27 -0.894 . . . . 0.0 110.342 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 70.9 mtp180 -79.14 -179.18 6.55 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.346 -0.847 . . . . 0.0 109.748 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -77.26 156.05 31.69 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.177 -0.952 . . . . 0.0 109.934 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.494 ' CG ' ' N ' ' A' ' 12' ' ' LYS . 14.9 tttt -157.93 169.74 23.91 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.449 -0.782 . . . . 0.0 110.026 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.494 ' N ' ' CG ' ' A' ' 11' ' ' LYS . 4.3 mtmt -69.43 -165.78 0.08 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.184 -0.947 . . . . 0.0 109.953 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.442 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -52.92 155.04 2.56 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.421 -0.799 . . . . 0.0 110.451 -179.887 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.418 ' O ' ' HB2' ' A' ' 15' ' ' ALA . . . 112.58 -71.0 0.22 Allowed Glycine 0 N--CA 1.489 2.186 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.931 ' HB1' ' HD2' ' A' ' 16' ' ' PRO . . . -176.2 178.93 0.43 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.42 -1.047 . . . . 0.0 110.948 -179.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.931 ' HD2' ' HB1' ' A' ' 15' ' ' ALA . 41.0 Cg_endo -71.47 -176.57 2.01 Favored 'Trans proline' 0 C--N 1.307 -1.607 0 O-C-N 124.166 1.613 . . . . 0.0 110.74 179.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.458 ' OG ' ' HB2' ' A' ' 11' ' ' LYS . 13.1 m -133.49 97.34 3.92 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.332 -0.855 . . . . 0.0 110.035 179.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 1.072 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.0 tt -75.51 115.49 17.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.121 -0.987 . . . . 0.0 110.223 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.576 HG22 ' N ' ' A' ' 20' ' ' CYS . 58.3 m -111.33 175.47 5.41 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.356 -0.84 . . . . 0.0 109.768 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.576 ' N ' HG22 ' A' ' 19' ' ' THR . 48.5 t -79.42 129.53 34.55 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.144 -0.972 . . . . 0.0 110.115 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.69 HG22 ' O ' ' A' ' 5' ' ' ARG . 0.8 OUTLIER -126.56 25.55 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.13 -0.981 . . . . 0.0 110.1 -179.818 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.468 ' HB3' ' HB3' ' A' ' 4' ' ' ARG . 1.7 tpm_? -162.65 159.08 24.03 Favored 'General case' 0 C--N 1.289 -2.023 0 O-C-N 121.801 -0.562 . . . . 0.0 110.321 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.37 155.37 19.18 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.239 -0.913 . . . . 0.0 109.817 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.594 ' HB3' ' O ' ' A' ' 2' ' ' LYS . . . -175.27 76.43 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.274 -0.891 . . . . 0.0 110.238 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.422 ' O ' ' O ' ' A' ' 24' ' ' ALA . 28.6 p90 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.339 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 27.5 t80 . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.231 0.539 . . . . 0.0 110.244 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.536 ' HB2' ' CE2' ' A' ' 25' ' ' PHE . 0.0 OUTLIER -100.39 115.01 29.0 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.249 -0.907 . . . . 0.0 110.193 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -122.72 -158.13 0.77 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.223 -0.923 . . . . 0.0 110.486 -179.991 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.556 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -146.89 -32.74 0.31 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.543 -0.723 . . . . 0.0 111.255 -179.7 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.65 ' O ' HG22 ' A' ' 21' ' ' VAL . 17.6 ttm-85 -150.6 92.07 1.81 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.859 -1.151 . . . . 0.0 111.589 -179.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.691 ' HB3' HG12 ' A' ' 18' ' ' ILE . 82.0 m95 -70.39 106.84 3.54 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.286 -0.884 . . . . 0.0 110.049 179.165 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.556 ' HB3' HG11 ' A' ' 21' ' ' VAL . 23.7 tt0 -92.21 109.28 20.65 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.199 -0.938 . . . . 0.0 110.464 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 1.075 ' NE1' HD12 ' A' ' 18' ' ' ILE . 54.2 m95 -48.84 103.68 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.27 -0.894 . . . . 0.0 110.512 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.507 ' HG3' ' CG2' ' A' ' 19' ' ' THR . 1.0 OUTLIER -79.15 -174.72 4.25 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.19 -0.944 . . . . 0.0 109.603 179.702 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.1 mtt -82.74 153.63 25.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.084 -1.01 . . . . 0.0 110.275 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.525 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -158.0 -155.55 0.51 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.474 -0.766 . . . . 0.0 110.102 179.818 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.493 ' O ' ' O ' ' A' ' 11' ' ' LYS . 6.1 mtmt -53.12 -164.72 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 121.77 0.795 . . . . 0.0 110.73 -179.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.471 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -73.86 139.27 44.93 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.458 -0.776 . . . . 0.0 111.292 -179.177 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.61 45.91 8.75 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 110.27 -1.132 . . . . 0.0 110.27 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.525 ' O ' ' HB3' ' A' ' 11' ' ' LYS . . . -164.01 100.96 0.91 Allowed Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.185 -1.185 . . . . 0.0 110.609 179.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.56 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.6 Cg_endo -77.45 -178.47 4.62 Favored 'Trans proline' 0 C--N 1.303 -1.827 0 O-C-N 124.109 1.584 . . . . 0.0 110.252 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.524 ' HB3' ' CD ' ' A' ' 11' ' ' LYS . 0.2 OUTLIER -138.74 95.59 3.0 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.189 -0.944 . . . . 0.0 110.038 179.621 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 1.075 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.7 tt -74.53 117.57 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.161 -0.962 . . . . 0.0 110.111 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.542 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 0.2 OUTLIER -116.82 177.09 4.83 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.236 -0.915 . . . . 0.0 110.077 -179.936 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 50.9 t -79.97 118.21 21.5 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.315 -0.866 . . . . 0.0 109.558 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.65 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -109.48 24.97 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.02 -1.05 . . . . 0.0 110.147 -179.475 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.556 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.86 113.44 1.45 Allowed 'General case' 0 C--N 1.292 -1.929 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.123 179.638 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.3 mtt85 -95.09 55.07 1.75 Allowed 'General case' 0 C--N 1.302 -1.473 0 O-C-N 120.92 -1.113 . . . . 0.0 110.137 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.32 134.6 53.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.309 -0.869 . . . . 0.0 110.208 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.536 ' CE2' ' HB2' ' A' ' 2' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.305 -1.364 0 CA-C-O 118.065 -0.969 . . . . 0.0 110.273 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 18.7 t80 . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.23 0.538 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.0 mttp -76.42 74.21 3.18 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.207 -0.933 . . . . 0.0 110.208 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.526 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 1.0 OUTLIER -72.5 -161.12 0.08 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.225 -0.922 . . . . 0.0 110.529 -179.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.583 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -143.23 -33.42 0.44 Allowed 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.605 -0.685 . . . . 0.0 111.258 -179.581 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.583 ' N ' ' CD ' ' A' ' 4' ' ' ARG . 1.5 tpm_? -117.3 75.83 1.01 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.977 -1.077 . . . . 0.0 111.001 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.673 ' HB3' HG12 ' A' ' 18' ' ' ILE . 69.3 m95 -74.27 97.87 3.09 Favored 'General case' 0 C--N 1.306 -1.316 0 O-C-N 121.229 -0.919 . . . . 0.0 110.337 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.541 ' HB3' HG11 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -85.95 101.67 13.09 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.17 -0.956 . . . . 0.0 110.251 -179.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.996 ' NE1' HD12 ' A' ' 18' ' ' ILE . 52.3 m95 -41.75 104.42 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.278 -0.888 . . . . 0.0 110.618 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.713 ' HD2' HG21 ' A' ' 19' ' ' THR . 7.6 mtp180 -79.22 -172.41 3.15 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.173 -0.954 . . . . 0.0 109.454 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.9 mmt -85.6 154.77 21.48 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.039 -1.038 . . . . 0.0 110.215 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -158.77 -155.12 0.46 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.497 -0.752 . . . . 0.0 110.179 179.802 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.493 ' O ' ' O ' ' A' ' 11' ' ' LYS . 2.3 mtmp? -53.02 -164.62 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.801 0.81 . . . . 0.0 110.771 -179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.472 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 0.9 OUTLIER -73.63 139.13 45.26 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.467 -0.77 . . . . 0.0 111.339 -179.237 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.64 45.97 8.81 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 179.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.529 ' O ' ' CB ' ' A' ' 11' ' ' LYS . . . -163.62 101.14 0.95 Allowed Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.158 -1.201 . . . . 0.0 110.593 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.571 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.9 Cg_endo -77.38 -178.52 4.65 Favored 'Trans proline' 0 C--N 1.302 -1.896 0 O-C-N 124.062 1.559 . . . . 0.0 110.225 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.524 ' OG ' ' CD ' ' A' ' 11' ' ' LYS . 0.3 OUTLIER -137.16 95.91 3.19 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.252 -0.905 . . . . 0.0 110.088 179.567 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.996 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.2 tt -75.77 115.25 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.1 -1.0 . . . . 0.0 110.132 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.713 HG21 ' HD2' ' A' ' 9' ' ' ARG . 11.9 t -112.6 -153.39 0.52 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.181 -0.95 . . . . 0.0 109.855 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.1 t -112.15 114.28 27.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.023 -1.048 . . . . 0.0 109.98 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 21' ' ' VAL . 0.8 OUTLIER -107.65 21.91 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.12 -0.987 . . . . 0.0 109.913 -179.733 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.545 ' HD3' ' NE ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.82 89.15 0.64 Allowed 'General case' 0 C--N 1.29 -1.983 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.025 179.854 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 14.4 mtt180 -79.61 76.24 6.25 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.043 -1.035 . . . . 0.0 110.143 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.445 ' O ' ' OXT' ' A' ' 25' ' ' PHE . . . -84.95 123.32 30.38 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.326 -0.859 . . . . 0.0 110.236 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.445 ' OXT' ' O ' ' A' ' 24' ' ' ALA . 6.2 m-85 . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.438 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 42.3 t80 . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.258 0.552 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.486 ' HB3' ' O ' ' A' ' 24' ' ' ALA . 0.0 OUTLIER -80.12 125.65 30.08 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.236 -0.915 . . . . 0.0 110.228 179.959 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.7 OUTLIER -134.66 -158.62 0.89 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.311 -0.868 . . . . 0.0 110.485 -179.976 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.556 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -149.95 -34.65 0.17 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.558 -0.714 . . . . 0.0 111.055 -179.905 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.624 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.4 OUTLIER -152.52 91.38 1.57 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.994 -1.066 . . . . 0.0 111.212 -179.466 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.694 ' HB3' HG12 ' A' ' 18' ' ' ILE . 83.1 m95 -63.73 121.98 15.29 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.27 -0.893 . . . . 0.0 110.166 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.642 ' HB3' HG11 ' A' ' 21' ' ' VAL . 2.6 tt0 -104.38 124.06 48.54 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.174 -0.953 . . . . 0.0 110.221 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 1.1 ' NE1' HD12 ' A' ' 18' ' ' ILE . 64.6 m95 -61.72 106.26 0.65 Allowed 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.217 -0.927 . . . . 0.0 110.441 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -79.4 -177.06 5.56 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.352 -0.843 . . . . 0.0 109.815 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.01 153.49 21.24 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.197 -0.939 . . . . 0.0 109.749 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.519 ' CD ' ' OG ' ' A' ' 17' ' ' SER . 0.1 OUTLIER -162.9 -153.92 0.27 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.369 -0.832 . . . . 0.0 110.503 -179.741 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.555 ' O ' ' O ' ' A' ' 13' ' ' LEU . 1.3 mtpp -56.0 -141.58 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 CA-C-O 121.6 0.714 . . . . 0.0 110.578 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.555 ' O ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -41.31 174.46 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.708 0 O-C-N 121.784 -0.572 . . . . 0.0 110.982 -179.682 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.489 ' C ' ' O ' ' A' ' 13' ' ' LEU . . . -34.77 -31.34 0.01 OUTLIER Glycine 0 N--CA 1.496 2.663 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.538 ' N ' ' O ' ' A' ' 13' ' ' LEU . . . -51.47 106.62 0.67 Allowed Pre-proline 0 N--CA 1.492 1.668 0 O-C-N 121.233 -1.157 . . . . 0.0 110.183 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.585 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 42.8 Cg_endo -78.43 -176.45 3.26 Favored 'Trans proline' 0 C--N 1.306 -1.659 0 O-C-N 123.93 1.49 . . . . 0.0 110.809 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.519 ' OG ' ' CD ' ' A' ' 11' ' ' LYS . 2.7 m -135.58 96.73 3.51 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.374 -0.829 . . . . 0.0 110.077 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 1.1 HD12 ' NE1' ' A' ' 8' ' ' TRP . 3.7 tt -74.0 118.28 19.27 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.163 -0.961 . . . . 0.0 110.301 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.567 HG22 ' H ' ' A' ' 20' ' ' CYS . 26.8 m -112.45 177.49 4.62 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.291 -0.881 . . . . 0.0 109.853 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.567 ' H ' HG22 ' A' ' 19' ' ' THR . 42.9 t -79.43 118.3 21.18 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.14 -0.975 . . . . 0.0 109.983 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.642 HG11 ' HB3' ' A' ' 7' ' ' GLN . 0.9 OUTLIER -106.21 27.39 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.046 -1.034 . . . . 0.0 109.855 -179.77 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.556 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.24 134.36 5.56 Favored 'General case' 0 C--N 1.293 -1.885 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.144 179.826 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.2 mtt85 -108.2 54.27 0.67 Allowed 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.026 -1.046 . . . . 0.0 110.165 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.486 ' O ' ' HB3' ' A' ' 2' ' ' LYS . . . -72.1 98.53 2.13 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.314 -0.866 . . . . 0.0 110.233 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.346 -179.881 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.571 ' O ' ' CD2' ' A' ' 1' ' ' PHE . 87.2 t80 . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.246 0.546 . . . . 0.0 110.197 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.441 ' CG ' ' O ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -42.86 102.94 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.26 -0.9 . . . . 0.0 110.178 179.955 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.529 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.5 OUTLIER -56.93 -161.48 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.227 -0.92 . . . . 0.0 110.551 -179.946 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.549 ' CZ ' ' HD2' ' A' ' 22' ' ' ARG . 0.6 OUTLIER -152.89 -30.31 0.14 Allowed 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 119.943 -0.703 . . . . 0.0 111.713 -179.545 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.58 ' O ' HG22 ' A' ' 21' ' ' VAL . 9.1 mtt-85 -135.56 77.49 1.67 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.742 -1.224 . . . . 0.0 111.534 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.684 ' HB3' HG12 ' A' ' 18' ' ' ILE . 87.6 m95 -66.17 99.26 0.51 Allowed 'General case' 0 C--N 1.305 -1.326 0 O-C-N 121.068 -1.02 . . . . 0.0 109.975 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.577 ' HB3' HG11 ' A' ' 21' ' ' VAL . 2.4 tt0 -85.84 109.21 18.53 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.158 -0.964 . . . . 0.0 110.589 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 1.065 ' NE1' HD12 ' A' ' 18' ' ' ILE . 49.2 m95 -48.07 102.6 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.255 -0.903 . . . . 0.0 110.585 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.457 ' HD2' ' HB ' ' A' ' 19' ' ' THR . 0.3 OUTLIER -78.98 -176.82 5.25 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.136 -0.978 . . . . 0.0 109.588 179.699 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.425 ' O ' ' OG ' ' A' ' 17' ' ' SER . 2.2 mtm -79.28 154.24 29.3 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.957 -1.089 . . . . 0.0 110.26 -179.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.527 ' CG ' ' HB3' ' A' ' 17' ' ' SER . 0.1 OUTLIER -157.41 -155.77 0.54 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.413 -0.805 . . . . 0.0 110.088 179.8 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.49 ' HD2' ' HD2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -53.31 -164.62 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.773 0 CA-C-O 121.79 0.805 . . . . 0.0 110.683 -179.681 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.47 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -74.42 140.45 44.7 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.371 -0.831 . . . . 0.0 111.216 -179.291 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.51 45.71 8.55 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.521 ' O ' ' CB ' ' A' ' 11' ' ' LYS . . . -165.02 103.67 0.79 Allowed Pre-proline 0 N--CA 1.492 1.648 0 O-C-N 121.198 -1.178 . . . . 0.0 110.566 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.555 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.6 Cg_endo -78.08 -179.54 5.54 Favored 'Trans proline' 0 C--N 1.303 -1.826 0 O-C-N 124.15 1.605 . . . . 0.0 110.208 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.527 ' HB3' ' CG ' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -136.87 95.92 3.21 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.153 -0.967 . . . . 0.0 110.069 179.554 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 1.065 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.7 tt -74.51 114.72 14.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.048 -1.032 . . . . 0.0 110.136 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.55 HG22 ' N ' ' A' ' 20' ' ' CYS . 33.0 m -115.34 176.2 5.18 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.358 -0.839 . . . . 0.0 109.707 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.553 ' SG ' ' CE2' ' A' ' 1' ' ' PHE . 47.7 t -79.4 123.96 28.0 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.091 -1.006 . . . . 0.0 110.218 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.58 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.3 m -113.07 22.18 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 121.183 -0.948 . . . . 0.0 110.11 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.549 ' HD2' ' CZ ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.93 145.07 10.31 Favored 'General case' 0 C--N 1.291 -1.97 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.061 179.531 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 26.3 ptt85 -118.69 59.26 0.82 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.104 -0.998 . . . . 0.0 110.154 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.431 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -65.65 96.84 0.29 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.245 -0.909 . . . . 0.0 110.219 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.431 ' C ' ' O ' ' A' ' 24' ' ' ALA . 2.4 m-85 . . . . . 0 N--CA 1.49 1.542 0 CA-C-O 118.055 -0.974 . . . . 0.0 110.319 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.303 0.573 . . . . 0.0 110.171 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 10.2 mtpp -97.3 88.37 4.41 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.236 -0.915 . . . . 0.0 110.219 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.535 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER -85.53 -158.87 0.41 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.257 -0.902 . . . . 0.0 110.508 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.55 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -150.12 -31.72 0.2 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.6 -0.688 . . . . 0.0 111.318 -179.703 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.619 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -144.03 81.37 1.68 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 120.836 -1.165 . . . . 0.0 111.518 -179.394 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.682 ' HB3' HG12 ' A' ' 18' ' ' ILE . 91.3 m95 -66.19 101.54 0.73 Allowed 'General case' 0 C--N 1.306 -1.316 0 O-C-N 121.035 -1.041 . . . . 0.0 109.931 179.116 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.55 ' HB3' HG11 ' A' ' 21' ' ' VAL . 21.4 tt0 -88.95 113.23 24.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.108 -0.995 . . . . 0.0 110.624 -179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 1.104 ' NE1' HD12 ' A' ' 18' ' ' ILE . 52.6 m95 -51.63 106.47 0.14 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.258 -0.901 . . . . 0.0 110.444 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 38.8 mtp180 -79.21 -178.43 6.18 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.252 -0.905 . . . . 0.0 109.816 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 3.4 mtm -83.11 154.99 24.07 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.149 -0.969 . . . . 0.0 110.196 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.526 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -160.72 -155.04 0.4 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.488 -0.758 . . . . 0.0 110.227 179.934 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 11' ' ' LYS . 1.2 mtpt -52.58 -164.38 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 CA-C-O 121.804 0.812 . . . . 0.0 110.96 -179.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.468 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 1.1 pp -73.15 135.95 44.74 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.466 -0.771 . . . . 0.0 111.476 -179.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.58 46.93 8.93 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 110.502 -1.039 . . . . 0.0 110.502 179.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.526 ' O ' ' CB ' ' A' ' 11' ' ' LYS . . . -161.88 94.14 1.32 Allowed Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 121.086 -1.243 . . . . 0.0 110.657 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.487 ' HB2' ' HB3' ' A' ' 8' ' ' TRP . 48.4 Cg_endo -74.96 177.25 8.83 Favored 'Trans proline' 0 C--N 1.3 -1.987 0 O-C-N 124.194 1.628 . . . . 0.0 110.215 179.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.474 ' CB ' ' HG3' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -136.67 97.83 3.64 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.162 -0.961 . . . . 0.0 109.894 179.345 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 1.104 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.1 tt -73.82 114.21 13.1 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.081 -1.012 . . . . 0.0 110.063 -179.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.543 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 24.7 m -111.57 173.92 6.12 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.36 -0.837 . . . . 0.0 109.674 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.574 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 51.5 t -79.55 121.39 25.18 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.085 -1.009 . . . . 0.0 110.153 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.619 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -112.83 25.33 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.091 -1.006 . . . . 0.0 109.926 -179.921 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.55 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.63 93.96 0.85 Allowed 'General case' 0 C--N 1.292 -1.913 0 O-C-N 121.912 -0.492 . . . . 0.0 110.187 179.917 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -79.76 59.01 2.96 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.001 -1.062 . . . . 0.0 110.044 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.41 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -80.13 74.11 6.93 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.359 -0.838 . . . . 0.0 110.227 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.41 ' C ' ' O ' ' A' ' 24' ' ' ALA . 22.6 m-85 . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.403 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.449 ' C ' ' CD1' ' A' ' 1' ' ' PHE . 15.8 p90 . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 121.238 0.542 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 13.4 mtpp -117.51 96.37 5.37 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.272 -0.893 . . . . 0.0 110.198 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.523 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER -61.34 -158.0 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.173 -0.954 . . . . 0.0 110.531 179.969 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.533 ' CG ' ' HD2' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -155.9 -32.18 0.09 Allowed 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.901 -0.72 . . . . 0.0 111.193 -179.729 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.67 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -136.67 78.88 1.73 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.923 -1.111 . . . . 0.0 111.623 -179.202 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.654 ' HB3' HG12 ' A' ' 18' ' ' ILE . 73.2 m95 -66.1 97.21 0.36 Allowed 'General case' 0 C--N 1.305 -1.327 0 O-C-N 120.994 -1.066 . . . . 0.0 109.625 178.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.533 ' HB3' HG11 ' A' ' 21' ' ' VAL . 31.0 tp60 -84.74 104.39 14.67 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.055 -1.028 . . . . 0.0 110.367 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 1.034 ' NE1' HD12 ' A' ' 18' ' ' ILE . 55.0 m95 -43.14 105.58 0.05 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.275 -0.891 . . . . 0.0 110.399 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.418 ' HG3' HG22 ' A' ' 19' ' ' THR . 5.2 mtp180 -79.31 179.91 7.14 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.283 -0.885 . . . . 0.0 109.721 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.48 ' O ' ' HD3' ' A' ' 11' ' ' LYS . 7.4 mtm -78.32 155.61 30.04 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.161 -0.962 . . . . 0.0 109.854 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.48 ' HD3' ' O ' ' A' ' 10' ' ' MET . 0.6 OUTLIER -157.19 171.65 20.04 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.294 -0.879 . . . . 0.0 110.08 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.27 -165.96 0.11 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.198 -0.939 . . . . 0.0 110.082 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.438 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -52.97 155.43 2.45 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.435 -0.791 . . . . 0.0 110.477 -179.847 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.41 ' O ' ' HB2' ' A' ' 15' ' ' ALA . . . 112.53 -71.01 0.22 Allowed Glycine 0 N--CA 1.488 2.131 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.927 ' HB1' ' HD2' ' A' ' 16' ' ' PRO . . . -176.1 179.28 0.42 Allowed Pre-proline 0 N--CA 1.493 1.72 0 O-C-N 121.423 -1.045 . . . . 0.0 110.881 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.927 ' HD2' ' HB1' ' A' ' 15' ' ' ALA . 41.6 Cg_endo -71.87 -177.11 2.37 Favored 'Trans proline' 0 C--N 1.307 -1.636 0 O-C-N 124.216 1.64 . . . . 0.0 110.629 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.467 ' OG ' ' CE ' ' A' ' 11' ' ' LYS . 0.4 OUTLIER -133.26 97.36 3.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.36 -0.837 . . . . 0.0 110.001 179.477 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 1.034 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.5 tt -76.27 115.74 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.221 -0.924 . . . . 0.0 110.286 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.592 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 9.3 t -107.25 -158.24 0.65 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.281 -0.887 . . . . 0.0 109.773 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.4 t -108.11 120.04 41.2 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.21 -0.931 . . . . 0.0 110.4 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.67 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -113.11 28.36 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.111 -0.993 . . . . 0.0 109.778 179.897 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.533 ' HD2' ' CG ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.2 128.91 3.69 Favored 'General case' 0 C--N 1.292 -1.901 0 O-C-N 121.945 -0.472 . . . . 0.0 110.08 179.81 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 53.8 mtp85 -105.44 55.1 0.69 Allowed 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.031 -1.043 . . . . 0.0 110.175 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.434 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -70.99 112.05 6.84 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.3 -0.875 . . . . 0.0 110.223 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.434 ' C ' ' O ' ' A' ' 24' ' ' ALA . 7.1 m-85 . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 118.074 -0.965 . . . . 0.0 110.413 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.534 ' CZ ' ' HA ' ' A' ' 23' ' ' ARG . 15.6 t80 . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.201 0.524 . . . . 0.0 110.237 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.48 ' HB2' ' O ' ' A' ' 24' ' ' ALA . 51.8 mmtt -63.01 179.79 0.35 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.246 -0.909 . . . . 0.0 110.195 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.453 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.6 OUTLIER -174.95 -157.81 0.07 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.251 -0.905 . . . . 0.0 110.552 -179.966 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.546 ' HB3' ' CG ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -160.91 -31.81 0.05 Allowed 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 119.782 -0.767 . . . . 0.0 111.308 -179.682 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.652 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.2 OUTLIER -136.96 80.23 1.8 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 120.763 -1.211 . . . . 0.0 111.677 -179.183 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.67 ' HB3' HG12 ' A' ' 18' ' ' ILE . 73.1 m95 -65.76 97.19 0.32 Allowed 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.068 -1.02 . . . . 0.0 109.594 178.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.528 ' HB3' HG11 ' A' ' 21' ' ' VAL . 1.5 tt0 -82.84 105.05 13.54 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.071 -1.018 . . . . 0.0 110.489 -179.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 1.008 ' NE1' HD12 ' A' ' 18' ' ' ILE . 48.6 m95 -46.94 106.17 0.08 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.337 -0.852 . . . . 0.0 110.46 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.7 mtp180 -79.2 -177.59 5.74 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 109.718 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 6.8 mtm -83.69 155.47 23.11 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.058 -1.026 . . . . 0.0 110.237 -179.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.527 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -160.41 -154.87 0.4 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.457 -0.777 . . . . 0.0 110.202 179.861 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.49 ' O ' ' O ' ' A' ' 11' ' ' LYS . 6.4 mttt -52.94 -164.47 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 121.783 0.801 . . . . 0.0 110.82 -179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.459 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -73.12 137.19 45.05 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.452 -0.78 . . . . 0.0 111.504 -179.133 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.54 46.69 8.8 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 110.473 -1.051 . . . . 0.0 110.473 179.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.527 ' O ' ' HB3' ' A' ' 11' ' ' LYS . . . -162.59 96.37 1.15 Allowed Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.157 -1.202 . . . . 0.0 110.644 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.476 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 48.7 Cg_endo -75.99 177.61 8.52 Favored 'Trans proline' 0 C--N 1.301 -1.941 0 O-C-N 124.208 1.636 . . . . 0.0 110.192 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.494 ' CB ' ' HG3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -134.46 98.21 4.02 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.165 -0.96 . . . . 0.0 109.856 179.423 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 1.008 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.3 tt -75.93 114.77 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.103 -0.998 . . . . 0.0 110.288 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.592 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 6.7 t -107.48 -159.38 0.69 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.32 -0.863 . . . . 0.0 109.675 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.6 t -107.27 122.79 47.25 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.194 -0.941 . . . . 0.0 110.129 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.652 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -116.45 28.79 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.018 -1.051 . . . . 0.0 110.013 179.981 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.546 ' CG ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.09 143.84 11.01 Favored 'General case' 0 C--N 1.294 -1.828 0 O-C-N 121.808 -0.557 . . . . 0.0 110.099 179.578 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.534 ' HA ' ' CZ ' ' A' ' 1' ' ' PHE . 4.2 mtm180 -104.3 55.05 0.72 Allowed 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.154 -0.966 . . . . 0.0 110.19 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.48 ' O ' ' HB2' ' A' ' 2' ' ' LYS . . . -58.47 126.84 29.29 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.345 -0.847 . . . . 0.0 110.17 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.432 ' C ' ' O ' ' A' ' 24' ' ' ALA . 16.7 p90 . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 118.016 -0.993 . . . . 0.0 110.4 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.551 ' CD2' ' O ' ' A' ' 2' ' ' LYS . 66.7 t80 . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 121.264 0.554 . . . . 0.0 110.221 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.551 ' O ' ' CD2' ' A' ' 1' ' ' PHE . 4.6 mttt -44.08 154.6 0.1 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.186 -0.946 . . . . 0.0 110.172 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.459 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER -168.97 -158.2 0.2 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.174 -0.954 . . . . 0.0 110.523 -179.952 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.56 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -151.48 -32.48 0.15 Allowed 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 119.864 -0.734 . . . . 0.0 111.203 -179.782 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.612 ' O ' HG22 ' A' ' 21' ' ' VAL . 24.6 ttm-85 -150.72 89.9 1.59 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.898 -1.126 . . . . 0.0 111.592 -179.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.675 ' HB3' HG12 ' A' ' 18' ' ' ILE . 86.1 m95 -67.67 99.86 0.84 Allowed 'General case' 0 C--N 1.307 -1.259 0 O-C-N 121.109 -0.994 . . . . 0.0 109.943 179.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.573 ' HB3' HG11 ' A' ' 21' ' ' VAL . 15.4 tt0 -85.97 109.57 18.86 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.146 -0.971 . . . . 0.0 110.471 -179.6 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 1.058 ' NE1' HD12 ' A' ' 18' ' ' ILE . 56.5 m95 -47.46 107.05 0.1 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.305 -0.872 . . . . 0.0 110.371 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 29.0 mtt180 -79.42 178.91 7.76 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.288 -0.882 . . . . 0.0 109.785 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.97 155.22 27.77 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.149 -0.969 . . . . 0.0 109.914 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.484 ' HD3' ' N ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -157.28 175.74 13.62 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.385 -0.822 . . . . 0.0 110.112 179.906 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.484 ' N ' ' HD3' ' A' ' 11' ' ' LYS . 0.3 OUTLIER -71.7 -166.17 0.19 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.208 -0.933 . . . . 0.0 110.077 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.429 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -53.95 156.75 2.75 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.455 -0.778 . . . . 0.0 110.429 -179.868 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.406 ' O ' ' HB2' ' A' ' 15' ' ' ALA . . . 112.05 -71.01 0.22 Allowed Glycine 0 N--CA 1.487 2.086 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.93 ' HB1' ' HD2' ' A' ' 16' ' ' PRO . . . -176.12 178.36 0.47 Allowed Pre-proline 0 N--CA 1.493 1.677 0 O-C-N 121.351 -1.088 . . . . 0.0 110.842 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.93 ' HD2' ' HB1' ' A' ' 15' ' ' ALA . 41.7 Cg_endo -72.05 -177.03 2.38 Favored 'Trans proline' 0 C--N 1.306 -1.674 0 O-C-N 124.309 1.689 . . . . 0.0 110.766 179.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.445 ' OG ' ' HB2' ' A' ' 11' ' ' LYS . 75.5 m -133.92 97.16 3.81 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.301 -0.874 . . . . 0.0 110.002 179.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 1.058 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.0 tt -75.78 116.9 19.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.122 -0.986 . . . . 0.0 110.465 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.572 HG22 ' N ' ' A' ' 20' ' ' CYS . 62.9 m -114.69 174.99 5.69 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.331 -0.856 . . . . 0.0 109.658 179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.572 ' N ' HG22 ' A' ' 19' ' ' THR . 42.9 t -79.59 122.04 26.01 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.111 -0.993 . . . . 0.0 110.27 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.612 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.1 m -110.33 25.77 3.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.105 -0.997 . . . . 0.0 109.868 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.56 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.45 137.21 6.79 Favored 'General case' 0 C--N 1.293 -1.856 0 O-C-N 121.851 -0.53 . . . . 0.0 110.164 179.829 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 41.8 mtt-85 -106.44 53.13 0.71 Allowed 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.186 -0.946 . . . . 0.0 109.981 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.466 ' O ' ' O ' ' A' ' 25' ' ' PHE . . . -67.85 90.95 0.31 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.399 -0.813 . . . . 0.0 110.23 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.476 ' OXT' ' HD3' ' A' ' 2' ' ' LYS . 17.1 m-85 . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 118.024 -0.988 . . . . 0.0 110.279 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 54.9 t80 . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 121.257 0.551 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.457 ' HD3' ' O ' ' A' ' 25' ' ' PHE . 40.1 mttt -69.0 112.22 5.5 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.248 -0.907 . . . . 0.0 110.227 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.521 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.5 OUTLIER -127.78 -159.75 0.96 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.265 -0.897 . . . . 0.0 110.472 -179.977 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.586 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -174.76 -64.38 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.919 -0.712 . . . . 0.0 110.902 -179.895 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.883 ' O ' HG13 ' A' ' 21' ' ' VAL . 4.3 ttt180 -84.06 53.85 2.74 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.256 -0.903 . . . . 0.0 110.958 -179.075 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.634 ' HB3' HG12 ' A' ' 18' ' ' ILE . 72.7 m95 -46.84 176.39 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.373 -0.829 . . . . 0.0 110.18 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 7' ' ' GLN . 32.4 tt0 -151.53 95.27 2.11 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.051 -1.031 . . . . 0.0 110.55 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.901 ' NE1' HD12 ' A' ' 18' ' ' ILE . 52.8 m95 -45.12 111.63 0.35 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.236 -0.915 . . . . 0.0 110.034 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.492 ' O ' ' HA ' ' A' ' 16' ' ' PRO . 0.5 OUTLIER -79.42 -173.24 3.61 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.058 -1.026 . . . . 0.0 109.873 179.814 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 6.6 mtt -99.89 163.19 12.56 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.198 -0.939 . . . . 0.0 110.027 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.547 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -175.02 -152.52 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.168 -0.957 . . . . 0.0 111.178 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.499 ' O ' ' N ' ' A' ' 14' ' ' GLY . 6.3 mttm -52.36 -161.06 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.836 0 CA-C-O 122.088 0.947 . . . . 0.0 111.952 -178.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -38.53 90.06 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 121.327 0.584 . . . . 0.0 112.071 -178.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.516 ' O ' ' HD3' ' A' ' 16' ' ' PRO . . . 43.64 34.52 2.7 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 110.594 -1.002 . . . . 0.0 110.594 178.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.547 ' O ' ' CB ' ' A' ' 11' ' ' LYS . . . -106.17 83.61 1.16 Allowed Pre-proline 0 N--CA 1.492 1.647 0 O-C-N 121.016 -1.285 . . . . 0.0 109.723 179.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.516 ' HD3' ' O ' ' A' ' 14' ' ' GLY . 42.6 Cg_endo -66.95 176.75 4.15 Favored 'Trans proline' 0 C--N 1.298 -2.084 0 O-C-N 124.304 1.687 . . . . 0.0 110.891 -179.447 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.3 m -144.19 96.21 2.85 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.483 -0.761 . . . . 0.0 109.644 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.901 HD12 ' NE1' ' A' ' 8' ' ' TRP . 0.7 OUTLIER -60.46 113.35 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.25 -0.906 . . . . 0.0 110.003 -179.315 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.558 HG22 ' N ' ' A' ' 20' ' ' CYS . 85.3 m -106.19 173.52 6.28 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.247 -0.908 . . . . 0.0 109.972 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.558 ' N ' HG22 ' A' ' 19' ' ' THR . 50.7 t -79.71 124.55 28.68 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.133 -0.979 . . . . 0.0 110.099 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.883 HG13 ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -137.14 33.54 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 CA-C-O 122.834 1.302 . . . . 0.0 109.138 -179.55 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.552 ' CG ' ' HB3' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -161.09 96.15 1.08 Allowed 'General case' 0 C--N 1.296 -1.747 0 O-C-N 121.105 -0.997 . . . . 0.0 110.191 179.342 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.4 mtt-85 -79.82 90.35 5.27 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.286 -0.884 . . . . 0.0 110.269 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.413 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -101.43 104.78 15.74 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.288 -0.883 . . . . 0.0 110.272 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.457 ' O ' ' HD3' ' A' ' 2' ' ' LYS . 24.7 m-85 . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.409 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.466 ' CG ' ' O ' ' A' ' 1' ' ' PHE . 12.4 t80 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.226 0.536 . . . . 0.0 110.22 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.49 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 11.2 mmtp -76.42 99.98 5.05 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.298 -0.877 . . . . 0.0 110.219 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER -56.69 -158.26 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.349 -0.844 . . . . 0.0 110.536 -179.995 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.561 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -149.83 -33.15 0.19 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.507 -0.745 . . . . 0.0 111.142 -179.737 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.583 ' O ' HG22 ' A' ' 21' ' ' VAL . 1.5 tmm_? -152.87 92.52 1.65 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.795 -1.19 . . . . 0.0 111.673 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.688 ' HB3' HG12 ' A' ' 18' ' ' ILE . 83.6 m95 -67.62 102.1 1.12 Allowed 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.244 -0.91 . . . . 0.0 109.838 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.581 ' HB3' HG11 ' A' ' 21' ' ' VAL . 5.6 tp-100 -88.21 109.54 20.0 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.181 -0.949 . . . . 0.0 110.346 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 1.071 ' NE1' HD12 ' A' ' 18' ' ' ILE . 59.1 m95 -47.01 107.64 0.12 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.193 -0.942 . . . . 0.0 110.318 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.2 mtp180 -79.51 179.19 7.6 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.301 -0.875 . . . . 0.0 109.786 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.5 153.89 23.03 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.264 -0.897 . . . . 0.0 109.754 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.499 ' O ' ' O ' ' A' ' 12' ' ' LYS . 4.4 tptt -163.07 -154.35 0.29 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.341 -0.85 . . . . 0.0 110.614 -179.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.556 ' O ' ' O ' ' A' ' 13' ' ' LEU . 0.4 OUTLIER -55.82 -141.78 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 121.637 0.732 . . . . 0.0 110.646 179.816 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.556 ' O ' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -41.33 174.9 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.706 0 CA-C-O 121.279 0.562 . . . . 0.0 111.05 -179.616 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.486 ' C ' ' O ' ' A' ' 13' ' ' LEU . . . -34.81 -31.38 0.01 OUTLIER Glycine 0 N--CA 1.495 2.623 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.542 ' N ' ' O ' ' A' ' 13' ' ' LEU . . . -52.3 106.96 0.72 Allowed Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.242 -1.152 . . . . 0.0 110.217 179.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.585 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 42.8 Cg_endo -77.29 -176.97 3.49 Favored 'Trans proline' 0 C--N 1.307 -1.651 0 O-C-N 124.036 1.545 . . . . 0.0 110.854 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.443 ' OG ' ' CG ' ' A' ' 11' ' ' LYS . 73.9 m -133.86 96.97 3.77 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.408 -0.808 . . . . 0.0 109.986 179.526 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 1.071 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.1 tt -75.65 117.13 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.203 -0.935 . . . . 0.0 110.397 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.557 HG22 ' N ' ' A' ' 20' ' ' CYS . 32.1 m -115.57 176.49 5.05 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.434 -0.791 . . . . 0.0 109.669 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.557 ' N ' HG22 ' A' ' 19' ' ' THR . 42.4 t -79.62 123.3 27.5 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.072 -1.018 . . . . 0.0 110.21 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.583 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.2 m -111.06 25.61 3.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.181 -0.949 . . . . 0.0 109.907 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.561 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.2 OUTLIER -162.63 137.27 6.62 Favored 'General case' 0 C--N 1.292 -1.903 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.128 179.691 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 7.5 mtp180 -107.14 53.33 0.69 Allowed 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.15 -0.969 . . . . 0.0 110.063 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.49 ' HB3' ' O ' ' A' ' 2' ' ' LYS . . . -83.35 89.93 7.09 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.436 -0.79 . . . . 0.0 110.237 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.432 ' C ' ' O ' ' A' ' 24' ' ' ALA . 9.0 m-85 . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 117.936 -1.03 . . . . 0.0 110.389 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.276 0.56 . . . . 0.0 110.183 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.492 ' HB3' ' O ' ' A' ' 24' ' ' ALA . 16.0 mmtm -45.43 133.4 7.46 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.223 -0.923 . . . . 0.0 110.142 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.456 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.7 OUTLIER -129.57 -158.44 0.89 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.246 -0.909 . . . . 0.0 110.507 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.564 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -149.9 -34.61 0.17 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 119.945 -0.702 . . . . 0.0 111.069 -179.852 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.554 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.5 OUTLIER -152.63 89.85 1.44 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 120.945 -1.097 . . . . 0.0 111.347 -179.475 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.693 ' HB3' HG12 ' A' ' 18' ' ' ILE . 85.1 m95 -63.55 112.32 2.74 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.254 -0.904 . . . . 0.0 110.358 179.483 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.502 ' O ' ' CG ' ' A' ' 7' ' ' GLN . 14.1 pt20 -94.22 117.79 30.63 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.174 -0.954 . . . . 0.0 110.552 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 1.1 ' NE1' HD12 ' A' ' 18' ' ' ILE . 56.9 m95 -57.17 105.46 0.23 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.208 -0.933 . . . . 0.0 110.315 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 -79.19 -178.69 6.31 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.222 -0.924 . . . . 0.0 109.817 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 5.2 mtp -81.69 155.08 25.74 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.209 -0.932 . . . . 0.0 109.911 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.488 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -157.76 174.21 15.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.311 -0.868 . . . . 0.0 110.063 179.832 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.57 -165.89 0.12 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.138 -0.976 . . . . 0.0 110.092 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.427 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -53.56 156.5 2.54 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.519 -0.738 . . . . 0.0 110.613 -179.882 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.407 ' O ' ' HB2' ' A' ' 15' ' ' ALA . . . 112.28 -71.47 0.22 Allowed Glycine 0 N--CA 1.488 2.125 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.916 ' HB1' ' HD2' ' A' ' 16' ' ' PRO . . . -176.26 178.66 0.44 Allowed Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.333 -1.098 . . . . 0.0 110.881 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.916 ' HD2' ' HB1' ' A' ' 15' ' ' ALA . 40.9 Cg_endo -72.2 -176.62 2.24 Favored 'Trans proline' 0 C--N 1.306 -1.662 0 O-C-N 124.226 1.645 . . . . 0.0 110.729 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.461 ' OG ' ' HG3' ' A' ' 11' ' ' LYS . 4.8 m -134.26 97.05 3.74 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.378 -0.826 . . . . 0.0 109.985 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 1.1 HD12 ' NE1' ' A' ' 8' ' ' TRP . 2.8 tt -75.17 117.35 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.18 -0.95 . . . . 0.0 110.347 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.542 HG22 ' N ' ' A' ' 20' ' ' CYS . 30.5 m -112.87 176.12 5.15 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.38 -0.825 . . . . 0.0 109.668 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.542 ' N ' HG22 ' A' ' 19' ' ' THR . 43.6 t -79.71 123.91 28.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.118 -0.989 . . . . 0.0 110.206 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.2 m -110.6 25.38 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.028 -1.045 . . . . 0.0 110.055 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.564 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 7.2 tpt85 -162.43 138.28 7.38 Favored 'General case' 0 C--N 1.293 -1.878 0 O-C-N 121.799 -0.563 . . . . 0.0 110.283 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.2 mtm-85 -109.91 53.28 0.7 Allowed 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.08 -1.013 . . . . 0.0 110.051 179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.492 ' O ' ' HB3' ' A' ' 2' ' ' LYS . . . -81.02 76.33 7.98 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.405 -0.809 . . . . 0.0 110.233 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.47 ' HA ' ' HB2' ' A' ' 2' ' ' LYS . 38.2 p90 . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.319 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.221 0.534 . . . . 0.0 110.167 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' A' ' 3' ' ' CYS . 0.9 OUTLIER -98.27 62.13 1.48 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.273 -0.892 . . . . 0.0 110.246 179.967 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.462 ' O ' ' O ' ' A' ' 2' ' ' LYS . 1.2 t -55.6 -162.85 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.181 -0.949 . . . . 0.0 110.37 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.562 ' HG3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -144.54 -32.56 0.41 Allowed 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.577 -0.702 . . . . 0.0 111.098 -179.669 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.822 ' O ' HG22 ' A' ' 21' ' ' VAL . 2.7 ttt180 -146.32 96.77 2.83 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.988 -1.07 . . . . 0.0 110.653 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.613 ' HB3' HG12 ' A' ' 18' ' ' ILE . 70.5 m95 -68.97 169.38 11.82 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.277 -0.889 . . . . 0.0 110.403 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.655 ' CB ' HG11 ' A' ' 21' ' ' VAL . 2.9 tt0 -146.44 93.31 2.28 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.228 -0.92 . . . . 0.0 109.836 179.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.922 ' NE1' HD12 ' A' ' 18' ' ' ILE . 42.7 m95 -39.7 95.42 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.378 -0.826 . . . . 0.0 110.638 -179.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.514 ' O ' ' N ' ' A' ' 17' ' ' SER . 17.0 mtp-105 -78.87 -170.51 2.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.305 -0.872 . . . . 0.0 109.537 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.423 ' O ' ' HD2' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -82.66 152.51 25.81 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.151 -0.968 . . . . 0.0 110.233 -179.648 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.543 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -148.64 -151.12 0.38 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.464 -0.772 . . . . 0.0 110.167 179.736 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.48 ' O ' ' O ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -52.82 -164.6 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.838 0 CA-C-O 121.849 0.833 . . . . 0.0 110.952 -179.508 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.47 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -60.23 128.75 38.28 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.555 -0.715 . . . . 0.0 111.241 -179.294 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.42 50.72 8.01 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.977 -1.249 . . . . 0.0 109.977 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.543 ' O ' ' CB ' ' A' ' 11' ' ' LYS . . . -153.0 122.63 3.31 Favored Pre-proline 0 C--N 1.299 -1.591 0 O-C-N 121.236 -1.156 . . . . 0.0 110.388 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.551 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 50.3 Cg_endo -87.49 -174.32 1.24 Allowed 'Trans proline' 0 C--N 1.306 -1.679 0 O-C-N 123.896 1.472 . . . . 0.0 110.162 179.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.514 ' N ' ' O ' ' A' ' 9' ' ' ARG . 0.3 OUTLIER -146.95 93.3 2.25 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.115 -0.99 . . . . 0.0 109.943 179.505 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.922 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.0 OUTLIER -63.9 114.15 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.153 -0.967 . . . . 0.0 109.821 -179.657 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.539 ' C ' ' CE3' ' A' ' 6' ' ' TRP . 22.7 m -120.61 174.37 6.61 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.32 -0.863 . . . . 0.0 109.927 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.489 ' N ' HG22 ' A' ' 19' ' ' THR . 23.9 t -79.27 122.51 26.41 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.093 -1.005 . . . . 0.0 109.856 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.822 HG22 ' O ' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -111.06 23.28 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.126 -0.984 . . . . 0.0 109.655 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.562 ' CB ' ' HG3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.07 89.68 0.72 Allowed 'General case' 0 C--N 1.292 -1.893 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.008 179.792 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 22.9 mtt180 -79.72 59.84 3.19 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.039 -1.038 . . . . 0.0 110.004 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.428 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -67.51 92.12 0.3 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.39 -0.818 . . . . 0.0 110.271 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.428 ' C ' ' O ' ' A' ' 24' ' ' ALA . 5.9 m-85 . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.398 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 23.0 p90 . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.236 0.541 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -109.51 113.33 26.04 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.258 -0.901 . . . . 0.0 110.194 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.542 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER -85.96 -158.35 0.39 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.23 -0.919 . . . . 0.0 110.537 179.954 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.548 ' HB3' ' CG ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -153.07 -33.24 0.12 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.599 -0.688 . . . . 0.0 111.082 -179.704 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.663 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -136.31 79.93 1.79 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.856 -1.153 . . . . 0.0 111.545 -178.969 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.658 ' HB3' HG12 ' A' ' 18' ' ' ILE . 72.9 m95 -67.01 97.16 0.48 Allowed 'General case' 0 C--N 1.305 -1.347 0 O-C-N 121.093 -1.004 . . . . 0.0 109.68 179.036 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.52 ' HB3' HG11 ' A' ' 21' ' ' VAL . 6.4 tt0 -84.21 103.69 13.63 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.12 -0.988 . . . . 0.0 110.374 -179.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 1.03 ' NE1' HD12 ' A' ' 18' ' ' ILE . 54.7 m95 -42.69 105.76 0.05 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.231 -0.918 . . . . 0.0 110.415 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.45 ' HD2' HG21 ' A' ' 19' ' ' THR . 4.4 mtt180 -79.25 179.41 7.41 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.277 -0.89 . . . . 0.0 109.67 179.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 6.6 mtm -76.99 156.36 31.94 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.172 -0.955 . . . . 0.0 109.945 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.489 ' HG3' ' CB ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -157.59 168.68 26.57 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.344 -0.847 . . . . 0.0 109.993 179.924 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.9 mtmt -69.15 -165.72 0.08 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.198 -0.939 . . . . 0.0 109.964 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.45 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -52.52 154.97 2.32 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.431 -0.793 . . . . 0.0 110.436 -179.878 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.413 ' O ' ' HB2' ' A' ' 15' ' ' ALA . . . 112.62 -71.13 0.22 Allowed Glycine 0 N--CA 1.487 2.071 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 179.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.939 ' HB1' ' HD2' ' A' ' 16' ' ' PRO . . . -176.11 179.28 0.42 Allowed Pre-proline 0 N--CA 1.493 1.691 0 O-C-N 121.362 -1.081 . . . . 0.0 110.951 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.939 ' HD2' ' HB1' ' A' ' 15' ' ' ALA . 41.7 Cg_endo -72.0 -177.23 2.48 Favored 'Trans proline' 0 C--N 1.308 -1.583 0 O-C-N 124.147 1.604 . . . . 0.0 110.661 179.524 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.489 ' CB ' ' HG3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -133.05 97.39 3.99 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.239 -0.913 . . . . 0.0 109.953 179.56 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 1.03 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.5 tt -76.69 116.31 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 O-C-N 121.201 -0.937 . . . . 0.0 110.265 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.592 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 9.0 t -108.47 -158.32 0.65 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.343 -0.848 . . . . 0.0 109.759 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.7 t -107.1 124.44 49.68 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.169 -0.957 . . . . 0.0 110.148 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.663 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -117.88 26.74 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.042 -1.037 . . . . 0.0 110.118 -179.999 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.548 ' CG ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.56 94.6 0.88 Allowed 'General case' 0 C--N 1.292 -1.916 0 O-C-N 121.87 -0.519 . . . . 0.0 110.116 179.671 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 38.3 mtp180 -79.7 61.41 3.66 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 120.99 -1.069 . . . . 0.0 110.021 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -77.37 100.76 6.06 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.333 -0.854 . . . . 0.0 110.158 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.569 ' OXT' ' CD1' ' A' ' 25' ' ' PHE . 15.8 p90 . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 118.061 -0.971 . . . . 0.0 110.372 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.47 ' O ' ' HG3' ' A' ' 2' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.242 0.544 . . . . 0.0 110.206 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' A' ' 1' ' ' PHE . 47.9 mtmt -153.78 82.57 1.16 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.276 -0.89 . . . . 0.0 110.237 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.549 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER -77.04 -161.48 0.21 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.209 -0.932 . . . . 0.0 110.588 179.986 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.58 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -141.8 -30.26 0.59 Allowed 'General case' 0 C--N 1.3 -1.563 0 O-C-N 121.642 -0.661 . . . . 0.0 111.448 -179.65 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.663 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -120.9 74.04 1.05 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.92 -1.112 . . . . 0.0 111.296 -179.157 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.653 ' HB3' HG12 ' A' ' 18' ' ' ILE . 95.3 m95 -73.54 96.26 2.4 Favored 'General case' 0 C--N 1.305 -1.327 0 O-C-N 121.1 -1.0 . . . . 0.0 110.088 179.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.536 ' HB3' HG11 ' A' ' 21' ' ' VAL . 2.3 tp60 -87.36 109.14 19.33 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.169 -0.957 . . . . 0.0 110.394 -179.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 1.065 ' NE1' HD12 ' A' ' 18' ' ' ILE . 54.1 m95 -46.46 103.58 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.179 -0.951 . . . . 0.0 110.383 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.467 ' HD2' ' HB ' ' A' ' 19' ' ' THR . 2.3 mtp-105 -79.19 -179.64 6.84 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.326 -0.859 . . . . 0.0 109.698 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.02 156.74 35.89 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.212 -0.93 . . . . 0.0 109.938 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.502 ' CG ' ' OG ' ' A' ' 17' ' ' SER . 1.2 tmtt? -157.74 165.49 35.24 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.345 -0.847 . . . . 0.0 110.046 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.47 -165.58 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.241 -0.912 . . . . 0.0 109.99 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.473 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 0.6 OUTLIER -52.34 154.43 2.45 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.462 -0.773 . . . . 0.0 110.355 -179.867 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.425 ' O ' ' HB2' ' A' ' 15' ' ' ALA . . . 112.67 -70.94 0.22 Allowed Glycine 0 N--CA 1.488 2.12 0 N-CA-C 109.699 -1.36 . . . . 0.0 109.699 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.971 ' HB1' ' HD2' ' A' ' 16' ' ' PRO . . . -176.19 179.62 0.4 Allowed Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.393 -1.063 . . . . 0.0 110.939 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.971 ' HD2' ' HB1' ' A' ' 15' ' ' ALA . 40.4 Cg_endo -71.24 -176.63 1.97 Allowed 'Trans proline' 0 C--N 1.307 -1.612 0 O-C-N 124.198 1.63 . . . . 0.0 110.562 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.502 ' OG ' ' CG ' ' A' ' 11' ' ' LYS . 0.5 OUTLIER -133.5 96.9 3.81 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.274 -0.891 . . . . 0.0 110.117 179.604 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 1.065 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.9 tt -75.59 115.1 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.175 -0.953 . . . . 0.0 110.097 -179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.542 ' O ' ' HA ' ' A' ' 6' ' ' TRP . 8.1 m -115.91 170.4 8.51 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.31 -0.869 . . . . 0.0 109.89 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.535 ' HB2' ' CH2' ' A' ' 6' ' ' TRP . 5.4 t -78.85 113.2 16.74 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.122 -0.986 . . . . 0.0 110.005 -179.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.663 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.0 OUTLIER -102.91 21.1 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.162 -0.961 . . . . 0.0 109.836 -179.814 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.494 ' HG2' ' NE ' ' A' ' 4' ' ' ARG . 14.9 tpt85 -162.98 86.44 0.55 Allowed 'General case' 0 C--N 1.289 -2.061 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.989 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 25.0 mtt180 -79.14 65.51 4.33 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 120.924 -1.11 . . . . 0.0 110.126 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.428 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -54.84 111.05 0.74 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.369 -0.832 . . . . 0.0 110.213 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.428 ' C ' ' O ' ' A' ' 24' ' ' ALA . 7.0 m-85 . . . . . 0 N--CA 1.489 1.52 0 CA-C-O 118.003 -0.999 . . . . 0.0 110.326 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.534 ' CE1' ' SG ' ' A' ' 20' ' ' CYS . 7.1 p90 . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.206 0.527 . . . . 0.0 110.19 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.404 ' C ' ' O ' ' A' ' 1' ' ' PHE . 0.0 OUTLIER -44.38 109.05 0.13 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.338 -0.851 . . . . 0.0 110.234 -179.983 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.493 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.5 OUTLIER -106.58 -160.17 0.73 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.262 -0.899 . . . . 0.0 110.509 179.888 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.596 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.0 OUTLIER -175.08 -61.83 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 119.946 -0.701 . . . . 0.0 110.899 -179.9 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.887 ' O ' HG13 ' A' ' 21' ' ' VAL . 0.6 OUTLIER -85.45 53.03 2.62 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.285 -0.885 . . . . 0.0 110.94 -178.98 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.62 ' HB3' HG12 ' A' ' 18' ' ' ILE . 74.9 m95 -46.41 175.39 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.359 0 O-C-N 121.444 -0.785 . . . . 0.0 110.209 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.513 ' O ' ' N ' ' A' ' 9' ' ' ARG . 11.4 tt0 -150.77 93.62 1.98 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.952 -1.093 . . . . 0.0 110.559 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.914 ' NE1' HD12 ' A' ' 18' ' ' ILE . 42.7 m95 -43.32 94.4 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.206 -0.934 . . . . 0.0 109.988 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 7' ' ' GLN . 3.7 mtp180 -78.65 -170.27 2.04 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.097 -1.002 . . . . 0.0 109.815 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -82.63 151.98 26.08 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.19 -0.944 . . . . 0.0 110.171 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.55 ' CB ' ' O ' ' A' ' 15' ' ' ALA . 4.2 tttm -152.39 -150.33 0.33 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.479 -0.763 . . . . 0.0 110.29 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.49 ' O ' ' O ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -52.72 -165.28 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.824 0 CA-C-O 121.785 0.803 . . . . 0.0 110.814 -179.507 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.467 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 1.0 OUTLIER -66.59 133.14 49.69 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.482 -0.761 . . . . 0.0 111.177 -179.353 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.54 48.42 8.76 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.891 -1.283 . . . . 0.0 109.891 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.55 ' O ' ' CB ' ' A' ' 11' ' ' LYS . . . -156.97 115.16 1.99 Allowed Pre-proline 0 N--CA 1.49 1.549 0 O-C-N 121.366 -1.079 . . . . 0.0 110.406 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.581 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 46.1 Cg_endo -83.94 -174.61 1.94 Allowed 'Trans proline' 0 C--N 1.307 -1.634 0 O-C-N 123.996 1.524 . . . . 0.0 110.358 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.458 ' OG ' ' HG3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -144.4 93.04 2.37 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.161 -0.962 . . . . 0.0 110.096 179.603 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.914 HD12 ' NE1' ' A' ' 8' ' ' TRP . 0.9 OUTLIER -63.16 111.97 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.168 -0.958 . . . . 0.0 109.67 -179.913 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.544 HG22 ' N ' ' A' ' 20' ' ' CYS . 82.9 m -109.14 173.18 6.44 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.167 -0.958 . . . . 0.0 110.157 -179.429 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.544 ' N ' HG22 ' A' ' 19' ' ' THR . 52.4 t -79.55 124.28 28.36 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.096 -1.003 . . . . 0.0 109.921 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.887 HG13 ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -136.98 33.64 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 CA-C-O 122.942 1.353 . . . . 0.0 109.068 -179.642 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.524 ' HD3' ' CZ ' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -160.83 96.38 1.12 Allowed 'General case' 0 C--N 1.296 -1.75 0 O-C-N 121.075 -1.015 . . . . 0.0 110.017 179.118 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.53 ' O ' ' CG ' ' A' ' 23' ' ' ARG . 23.1 ptt85 -79.62 94.74 5.73 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.235 -0.916 . . . . 0.0 110.275 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -101.03 104.24 15.38 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.322 -0.861 . . . . 0.0 110.136 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.436 ' C ' ' O ' ' A' ' 24' ' ' ALA . 11.2 m-85 . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 117.978 -1.011 . . . . 0.0 110.382 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.241 0.544 . . . . 0.0 110.293 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.439 ' HD2' ' O ' ' A' ' 24' ' ' ALA . 11.2 ptpt -113.44 71.38 0.74 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.215 -0.928 . . . . 0.0 110.246 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -60.77 -158.45 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.361 -0.837 . . . . 0.0 110.493 -179.982 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.528 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -148.83 -34.77 0.2 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 120.001 -0.679 . . . . 0.0 110.769 -179.784 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.675 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.5 OUTLIER -143.59 92.24 2.34 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.063 -1.023 . . . . 0.0 111.224 -179.427 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.675 ' HB3' HG12 ' A' ' 18' ' ' ILE . 68.2 m95 -71.16 105.47 3.41 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 121.237 -0.914 . . . . 0.0 110.079 179.44 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.569 ' HB3' HG11 ' A' ' 21' ' ' VAL . 32.3 tp60 -89.26 108.22 19.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.053 -1.029 . . . . 0.0 110.367 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 1.06 ' NE1' HD12 ' A' ' 18' ' ' ILE . 59.4 m95 -46.33 103.68 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.283 -0.886 . . . . 0.0 110.547 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.406 ' HB2' ' O ' ' A' ' 17' ' ' SER . 12.1 mtp180 -79.35 -172.1 3.04 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.262 -0.899 . . . . 0.0 109.558 179.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.476 ' O ' ' HD3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -81.72 151.92 27.28 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.076 -1.015 . . . . 0.0 110.098 -179.755 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.511 ' HB3' ' O ' ' A' ' 15' ' ' ALA . 1.7 tptt -163.27 -154.66 0.29 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.618 -0.676 . . . . 0.0 109.767 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.483 ' HD2' ' HG3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -53.59 -167.72 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.876 179.983 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.12 153.35 21.59 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.273 -0.892 . . . . 0.0 111.427 -179.314 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 49.41 21.61 3.13 Favored Glycine 0 N--CA 1.485 1.941 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.511 ' O ' ' HB3' ' A' ' 11' ' ' LYS . . . -157.11 103.25 1.9 Allowed Pre-proline 0 N--CA 1.492 1.65 0 O-C-N 121.064 -1.257 . . . . 0.0 111.169 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.589 ' HG2' ' CE3' ' A' ' 8' ' ' TRP . 43.3 Cg_endo -77.11 -177.09 3.57 Favored 'Trans proline' 0 C--N 1.304 -1.783 0 O-C-N 124.191 1.627 . . . . 0.0 110.255 179.007 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.495 ' OG ' ' CE ' ' A' ' 11' ' ' LYS . 0.3 OUTLIER -134.44 97.13 3.74 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.083 -1.01 . . . . 0.0 110.374 179.552 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 1.06 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.7 tt -77.45 117.73 23.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.099 -1.001 . . . . 0.0 110.316 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.587 ' O ' ' CE3' ' A' ' 6' ' ' TRP . 14.2 t -112.96 -158.1 0.64 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.307 -0.87 . . . . 0.0 109.79 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.7 t -101.55 129.13 47.58 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.229 -0.92 . . . . 0.0 109.919 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.675 HG22 ' O ' ' A' ' 5' ' ' ARG . 0.9 OUTLIER -122.14 25.48 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.025 -1.047 . . . . 0.0 110.153 -179.697 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.528 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -162.7 94.86 0.88 Allowed 'General case' 0 C--N 1.292 -1.916 0 O-C-N 121.781 -0.575 . . . . 0.0 110.327 179.671 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 23.0 mtm180 -79.92 52.85 1.56 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.991 -1.068 . . . . 0.0 109.777 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.439 ' O ' ' HD2' ' A' ' 2' ' ' LYS . . . -58.63 116.98 4.05 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.465 -0.772 . . . . 0.0 110.271 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.427 ' C ' ' HD2' ' A' ' 2' ' ' LYS . 41.9 m-85 . . . . . 0 N--CA 1.488 1.463 0 CA-C-O 117.943 -1.027 . . . . 0.0 110.319 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.535 ' CD1' ' N ' ' A' ' 2' ' ' LYS . 9.0 t80 . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.266 0.555 . . . . 0.0 110.12 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.535 ' N ' ' CD1' ' A' ' 1' ' ' PHE . 0.7 OUTLIER -140.63 114.3 8.84 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.24 -0.912 . . . . 0.0 110.241 179.961 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.538 ' HB3' ' NE1' ' A' ' 6' ' ' TRP . 0.9 OUTLIER -82.85 -157.86 0.24 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.229 -0.919 . . . . 0.0 110.495 -179.988 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.531 ' HB3' ' CB ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -155.66 -32.43 0.09 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.544 -0.723 . . . . 0.0 111.286 -179.671 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.668 ' O ' HG22 ' A' ' 21' ' ' VAL . 0.0 OUTLIER -136.19 78.38 1.71 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.778 -1.201 . . . . 0.0 111.625 -179.102 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.668 ' HB3' HG12 ' A' ' 18' ' ' ILE . 73.5 m95 -65.94 96.93 0.33 Allowed 'General case' 0 C--N 1.305 -1.355 0 O-C-N 120.961 -1.087 . . . . 0.0 109.64 178.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.536 ' HB3' HG11 ' A' ' 21' ' ' VAL . 28.1 tt0 -84.17 104.41 14.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.114 -0.991 . . . . 0.0 110.415 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 1.03 ' NE1' HD12 ' A' ' 18' ' ' ILE . 49.9 m95 -44.53 105.47 0.06 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.264 -0.897 . . . . 0.0 110.555 179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.598 ' CZ ' HG21 ' A' ' 19' ' ' THR . 28.8 mtt180 -79.23 -177.69 5.81 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.23 -0.919 . . . . 0.0 109.386 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.524 ' SD ' ' N ' ' A' ' 10' ' ' MET . 0.0 OUTLIER -107.31 135.29 49.06 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.033 -1.042 . . . . 0.0 110.016 -179.863 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.524 ' CE ' ' O ' ' A' ' 16' ' ' PRO . 0.2 OUTLIER -134.17 -166.92 1.87 Allowed 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.477 -0.764 . . . . 0.0 109.81 179.89 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -59.63 -164.58 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.319 -0.863 . . . . 0.0 109.894 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.6 167.96 4.05 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.477 -0.764 . . . . 0.0 110.52 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.416 ' O ' ' HB2' ' A' ' 15' ' ' ALA . . . 110.01 -70.42 0.21 Allowed Glycine 0 N--CA 1.488 2.156 0 N-CA-C 109.724 -1.35 . . . . 0.0 109.724 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.988 ' HB1' ' HD2' ' A' ' 16' ' ' PRO . . . -176.01 -178.05 0.31 Allowed Pre-proline 0 N--CA 1.492 1.668 0 O-C-N 121.485 -1.009 . . . . 0.0 110.75 -179.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.988 ' HD2' ' HB1' ' A' ' 15' ' ' ALA . 44.1 Cg_endo -74.08 179.18 6.01 Favored 'Trans proline' 0 C--N 1.308 -1.591 0 O-C-N 124.051 1.553 . . . . 0.0 110.458 179.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -133.88 97.95 4.03 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.264 -0.898 . . . . 0.0 109.847 179.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 1.03 HD12 ' NE1' ' A' ' 8' ' ' TRP . 1.5 tt -75.4 115.08 16.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.212 -0.93 . . . . 0.0 110.176 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.598 HG21 ' CZ ' ' A' ' 9' ' ' ARG . 6.9 t -106.86 -159.22 0.69 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.287 -0.883 . . . . 0.0 109.732 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 44.2 t -107.77 119.22 38.84 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.156 -0.965 . . . . 0.0 110.246 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.668 HG22 ' O ' ' A' ' 5' ' ' ARG . 1.1 m -112.52 28.29 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.162 -0.961 . . . . 0.0 109.806 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.531 ' CB ' ' HB3' ' A' ' 4' ' ' ARG . 0.1 OUTLIER -162.15 126.96 3.32 Favored 'General case' 0 C--N 1.293 -1.891 0 O-C-N 121.918 -0.489 . . . . 0.0 110.019 179.734 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.503 ' HA ' ' CZ ' ' A' ' 1' ' ' PHE . 60.4 mtt85 -105.35 55.06 0.7 Allowed 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.078 -1.013 . . . . 0.0 110.179 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.435 ' O ' ' C ' ' A' ' 25' ' ' PHE . . . -71.77 131.66 43.41 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.366 -0.834 . . . . 0.0 110.211 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.435 ' C ' ' O ' ' A' ' 24' ' ' ALA . 12.0 m-85 . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.393 -179.886 . . . . . . . . 1 1 . 1 stop_ save_