data_1hff_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 1hff _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 ' 4' ' ' SER . . . . . . . . . . . . . 2.0 p . . . . . 0 CA--C 1.518 -0.28 0 CA-C-O 121.396 0.617 . . . . 0.0 110.104 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.76 126.69 45.87 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.063 -179.226 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.401 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -117.7 -15.5 10.12 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.086 -0.961 . . . . 0.0 111.481 -179.627 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.401 ' CB ' ' O ' ' A' ' 6' ' ' HIS . 8.8 mtp180 88.29 155.14 0.09 OUTLIER Pre-proline 0 N--CA 1.478 0.928 0 C-N-CA 123.332 0.653 . . . . 0.0 110.61 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo . . . . . 0 N--CA 1.477 0.537 0 C-N-CA 122.201 1.934 . . . . 0.0 113.43 179.428 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 CA--C 1.523 -0.092 0 CA-C-O 121.42 0.629 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.449 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -99.52 153.45 19.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.715 -179.495 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -133.32 -67.33 0.62 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.754 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 162.6 150.36 0.04 OUTLIER Pre-proline 0 N--CA 1.473 0.689 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.647 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.449 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 42.3 Cg_endo . . . . . 0 C--N 1.345 0.377 0 C-N-CA 122.034 1.823 . . . . 0.0 112.632 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.3 m . . . . . 0 CA--C 1.521 -0.157 0 CA-C-O 121.262 0.553 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.42 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.35 127.89 49.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.063 -179.565 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -108.68 -64.15 1.26 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.458 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 155.77 149.88 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.75 0 CA-C-N 114.821 -1.082 . . . . 0.0 109.474 179.358 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.42 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.4 Cg_endo . . . . . 0 C--N 1.344 0.308 0 C-N-CA 121.829 1.686 . . . . 0.0 112.378 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.462 0.172 0 CA-C-O 121.348 0.594 . . . . 0.0 110.386 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.433 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -93.78 125.78 38.59 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.895 -179.522 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -119.62 -14.42 9.08 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.641 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.433 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 17.9 mtt180 86.17 140.91 0.05 OUTLIER Pre-proline 0 N--CA 1.475 0.778 0 C-N-CA 123.335 0.654 . . . . 0.0 110.226 -179.284 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo . . . . . 0 C--N 1.348 0.519 0 C-N-CA 121.84 1.693 . . . . 0.0 113.538 179.952 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.517 -0.305 0 CA-C-O 121.309 0.576 . . . . 0.0 109.788 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.413 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.6 OUTLIER -99.25 144.27 28.56 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.633 -178.848 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.2 m170 -135.24 -46.43 0.7 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.762 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.1 mtt180 -178.64 160.67 1.1 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.121 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.413 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 39.9 Cg_endo . . . . . 0 C--N 1.345 0.352 0 C-N-CA 121.906 1.737 . . . . 0.0 112.672 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 CA--C 1.519 -0.24 0 CA-C-O 121.348 0.594 . . . . 0.0 110.782 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.442 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER 61.04 118.93 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.283 -0.872 . . . . 0.0 111.601 179.109 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.41 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 2.2 m170 -98.83 -61.44 1.37 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.107 178.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.41 ' CB ' ' O ' ' A' ' 6' ' ' HIS . 1.5 mtt180 148.71 145.8 0.0 OUTLIER Pre-proline 0 N--CA 1.48 1.052 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.486 179.074 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.442 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.8 Cg_endo . . . . . 0 C--N 1.344 0.333 0 C-N-CA 121.899 1.733 . . . . 0.0 112.445 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 CA--C 1.515 -0.367 0 CA-C-O 121.384 0.611 . . . . 0.0 110.062 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -93.63 157.32 16.23 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.852 -178.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -155.2 -48.17 0.08 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.362 -1.29 . . . . 0.0 109.122 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.19 162.26 3.5 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.09 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo . . . . . 0 N--CA 1.476 0.455 0 C-N-CA 121.863 1.709 . . . . 0.0 112.567 179.511 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 121.353 0.597 . . . . 0.0 109.435 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -99.29 158.42 15.71 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.817 -178.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -155.36 -47.32 0.08 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.277 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -161.58 156.81 20.46 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.309 -0.859 . . . . 0.0 109.917 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo . . . . . 0 N--CA 1.474 0.345 0 C-N-CA 121.972 1.781 . . . . 0.0 112.61 -179.994 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 CA--C 1.517 -0.31 0 CA-C-O 121.408 0.623 . . . . 0.0 110.074 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -93.03 167.29 11.89 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.479 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -170.56 -45.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.304 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.41 153.63 0.21 Allowed Pre-proline 0 N--CA 1.466 0.348 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.848 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo . . . . . 0 N--CA 1.476 0.461 0 C-N-CA 121.96 1.773 . . . . 0.0 112.983 179.705 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 CA--C 1.517 -0.308 0 CA-C-O 121.573 0.701 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.43 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 1.2 t90 -92.46 123.68 35.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.819 -1.082 . . . . 0.0 112.037 -178.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -115.54 -33.44 5.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.019 178.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.76 162.02 1.34 Allowed Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.238 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.43 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.5 Cg_endo . . . . . 0 N--CA 1.475 0.43 0 C-N-CA 121.941 1.761 . . . . 0.0 112.77 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 p . . . . . 0 CA--C 1.517 -0.306 0 CA-C-O 121.29 0.567 . . . . 0.0 109.898 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -96.61 147.84 23.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.667 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -140.41 -46.84 0.42 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.603 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -177.45 161.32 1.41 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.164 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo . . . . . 0 N--CA 1.476 0.45 0 C-N-CA 121.974 1.782 . . . . 0.0 113.249 -179.835 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 p . . . . . 0 CA--C 1.522 -0.112 0 CA-C-O 121.171 0.51 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.411 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -119.14 130.82 55.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.906 -179.624 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.04 -16.44 10.48 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.319 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.411 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 3.3 mtt180 82.02 147.39 0.1 Allowed Pre-proline 0 N--CA 1.473 0.709 0 C-N-CA 122.668 0.387 . . . . 0.0 110.308 -179.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo . . . . . 0 N--CA 1.474 0.348 0 C-N-CA 121.72 1.613 . . . . 0.0 112.397 178.892 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.519 -0.221 0 CA-C-O 121.285 0.564 . . . . 0.0 110.354 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -96.33 170.91 8.91 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.107 -179.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -170.1 -44.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.911 -1.04 . . . . 0.0 109.577 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.4 mtt85 179.77 158.09 0.77 Allowed Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.143 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo . . . . . 0 C--N 1.343 0.277 0 C-N-CA 121.955 1.77 . . . . 0.0 112.376 179.787 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.6 t . . . . . 0 CA--C 1.52 -0.2 0 CA-C-O 121.347 0.594 . . . . 0.0 110.469 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.425 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.3 OUTLIER -97.76 142.72 29.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.132 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -132.8 -48.93 0.88 Allowed 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.683 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 172.14 157.43 0.25 Allowed Pre-proline 0 CA--C 1.535 0.372 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.021 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.425 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.0 Cg_endo . . . . . 0 N--CA 1.473 0.293 0 C-N-CA 121.97 1.78 . . . . 0.0 112.365 179.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 CA--C 1.521 -0.159 0 CA-C-O 121.292 0.568 . . . . 0.0 110.399 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.428 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -99.76 147.47 25.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.009 -179.364 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -135.66 -55.69 0.78 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.541 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 167.4 153.34 0.11 Allowed Pre-proline 0 N--CA 1.468 0.467 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.778 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.428 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.4 Cg_endo . . . . . 0 C--N 1.343 0.281 0 C-N-CA 121.883 1.722 . . . . 0.0 112.327 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.7 p . . . . . 0 CA--C 1.518 -0.281 0 CA-C-O 121.32 0.581 . . . . 0.0 110.099 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -91.77 147.67 22.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.239 -178.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.66 -48.98 0.43 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.605 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 178.87 157.27 0.63 Allowed Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.282 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo . . . . . 0 N--CA 1.474 0.372 0 C-N-CA 121.977 1.785 . . . . 0.0 112.544 179.866 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.1 p . . . . . 0 CA--C 1.517 -0.303 0 CA-C-O 121.422 0.63 . . . . 0.0 110.141 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.421 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -90.54 135.06 33.94 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.48 -178.942 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -127.36 -46.4 1.48 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.746 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.4 mtp85 176.74 158.85 0.46 Allowed Pre-proline 0 CA--C 1.534 0.337 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.919 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.421 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.2 Cg_endo . . . . . 0 N--CA 1.476 0.461 0 C-N-CA 121.841 1.694 . . . . 0.0 112.725 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.8 m . . . . . 0 CA--C 1.52 -0.175 0 CA-C-O 121.256 0.551 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.446 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.2 OUTLIER -89.24 123.25 33.29 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.732 -179.372 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.405 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -123.65 -15.42 7.03 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.08 -179.238 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.446 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 32.9 mtp180 91.89 146.89 0.05 OUTLIER Pre-proline 0 N--CA 1.48 1.046 0 C-N-CA 123.83 0.852 . . . . 0.0 110.334 -179.195 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo . . . . . 0 N--CA 1.477 0.513 0 C-N-CA 121.924 1.749 . . . . 0.0 113.011 179.334 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.1 m . . . . . 0 CA--C 1.518 -0.261 0 CA-C-O 121.63 0.729 . . . . 0.0 110.531 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -108.15 157.78 18.0 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.354 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -153.14 -49.96 0.1 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.03 179.393 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 168.74 153.14 0.13 Allowed Pre-proline 0 N--CA 1.467 0.377 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.954 179.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo . . . . . 0 C--N 1.344 0.323 0 C-N-CA 121.984 1.79 . . . . 0.0 112.693 179.975 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.7 p . . . . . 0 CA--C 1.522 -0.115 0 CA-C-O 121.264 0.554 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.476 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -73.47 128.05 34.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.617 -179.73 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.4 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -125.51 -14.67 6.3 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.179 -178.981 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.476 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 27.8 mtm180 87.26 143.28 0.05 OUTLIER Pre-proline 0 N--CA 1.476 0.829 0 C-N-CA 123.245 0.618 . . . . 0.0 110.495 -179.258 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo . . . . . 0 N--CA 1.477 0.558 0 C-N-CA 121.927 1.751 . . . . 0.0 112.886 179.302 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.0 p . . . . . 0 C--O 1.231 0.115 0 CA-C-O 121.262 0.553 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -105.54 127.76 53.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.452 -179.749 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -117.66 -15.82 10.13 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.617 -179.287 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 84.39 145.62 0.08 OUTLIER Pre-proline 0 N--CA 1.476 0.841 0 C-N-CA 122.822 0.449 . . . . 0.0 110.127 -179.409 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo . . . . . 0 C--N 1.347 0.465 0 C-N-CA 121.825 1.683 . . . . 0.0 112.931 179.32 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.6 m . . . . . 0 CA--C 1.519 -0.224 0 CA-C-O 121.394 0.616 . . . . 0.0 110.507 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -96.84 168.39 10.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.337 -179.257 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -164.48 -63.24 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.977 -1.01 . . . . 0.0 109.203 179.788 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.43 151.85 0.2 Allowed Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.915 179.322 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo . . . . . 0 N--CA 1.475 0.384 0 C-N-CA 122.133 1.889 . . . . 0.0 113.051 179.985 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.522 -0.131 0 CA-C-O 121.289 0.566 . . . . 0.0 110.516 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.429 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -140.2 147.43 40.06 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.424 -179.544 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.406 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 2.2 m-70 -123.03 -66.94 0.98 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.048 178.94 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.406 ' CB ' ' O ' ' A' ' 6' ' ' HIS . 16.8 mtp180 149.24 143.21 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.938 0 CA-C-N 114.776 -1.102 . . . . 0.0 109.534 178.936 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.429 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 43.1 Cg_endo . . . . . 0 C--N 1.347 0.451 0 C-N-CA 121.964 1.776 . . . . 0.0 112.384 179.546 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 31.1 t . . . . . 0 CA--C 1.517 -0.307 0 CA-C-O 121.469 0.652 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.422 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.8 OUTLIER -90.88 134.67 34.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.271 -179.13 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.2 m170 -124.03 -45.94 1.98 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.019 179.507 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.5 mtp85 173.31 160.33 0.29 Allowed Pre-proline 0 N--CA 1.466 0.326 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.016 179.926 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.422 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.0 Cg_endo . . . . . 0 N--CA 1.473 0.307 0 C-N-CA 121.897 1.732 . . . . 0.0 112.596 179.643 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.1 m . . . . . 0 CA--C 1.512 -0.488 0 CA-C-O 121.404 0.621 . . . . 0.0 109.373 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.4 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 1.0 OUTLIER -97.11 139.5 33.01 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.021 -178.57 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -130.76 -44.29 1.08 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.748 -1.115 . . . . 0.0 109.708 179.293 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.4 mtp85 -171.07 161.8 5.42 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.013 -179.981 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.4 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.2 Cg_endo . . . . . 0 N--CA 1.475 0.422 0 C-N-CA 121.898 1.732 . . . . 0.0 112.646 179.678 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.3 m . . . . . 0 CA--C 1.52 -0.192 0 CA-C-O 121.679 0.752 . . . . 0.0 109.884 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.424 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -39.24 137.55 0.73 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.434 -1.257 . . . . 0.0 113.512 -178.698 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -130.96 -48.75 1.02 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.38 -1.282 . . . . 0.0 108.864 178.582 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.7 mtp180 165.16 154.33 0.07 OUTLIER Pre-proline 0 N--CA 1.468 0.473 0 CA-C-N 115.186 -0.916 . . . . 0.0 109.846 179.019 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.424 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.1 Cg_endo . . . . . 0 N--CA 1.475 0.399 0 C-N-CA 121.944 1.763 . . . . 0.0 112.687 -179.977 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.8 t . . . . . 0 CA--C 1.514 -0.408 0 CA-C-O 121.597 0.713 . . . . 0.0 109.887 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -63.84 134.79 55.85 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.672 -1.149 . . . . 0.0 112.262 -178.614 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -122.6 -43.21 2.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.469 -1.241 . . . . 0.0 109.619 179.071 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.47 167.34 1.01 Allowed Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.678 179.865 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo . . . . . 0 N--CA 1.475 0.414 0 C-N-CA 122.07 1.847 . . . . 0.0 112.778 179.514 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.519 -0.242 0 CA-C-O 121.35 0.595 . . . . 0.0 110.063 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -95.48 149.42 21.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.401 -179.172 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -145.81 -48.6 0.22 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.381 179.472 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 179.38 157.39 0.7 Allowed Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.091 179.552 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo . . . . . 0 N--CA 1.473 0.29 0 C-N-CA 121.939 1.759 . . . . 0.0 112.635 179.839 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.52 -0.197 0 CA-C-O 121.211 0.529 . . . . 0.0 110.552 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.74 173.75 10.05 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.364 -179.727 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 -169.68 -56.75 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 114.575 -1.193 . . . . 0.0 108.823 179.62 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 169.43 151.37 0.14 Allowed Pre-proline 0 N--CA 1.467 0.402 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.755 178.812 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo . . . . . 0 C--N 1.344 0.311 0 C-N-CA 121.906 1.738 . . . . 0.0 112.536 179.998 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.8 m . . . . . 0 CA--C 1.519 -0.24 0 CA-C-O 121.618 0.723 . . . . 0.0 110.72 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.423 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -82.74 117.75 22.88 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.833 -178.923 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -111.99 -34.66 5.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.855 178.852 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 170.77 158.44 0.21 Allowed Pre-proline 0 CA--C 1.536 0.437 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.312 179.513 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.423 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 42.3 Cg_endo . . . . . 0 N--CA 1.476 0.483 0 C-N-CA 122.177 1.918 . . . . 0.0 113.249 -179.664 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.9 p . . . . . 0 CA--C 1.519 -0.244 0 CA-C-O 121.303 0.573 . . . . 0.0 110.006 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.42 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -101.36 139.78 36.56 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.223 -179.222 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -128.83 -48.93 1.24 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.638 179.456 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.7 mtp85 167.37 155.29 0.12 Allowed Pre-proline 0 N--CA 1.468 0.472 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.794 179.875 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.42 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.3 Cg_endo . . . . . 0 N--CA 1.474 0.354 0 C-N-CA 121.925 1.75 . . . . 0.0 112.524 -179.933 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.521 -0.172 0 CA-C-O 121.395 0.617 . . . . 0.0 110.291 . . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.422 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -106.32 153.75 21.75 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.213 -179.47 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -143.7 -55.13 0.38 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.181 179.523 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.8 mtt180 165.33 151.73 0.06 OUTLIER Pre-proline 0 N--CA 1.469 0.513 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.717 179.408 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.422 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.4 Cg_endo . . . . . 0 C--N 1.344 0.318 0 C-N-CA 121.856 1.704 . . . . 0.0 112.572 179.958 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.522 -0.13 0 CA-C-O 121.198 0.523 . . . . 0.0 110.396 . . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.428 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.52 152.66 20.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.179 -179.36 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -142.78 -52.51 0.38 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.524 179.636 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 169.97 154.74 0.18 Allowed Pre-proline 0 N--CA 1.468 0.445 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.866 179.679 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.428 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo . . . . . 0 N--CA 1.473 0.32 0 C-N-CA 121.83 1.686 . . . . 0.0 112.568 179.854 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 CA--C 1.519 -0.248 0 CA-C-O 121.494 0.664 . . . . 0.0 110.411 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -69.27 158.99 33.92 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.043 -179.396 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -152.47 -49.34 0.1 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.562 179.834 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 176.19 156.42 0.41 Allowed Pre-proline 0 CA--C 1.533 0.315 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.013 179.67 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo . . . . . 0 N--CA 1.473 0.275 0 C-N-CA 121.951 1.768 . . . . 0.0 112.598 179.958 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.6 m . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.313 0.577 . . . . 0.0 110.351 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -104.3 159.18 15.92 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.48 -179.3 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -152.28 -48.61 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.407 179.563 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 177.22 159.14 0.5 Allowed Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.084 179.724 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo . . . . . 0 N--CA 1.475 0.402 0 C-N-CA 121.902 1.735 . . . . 0.0 112.698 179.774 . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 7.7 t . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.343 0.592 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.45 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -81.67 119.21 23.53 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.728 -179.391 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.418 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 4.9 m-70 -117.01 -19.16 9.89 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.776 -179.381 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.45 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 32.0 mtt180 94.57 148.17 0.04 OUTLIER Pre-proline 0 N--CA 1.482 1.138 0 C-N-CA 123.952 0.901 . . . . 0.0 110.336 -179.423 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo . . . . . 0 N--CA 1.476 0.484 0 C-N-CA 121.881 1.72 . . . . 0.0 112.723 179.309 . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.151 0 CA-C-O 121.244 0.545 . . . . 0.0 110.579 . . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.432 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.3 153.56 19.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.041 -179.514 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -143.54 -54.46 0.38 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.69 179.505 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 171.53 154.14 0.22 Allowed Pre-proline 0 N--CA 1.467 0.381 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.077 179.755 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.432 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.4 Cg_endo . . . . . 0 N--CA 1.474 0.343 0 C-N-CA 121.87 1.714 . . . . 0.0 112.654 179.996 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.1 m . . . . . 0 CA--C 1.519 -0.243 0 CA-C-O 121.359 0.6 . . . . 0.0 110.131 . . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -93.38 172.42 8.29 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.129 -179.247 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 4.1 t-160 -173.89 -42.64 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.729 179.745 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.3 mtt85 -179.93 155.75 0.73 Allowed Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.235 179.433 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo . . . . . 0 C--N 1.344 0.341 0 C-N-CA 121.951 1.767 . . . . 0.0 112.704 -179.852 . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.521 -0.136 0 CA-C-O 121.132 0.492 . . . . 0.0 110.16 . . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -103.12 163.57 12.15 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.555 0.693 . . . . 0.0 111.362 -179.31 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -159.9 -48.51 0.05 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.255 179.688 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.16 157.7 0.37 Allowed Pre-proline 0 CA--C 1.532 0.278 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.959 179.54 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo . . . . . 0 N--CA 1.474 0.333 0 C-N-CA 121.864 1.709 . . . . 0.0 112.614 179.537 . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.7 m . . . . . 0 CA--C 1.517 -0.321 0 CA-C-O 121.544 0.688 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -61.65 153.43 28.03 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.937 -1.028 . . . . 0.0 111.382 -179.179 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -146.64 -49.41 0.2 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.636 -1.165 . . . . 0.0 109.426 179.643 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.4 mtt180 176.09 157.34 0.41 Allowed Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.119 179.683 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo . . . . . 0 N--CA 1.474 0.375 0 C-N-CA 121.872 1.715 . . . . 0.0 112.663 179.838 . . . . . . . . 0 0 . 1 . 041 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.5 p . . . . . 0 CA--C 1.52 -0.205 0 CA-C-O 121.582 0.706 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 041 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.434 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -98.86 132.7 44.0 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.018 -179.532 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.95 -62.11 1.59 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.211 179.226 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.8 mtp180 159.85 147.3 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.69 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.452 179.199 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.434 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.5 Cg_endo . . . . . 0 C--N 1.344 0.341 0 C-N-CA 121.905 1.737 . . . . 0.0 112.61 179.897 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 CA--C 1.518 -0.257 0 CA-C-O 121.532 0.682 . . . . 0.0 110.612 . . . . . . . . . 0 0 . 1 . 042 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.42 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER 61.29 118.88 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.65 179.279 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -110.77 -49.61 3.02 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.014 178.53 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 158.92 151.57 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.719 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.631 179.239 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.42 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo . . . . . 0 N--CA 1.474 0.377 0 C-N-CA 121.833 1.689 . . . . 0.0 112.624 179.872 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.7 m . . . . . 0 CA--C 1.518 -0.274 0 CA-C-O 121.469 0.652 . . . . 0.0 110.383 . . . . . . . . . 0 0 . 1 . 043 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.402 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -116.32 158.6 23.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.908 -178.971 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -152.04 -50.44 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.609 -1.178 . . . . 0.0 108.752 179.319 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.9 mtp180 168.68 153.97 0.14 Allowed Pre-proline 0 N--CA 1.466 0.338 0 CA-C-N 115.032 -0.985 . . . . 0.0 109.723 179.175 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.402 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.2 Cg_endo . . . . . 0 N--CA 1.473 0.303 0 C-N-CA 121.963 1.776 . . . . 0.0 112.598 -179.932 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 74.0 m . . . . . 0 CA--C 1.517 -0.304 0 CA-C-O 121.559 0.695 . . . . 0.0 110.342 . . . . . . . . . 0 0 . 1 . 044 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -67.64 166.9 14.11 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.44 -179.336 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -166.37 -45.9 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.352 179.793 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 176.33 153.38 0.37 Allowed Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.871 179.507 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo . . . . . 0 N--CA 1.476 0.455 0 C-N-CA 122.046 1.831 . . . . 0.0 113.187 -179.75 . . . . . . . . 0 0 . 1 . 045 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.517 -0.31 0 CA-C-O 121.5 0.667 . . . . 0.0 110.512 . . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.415 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -111.6 142.82 43.42 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.914 -179.245 . . . . . . . . 3 3 . 1 . 045 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -134.84 -51.37 0.78 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.567 -1.197 . . . . 0.0 108.782 178.939 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.1 mtt180 168.21 157.45 0.15 Allowed Pre-proline 0 N--CA 1.465 0.305 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.466 179.456 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.415 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 39.8 Cg_endo . . . . . 0 N--CA 1.475 0.403 0 C-N-CA 121.67 1.58 . . . . 0.0 112.581 179.335 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.5 p . . . . . 0 CA--C 1.521 -0.17 0 CA-C-O 121.431 0.634 . . . . 0.0 110.488 . . . . . . . . . 0 0 . 1 . 046 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.412 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -70.49 128.85 37.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.554 -179.724 . . . . . . . . 3 3 . 1 . 046 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.99 -15.76 9.92 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.683 -179.159 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.412 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER 83.94 148.3 0.1 OUTLIER Pre-proline 0 N--CA 1.476 0.858 0 C-N-CA 122.713 0.405 . . . . 0.0 110.117 -179.154 . . . . . . . . 3 3 . 1 . 046 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo . . . . . 0 C--N 1.342 0.235 0 C-N-CA 121.754 1.636 . . . . 0.0 112.673 179.125 . . . . . . . . 0 0 . 1 . 047 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.522 -0.134 0 CA-C-O 121.228 0.537 . . . . 0.0 109.965 . . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.406 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.56 151.26 22.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.323 -179.177 . . . . . . . . 3 3 . 1 . 047 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -143.01 -50.05 0.34 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.468 179.464 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 173.51 155.82 0.28 Allowed Pre-proline 0 N--CA 1.466 0.341 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.027 179.742 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.6 Cg_endo . . . . . 0 N--CA 1.474 0.344 0 C-N-CA 121.904 1.736 . . . . 0.0 112.523 179.944 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.522 -0.117 0 CA-C-O 121.186 0.517 . . . . 0.0 110.337 . . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.406 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -109.73 155.62 21.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.479 -179.398 . . . . . . . . 3 3 . 1 . 048 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.28 -49.44 0.14 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.199 179.356 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 175.91 156.63 0.4 Allowed Pre-proline 0 CA--C 1.534 0.345 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.824 179.394 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo . . . . . 0 N--CA 1.474 0.325 0 C-N-CA 121.961 1.774 . . . . 0.0 112.548 -179.974 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.1 m . . . . . 0 C--O 1.232 0.139 0 CA-C-O 121.058 0.456 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 049 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.409 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -162.41 162.12 27.57 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.686 0.755 . . . . 0.0 111.788 -179.87 . . . . . . . . 3 3 . 1 . 049 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -154.03 -51.0 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.884 179.377 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 165.52 154.15 0.08 OUTLIER Pre-proline 0 N--CA 1.468 0.468 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.978 179.24 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.409 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.3 Cg_endo . . . . . 0 C--N 1.343 0.245 0 C-N-CA 121.936 1.757 . . . . 0.0 112.371 179.624 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.0 m . . . . . 0 CA--C 1.516 -0.328 0 CA-C-O 121.636 0.731 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 050 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.425 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER 61.42 117.81 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.74 179.091 . . . . . . . . 3 3 . 1 . 050 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -112.57 -45.23 3.25 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.761 -1.108 . . . . 0.0 108.96 178.34 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.2 mtt180 162.43 153.65 0.04 OUTLIER Pre-proline 0 N--CA 1.47 0.556 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.89 179.268 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.425 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.0 Cg_endo . . . . . 0 N--CA 1.473 0.323 0 C-N-CA 121.912 1.741 . . . . 0.0 112.613 -179.953 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 CA--C 1.52 -0.199 0 CA-C-O 121.257 0.551 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 051 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.411 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -97.43 153.81 17.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.031 -179.457 . . . . . . . . 3 3 . 1 . 051 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -143.75 -59.74 0.4 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.427 179.622 . . . . . . . . 2 2 . 1 . 051 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 172.79 153.49 0.24 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.922 179.588 . . . . . . . . 2 2 . 1 . 051 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.411 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.4 Cg_endo . . . . . 0 N--CA 1.473 0.318 0 C-N-CA 121.855 1.704 . . . . 0.0 112.507 179.871 . . . . . . . . 1 1 . 1 . 052 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 70.7 m . . . . . 0 C--O 1.234 0.267 0 CA-C-O 121.398 0.618 . . . . 0.0 110.497 . . . . . . . . . 0 0 . 1 . 052 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.429 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER 62.94 -173.77 0.15 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.69 0.757 . . . . 0.0 110.36 179.551 . . . . . . . . 3 3 . 1 . 052 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 174.24 -45.11 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.616 -1.174 . . . . 0.0 108.623 -179.762 . . . . . . . . 2 2 . 1 . 052 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 164.29 154.4 0.06 OUTLIER Pre-proline 0 N--CA 1.468 0.429 0 CA-C-N 114.86 -1.064 . . . . 0.0 109.703 179.179 . . . . . . . . 2 2 . 1 . 052 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.429 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.3 Cg_endo . . . . . 0 N--CA 1.473 0.312 0 C-N-CA 121.864 1.709 . . . . 0.0 112.513 179.882 . . . . . . . . 1 1 . 1 . 053 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.519 -0.242 0 CA-C-O 121.367 0.603 . . . . 0.0 110.614 . . . . . . . . . 1 1 . 1 . 053 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.424 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -177.59 145.21 0.41 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.816 179.799 . . . . . . . . 3 3 . 1 . 053 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -134.96 -51.12 0.77 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.547 -1.206 . . . . 0.0 108.898 178.819 . . . . . . . . 2 2 . 1 . 053 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 160.18 152.91 0.03 OUTLIER Pre-proline 0 N--CA 1.471 0.606 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.606 179.364 . . . . . . . . 1 1 . 1 . 053 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.424 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo . . . . . 0 N--CA 1.473 0.319 0 C-N-CA 121.911 1.741 . . . . 0.0 112.537 179.784 . . . . . . . . 1 1 . 1 . 054 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.8 m . . . . . 0 CA--C 1.519 -0.245 0 CA-C-O 121.305 0.574 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 054 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -107.71 172.71 6.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.66 -179.061 . . . . . . . . 2 2 . 1 . 054 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -176.63 -43.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.606 -1.179 . . . . 0.0 109.081 179.902 . . . . . . . . 2 2 . 1 . 054 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 173.84 154.26 0.28 Allowed Pre-proline 0 CA--C 1.534 0.338 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.805 179.284 . . . . . . . . 2 2 . 1 . 054 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo . . . . . 0 C--N 1.343 0.263 0 C-N-CA 121.853 1.702 . . . . 0.0 112.794 -179.763 . . . . . . . . 0 0 . 1 . 055 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 m . . . . . 0 CA--C 1.52 -0.186 0 CA-C-O 121.302 0.572 . . . . 0.0 110.617 . . . . . . . . . 0 0 . 1 . 055 nuclear orig core ' A' A ' 5' ' ' TRP . . . . . 0.425 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -119.27 171.25 8.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.426 -179.601 . . . . . . . . 3 3 . 1 . 055 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -160.07 -64.99 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.168 179.596 . . . . . . . . 2 2 . 1 . 055 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.1 mtp180 169.54 150.89 0.14 Allowed Pre-proline 0 N--CA 1.468 0.453 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.857 179.043 . . . . . . . . 1 1 . 1 . 055 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.425 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.6 Cg_endo . . . . . 0 C--N 1.345 0.344 0 C-N-CA 121.924 1.749 . . . . 0.0 112.613 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.0 mp . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -148.08 -115.65 0.84 Allowed Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -127.78 -166.73 1.65 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.923 0.392 . . . . 0.0 110.297 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.0 p -63.39 131.93 49.81 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.396 0.617 . . . . 0.0 110.104 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.76 126.69 45.87 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.063 -179.226 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.401 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -117.7 -15.5 10.12 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.086 -0.961 . . . . 0.0 111.481 -179.627 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.401 ' CB ' ' O ' ' A' ' 6' ' ' HIS . 8.8 mtp180 88.29 155.14 0.09 OUTLIER Pre-proline 0 N--CA 1.478 0.928 0 C-N-CA 123.332 0.653 . . . . 0.0 110.61 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -83.01 45.83 1.99 Allowed 'Trans proline' 0 N--CA 1.477 0.537 0 C-N-CA 122.201 1.934 . . . . 0.0 113.43 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 53.12 75.8 0.23 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.259 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.219 -0.524 0 CA-C-O 118.022 -0.99 . . . . 0.0 110.371 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 114.55 70.77 0.51 Allowed Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.2 173.87 15.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.983 0.42 . . . . 0.0 110.247 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.2 m -150.27 155.98 40.71 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.42 0.629 . . . . 0.0 110.985 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.449 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -99.52 153.45 19.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.715 -179.495 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -133.32 -67.33 0.62 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.754 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 162.6 150.36 0.04 OUTLIER Pre-proline 0 N--CA 1.473 0.689 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.647 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.449 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 42.3 Cg_endo -86.12 52.6 2.96 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.034 1.823 . . . . 0.0 112.632 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.8 t70 60.12 39.02 20.05 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.447 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt . . . . . 0 C--O 1.22 -0.487 0 CA-C-O 118.064 -0.969 . . . . 0.0 110.364 -179.999 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.1 mp . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 109.335 -0.616 . . . . 0.0 109.335 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 86.6 -125.35 7.37 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.71 -173.61 0.13 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.044 0.45 . . . . 0.0 110.553 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.3 m -111.38 152.48 27.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.534 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.42 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.35 127.89 49.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.063 -179.565 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -108.68 -64.15 1.26 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.458 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 155.77 149.88 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.75 0 CA-C-N 114.821 -1.082 . . . . 0.0 109.474 179.358 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.42 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.4 Cg_endo -84.19 55.71 4.72 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 121.829 1.686 . . . . 0.0 112.378 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -151.34 49.2 0.83 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.468 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 118.007 -0.996 . . . . 0.0 110.622 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.1 tp . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -108.58 68.39 0.22 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -133.65 -172.6 3.01 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.11 0.481 . . . . 0.0 110.486 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 63.23 120.89 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.386 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.433 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -93.78 125.78 38.59 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.895 -179.522 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -119.62 -14.42 9.08 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.641 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.433 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 17.9 mtt180 86.17 140.91 0.05 OUTLIER Pre-proline 0 N--CA 1.475 0.778 0 C-N-CA 123.335 0.654 . . . . 0.0 110.226 -179.284 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -84.19 46.8 2.06 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 121.84 1.693 . . . . 0.0 113.538 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -128.38 118.15 22.66 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.233 0.54 . . . . 0.0 110.482 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.5 tttt . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.334 -179.907 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.7 mm? . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -79.64 162.15 46.96 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.513 -1.035 . . . . 0.0 110.513 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.71 -165.48 0.21 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 120.83 0.348 . . . . 0.0 110.295 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.43 158.33 15.65 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.309 0.576 . . . . 0.0 109.788 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.413 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.6 OUTLIER -99.25 144.27 28.56 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.633 -178.848 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.2 m170 -135.24 -46.43 0.7 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.762 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.1 mtt180 -178.64 160.67 1.1 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.121 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.413 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 39.9 Cg_endo -81.29 56.73 6.14 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 121.906 1.737 . . . . 0.0 112.672 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.9 t0 61.46 156.09 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.527 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.3 tttt . . . . . 0 C--O 1.22 -0.458 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.439 179.998 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 14.2 mt . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 97.39 169.84 33.11 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 110.874 -0.89 . . . . 0.0 110.874 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -94.09 67.54 3.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.519 0.676 . . . . 0.0 110.368 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.2 m 60.48 33.81 20.53 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.782 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.442 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER 61.04 118.93 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.283 -0.872 . . . . 0.0 111.601 179.109 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.41 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 2.2 m170 -98.83 -61.44 1.37 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.107 178.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.41 ' CB ' ' O ' ' A' ' 6' ' ' HIS . 1.5 mtt180 148.71 145.8 0.0 OUTLIER Pre-proline 0 N--CA 1.48 1.052 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.486 179.074 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.442 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.8 Cg_endo -85.55 55.58 3.97 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 121.899 1.733 . . . . 0.0 112.445 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -156.74 -179.49 8.25 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.465 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 43.9 mttm . . . . . 0 C--O 1.22 -0.448 0 CA-C-O 117.963 -1.017 . . . . 0.0 110.438 179.96 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -137.99 30.61 2.54 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 111.091 -0.803 . . . . 0.0 111.091 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -169.27 131.07 1.17 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.224 0.535 . . . . 0.0 110.658 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.4 m -172.18 136.22 0.83 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.062 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -93.63 157.32 16.23 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.852 -178.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -155.2 -48.17 0.08 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.362 -1.29 . . . . 0.0 109.122 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.19 162.26 3.5 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.09 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -81.1 55.28 5.6 Favored 'Trans proline' 0 N--CA 1.476 0.455 0 C-N-CA 121.863 1.709 . . . . 0.0 112.567 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -175.23 97.92 0.08 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.976 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.8 mtmt . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.417 -179.738 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 161.15 -169.65 36.78 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.1 -165.71 0.22 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.97 0.414 . . . . 0.0 110.271 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.53 165.58 14.2 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.353 0.597 . . . . 0.0 109.435 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -99.29 158.42 15.71 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.817 -178.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -155.36 -47.32 0.08 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.277 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -161.58 156.81 20.46 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.309 -0.859 . . . . 0.0 109.917 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -83.58 55.45 4.92 Favored 'Trans proline' 0 N--CA 1.474 0.345 0 C-N-CA 121.972 1.781 . . . . 0.0 112.61 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -96.09 87.45 4.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.393 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.2 mtpt . . . . . 0 C--O 1.221 -0.436 0 CA-C-O 117.929 -1.034 . . . . 0.0 110.346 179.952 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -163.63 -109.22 0.23 Allowed Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -175.86 -178.21 1.03 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.026 0.441 . . . . 0.0 110.543 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.3 m -116.94 164.13 15.16 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.074 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -93.03 167.29 11.89 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.479 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -170.56 -45.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.304 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.41 153.63 0.21 Allowed Pre-proline 0 N--CA 1.466 0.348 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.848 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -86.07 47.44 1.83 Allowed 'Trans proline' 0 N--CA 1.476 0.461 0 C-N-CA 121.96 1.773 . . . . 0.0 112.983 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.8 t70 60.1 81.48 0.18 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.595 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.6 tttt . . . . . 0 C--O 1.219 -0.511 0 CA-C-O 118.064 -0.97 . . . . 0.0 110.597 179.996 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.4 mp . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -93.93 117.02 5.38 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.16 177.44 7.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.072 0.463 . . . . 0.0 110.406 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.4 t -178.52 158.32 1.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.573 0.701 . . . . 0.0 110.772 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.43 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 1.2 t90 -92.46 123.68 35.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.819 -1.082 . . . . 0.0 112.037 -178.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -115.54 -33.44 5.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.019 178.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.76 162.02 1.34 Allowed Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.238 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.43 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.5 Cg_endo -81.89 55.35 5.43 Favored 'Trans proline' 0 N--CA 1.475 0.43 0 C-N-CA 121.941 1.761 . . . . 0.0 112.77 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -107.28 64.34 0.63 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.377 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.2 tptp . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 118.055 -0.974 . . . . 0.0 110.545 179.955 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 165.23 86.22 0.06 OUTLIER Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -88.12 111.9 22.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.199 0.523 . . . . 0.0 110.689 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 p -105.22 145.82 30.12 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.898 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -96.61 147.84 23.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.667 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -140.41 -46.84 0.42 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.603 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -177.45 161.32 1.41 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.164 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -81.17 54.44 5.21 Favored 'Trans proline' 0 N--CA 1.476 0.45 0 C-N-CA 121.974 1.782 . . . . 0.0 113.249 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 57.24 -176.5 0.06 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.813 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.316 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.2 mp . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 169.74 -165.56 38.92 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.751 -0.939 . . . . 0.0 110.751 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -90.19 179.35 5.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.029 0.442 . . . . 0.0 110.447 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 p -99.52 132.94 44.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.275 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.411 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -119.14 130.82 55.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.906 -179.624 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.04 -16.44 10.48 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.319 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.411 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 3.3 mtt180 82.02 147.39 0.1 Allowed Pre-proline 0 N--CA 1.473 0.709 0 C-N-CA 122.668 0.387 . . . . 0.0 110.308 -179.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -83.43 52.13 3.78 Favored 'Trans proline' 0 N--CA 1.474 0.348 0 C-N-CA 121.72 1.613 . . . . 0.0 112.397 178.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 41.94 95.65 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 115.406 -0.815 . . . . 0.0 112.014 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.6 ttpt . . . . . 0 C--O 1.22 -0.458 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.578 -179.99 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 4.4 tp . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 148.6 -83.52 0.18 Allowed Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.731 -0.948 . . . . 0.0 110.731 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.82 162.29 0.06 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.101 0.477 . . . . 0.0 110.6 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -124.87 155.82 38.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.354 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -96.33 170.91 8.91 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.107 -179.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -170.1 -44.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.911 -1.04 . . . . 0.0 109.577 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.4 mtt85 179.77 158.09 0.77 Allowed Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.143 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -82.28 57.8 6.33 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 121.955 1.77 . . . . 0.0 112.376 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.5 t70 64.31 68.45 0.55 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.328 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.5 pttt . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.572 -179.973 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -130.25 58.59 0.7 Allowed Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.822 -0.911 . . . . 0.0 110.822 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -90.45 162.1 15.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.008 0.432 . . . . 0.0 110.481 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.6 t -118.25 156.01 29.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.469 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.425 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.3 OUTLIER -97.76 142.72 29.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.132 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -132.8 -48.93 0.88 Allowed 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.683 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 172.14 157.43 0.25 Allowed Pre-proline 0 CA--C 1.535 0.372 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.021 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.425 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.0 Cg_endo -83.21 56.98 5.7 Favored 'Trans proline' 0 N--CA 1.473 0.293 0 C-N-CA 121.97 1.78 . . . . 0.0 112.365 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -68.68 116.89 9.71 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.496 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.7 mttm . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.398 179.966 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.0 tt . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -62.02 -74.74 0.37 Allowed Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.819 -0.912 . . . . 0.0 110.819 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.64 -177.75 0.11 Allowed 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.014 0.435 . . . . 0.0 110.4 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.9 p -130.42 156.27 45.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.399 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.428 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -99.76 147.47 25.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.009 -179.364 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -135.66 -55.69 0.78 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.541 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 167.4 153.34 0.11 Allowed Pre-proline 0 N--CA 1.468 0.467 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.778 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.428 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.4 Cg_endo -84.15 56.74 5.1 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 121.883 1.722 . . . . 0.0 112.327 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -169.42 84.74 0.14 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.31 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.404 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 7.3 mt . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 95.2 -119.01 6.03 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -72.47 -171.85 0.86 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.069 0.461 . . . . 0.0 110.469 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.7 p -123.25 166.68 14.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.099 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -91.77 147.67 22.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.239 -178.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.66 -48.98 0.43 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.605 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 178.87 157.27 0.63 Allowed Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.282 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -82.9 56.6 5.69 Favored 'Trans proline' 0 N--CA 1.474 0.372 0 C-N-CA 121.977 1.785 . . . . 0.0 112.544 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -132.59 118.03 18.68 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.47 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.1 ttpp . . . . . 0 C--O 1.22 -0.477 0 CA-C-O 118.103 -0.951 . . . . 0.0 110.428 -179.977 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.4 tp . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 105.79 -159.91 15.08 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.799 -0.92 . . . . 0.0 110.799 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.69 167.79 20.69 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.207 0.527 . . . . 0.0 110.643 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.1 p -150.52 158.22 43.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.141 179.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.421 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -90.54 135.06 33.94 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.48 -178.942 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -127.36 -46.4 1.48 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.746 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.4 mtp85 176.74 158.85 0.46 Allowed Pre-proline 0 CA--C 1.534 0.337 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.919 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.421 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.2 Cg_endo -82.04 56.03 5.67 Favored 'Trans proline' 0 N--CA 1.476 0.461 0 C-N-CA 121.841 1.694 . . . . 0.0 112.725 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -90.91 89.1 7.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.511 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? . . . . . 0 C--O 1.22 -0.462 0 CA-C-O 117.997 -1.002 . . . . 0.0 110.431 -179.881 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 7.0 mt . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -78.1 -134.71 0.83 Allowed Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.712 -0.955 . . . . 0.0 110.712 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.86 174.0 3.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.229 0.538 . . . . 0.0 110.561 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.8 m -163.04 156.29 19.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.317 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.446 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.2 OUTLIER -89.24 123.25 33.29 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.732 -179.372 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.405 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -123.65 -15.42 7.03 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.08 -179.238 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.446 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 32.9 mtp180 91.89 146.89 0.05 OUTLIER Pre-proline 0 N--CA 1.48 1.046 0 C-N-CA 123.83 0.852 . . . . 0.0 110.334 -179.195 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -84.64 47.59 2.19 Favored 'Trans proline' 0 N--CA 1.477 0.513 0 C-N-CA 121.924 1.749 . . . . 0.0 113.011 179.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -77.8 113.99 16.22 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.351 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.4 tttm . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.401 -179.931 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.0 mp . . . . . 0 N--CA 1.492 1.673 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.47 144.7 48.84 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.5 -174.52 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.176 0.512 . . . . 0.0 110.614 -179.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.1 m 63.12 126.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.531 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -108.15 157.78 18.0 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.354 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -153.14 -49.96 0.1 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.03 179.393 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 168.74 153.14 0.13 Allowed Pre-proline 0 N--CA 1.467 0.377 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.954 179.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -83.46 55.89 5.15 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 121.984 1.79 . . . . 0.0 112.693 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -65.47 118.09 8.93 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.306 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.7 mttp . . . . . 0 C--O 1.22 -0.482 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.43 179.988 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.597 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -86.45 -157.12 29.54 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.801 -0.919 . . . . 0.0 110.801 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.15 166.62 5.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.119 0.485 . . . . 0.0 110.421 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.7 p -174.23 141.32 0.73 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.492 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.476 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -73.47 128.05 34.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.617 -179.73 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.4 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -125.51 -14.67 6.3 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.179 -178.981 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.476 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 27.8 mtm180 87.26 143.28 0.05 OUTLIER Pre-proline 0 N--CA 1.476 0.829 0 C-N-CA 123.245 0.618 . . . . 0.0 110.495 -179.258 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -82.15 51.21 3.71 Favored 'Trans proline' 0 N--CA 1.477 0.558 0 C-N-CA 121.927 1.751 . . . . 0.0 112.886 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.1 t70 57.71 103.86 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.737 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.9 tttm . . . . . 0 C--O 1.221 -0.429 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.508 179.999 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.6 pp . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.027 0.441 . . . . 0.0 109.866 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 85.53 -99.73 2.39 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.823 -0.911 . . . . 0.0 110.823 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.84 -173.63 0.13 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.095 0.474 . . . . 0.0 110.568 179.945 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.0 p -100.31 143.21 30.76 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.363 -179.994 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -105.54 127.76 53.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.452 -179.749 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -117.66 -15.82 10.13 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.617 -179.287 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 84.39 145.62 0.08 OUTLIER Pre-proline 0 N--CA 1.476 0.841 0 C-N-CA 122.822 0.449 . . . . 0.0 110.127 -179.409 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -85.0 48.43 2.33 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 121.825 1.683 . . . . 0.0 112.931 179.32 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 24.5 t70 61.1 156.65 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.503 179.979 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 117.953 -1.022 . . . . 0.0 110.431 -179.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.1 mt . . . . . 0 N--CA 1.489 1.482 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -166.89 134.3 3.22 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 -179.994 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.41 -177.8 0.1 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.072 0.463 . . . . 0.0 110.551 179.906 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.6 m -156.6 159.82 38.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.507 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -96.84 168.39 10.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.337 -179.257 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -164.48 -63.24 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.977 -1.01 . . . . 0.0 109.203 179.788 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.43 151.85 0.2 Allowed Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.915 179.322 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -87.02 46.52 1.45 Allowed 'Trans proline' 0 N--CA 1.475 0.384 0 C-N-CA 122.133 1.889 . . . . 0.0 113.051 179.985 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.3 t70 57.32 88.98 0.05 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.776 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? . . . . . 0 C--O 1.221 -0.406 0 CA-C-O 117.908 -1.044 . . . . 0.0 110.415 -179.894 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.7 mm? . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -143.0 104.55 0.36 Allowed Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 179.997 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.24 160.5 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.058 0.456 . . . . 0.0 110.58 179.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -115.39 123.8 49.59 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.516 -179.978 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.429 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -140.2 147.43 40.06 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.424 -179.544 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.406 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 2.2 m-70 -123.03 -66.94 0.98 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.048 178.94 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.406 ' CB ' ' O ' ' A' ' 6' ' ' HIS . 16.8 mtp180 149.24 143.21 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.938 0 CA-C-N 114.776 -1.102 . . . . 0.0 109.534 178.936 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.429 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 43.1 Cg_endo -87.61 52.22 2.26 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 121.964 1.776 . . . . 0.0 112.384 179.546 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -89.85 164.23 14.7 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.688 -179.686 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.7 mtpp . . . . . 0 C--O 1.22 -0.484 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.424 179.979 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 66.4 51.51 42.42 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.702 -0.959 . . . . 0.0 110.702 -179.894 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -82.95 -178.24 7.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.166 0.508 . . . . 0.0 110.446 -179.918 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 31.1 t -143.56 163.21 33.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.397 -179.994 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.422 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.8 OUTLIER -90.88 134.67 34.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.271 -179.13 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.2 m170 -124.03 -45.94 1.98 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.019 179.507 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.5 mtp85 173.31 160.33 0.29 Allowed Pre-proline 0 N--CA 1.466 0.326 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.016 179.926 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.422 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.0 Cg_endo -82.34 55.74 5.48 Favored 'Trans proline' 0 N--CA 1.473 0.307 0 C-N-CA 121.897 1.732 . . . . 0.0 112.596 179.643 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -125.4 146.33 49.65 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.398 179.846 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.3 ttmt . . . . . 0 C--O 1.22 -0.485 0 CA-C-O 118.058 -0.972 . . . . 0.0 110.544 -179.98 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 159.29 -112.39 0.52 Allowed Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.804 -0.918 . . . . 0.0 110.804 179.942 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -178.11 -164.72 0.09 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.945 0.402 . . . . 0.0 110.167 -179.803 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.1 m -76.94 156.11 32.24 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 121.404 0.621 . . . . 0.0 109.373 179.321 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.4 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 1.0 OUTLIER -97.11 139.5 33.01 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.021 -178.57 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -130.76 -44.29 1.08 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.748 -1.115 . . . . 0.0 109.708 179.293 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.4 mtp85 -171.07 161.8 5.42 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.013 -179.981 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.4 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.2 Cg_endo -81.42 56.19 5.89 Favored 'Trans proline' 0 N--CA 1.475 0.422 0 C-N-CA 121.898 1.732 . . . . 0.0 112.646 179.678 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -78.23 152.01 32.82 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.331 179.965 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.0 mttp . . . . . 0 C--O 1.219 -0.504 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.437 179.939 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -88.94 -163.07 39.1 Favored Glycine 0 CA--C 1.523 0.581 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 -179.797 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -148.84 47.89 1.01 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.481 0.657 . . . . 0.0 109.937 -179.716 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.3 m 61.07 96.46 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.884 -179.175 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.424 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -39.24 137.55 0.73 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.434 -1.257 . . . . 0.0 113.512 -178.698 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -130.96 -48.75 1.02 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.38 -1.282 . . . . 0.0 108.864 178.582 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.7 mtp180 165.16 154.33 0.07 OUTLIER Pre-proline 0 N--CA 1.468 0.473 0 CA-C-N 115.186 -0.916 . . . . 0.0 109.846 179.019 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.424 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.1 Cg_endo -82.87 55.59 5.29 Favored 'Trans proline' 0 N--CA 1.475 0.399 0 C-N-CA 121.944 1.763 . . . . 0.0 112.687 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -154.69 80.4 1.09 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.154 179.864 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 50.8 mttt . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.598 -179.887 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 8.0 tt . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 178.06 -95.05 0.1 OUTLIER Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 -179.944 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -104.16 40.06 1.53 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.284 0.564 . . . . 0.0 110.458 179.985 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.8 t -105.81 129.53 53.98 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.597 0.713 . . . . 0.0 109.887 179.593 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -63.84 134.79 55.85 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.672 -1.149 . . . . 0.0 112.262 -178.614 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -122.6 -43.21 2.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.469 -1.241 . . . . 0.0 109.619 179.071 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.47 167.34 1.01 Allowed Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.678 179.865 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -81.0 54.94 5.48 Favored 'Trans proline' 0 N--CA 1.475 0.414 0 C-N-CA 122.07 1.847 . . . . 0.0 112.778 179.514 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.1 p30 44.57 -170.85 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 115.192 -0.913 . . . . 0.0 112.026 179.751 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt . . . . . 0 C--O 1.221 -0.405 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.323 -179.717 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.1 tp . . . . . 0 N--CA 1.491 1.579 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 117.72 -161.68 13.25 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.576 -1.01 . . . . 0.0 110.576 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.34 152.85 42.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.256 0.55 . . . . 0.0 110.7 179.922 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 179.65 145.12 0.18 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.063 179.633 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -95.48 149.42 21.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.401 -179.172 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -145.81 -48.6 0.22 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.381 179.472 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 179.38 157.39 0.7 Allowed Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.091 179.552 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -82.54 56.8 5.85 Favored 'Trans proline' 0 N--CA 1.473 0.29 0 C-N-CA 121.939 1.759 . . . . 0.0 112.635 179.839 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -119.52 83.18 2.0 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.447 179.952 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.1 ttpt . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.408 -179.913 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.8 mp . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -99.56 -35.24 4.72 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 179.883 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -178.4 91.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.007 0.432 . . . . 0.0 110.31 179.992 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -116.92 130.7 56.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.552 -179.966 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.74 173.75 10.05 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.364 -179.727 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 -169.68 -56.75 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 114.575 -1.193 . . . . 0.0 108.823 179.62 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 169.43 151.37 0.14 Allowed Pre-proline 0 N--CA 1.467 0.402 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.755 178.812 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -83.97 56.93 5.26 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 121.906 1.738 . . . . 0.0 112.536 179.998 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -115.79 146.87 41.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.44 179.993 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.4 tptt . . . . . 0 C--O 1.219 -0.523 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.604 179.966 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.649 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 60.42 -96.78 0.1 OUTLIER Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 -179.785 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -132.49 122.19 24.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.972 0.415 . . . . 0.0 110.207 179.441 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.8 m -127.37 145.71 50.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.618 0.723 . . . . 0.0 110.72 -179.912 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.423 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -82.74 117.75 22.88 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.833 -178.923 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -111.99 -34.66 5.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.855 178.852 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 170.77 158.44 0.21 Allowed Pre-proline 0 CA--C 1.536 0.437 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.312 179.513 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.423 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 42.3 Cg_endo -82.62 55.11 5.16 Favored 'Trans proline' 0 N--CA 1.476 0.483 0 C-N-CA 122.177 1.918 . . . . 0.0 113.249 -179.664 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.2 t70 54.64 86.19 0.05 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.199 179.671 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.9 ttmt . . . . . 0 C--O 1.22 -0.448 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.551 179.854 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.4 tt . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -84.22 83.29 1.63 Allowed Glycine 0 CA--C 1.523 0.587 0 N-CA-C 110.564 -1.014 . . . . 0.0 110.564 179.844 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -172.64 -166.66 0.39 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.956 0.408 . . . . 0.0 110.3 -179.872 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.9 p -96.36 155.52 16.73 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 121.303 0.573 . . . . 0.0 110.006 179.791 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.42 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -101.36 139.78 36.56 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.223 -179.222 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -128.83 -48.93 1.24 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.638 179.456 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.7 mtp85 167.37 155.29 0.12 Allowed Pre-proline 0 N--CA 1.468 0.472 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.794 179.875 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.42 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.3 Cg_endo -84.02 55.87 4.86 Favored 'Trans proline' 0 N--CA 1.474 0.354 0 C-N-CA 121.925 1.75 . . . . 0.0 112.524 -179.933 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -107.49 139.4 42.06 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.559 -179.89 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.8 ttmt . . . . . 0 C--O 1.22 -0.46 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.356 179.983 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.8 mt . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -161.22 60.2 0.29 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 179.978 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.95 83.81 0.14 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.093 0.473 . . . . 0.0 110.516 -179.868 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.55 134.16 55.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.395 0.617 . . . . 0.0 110.291 179.964 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.422 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -106.32 153.75 21.75 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.213 -179.47 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -143.7 -55.13 0.38 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.181 179.523 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.8 mtt180 165.33 151.73 0.06 OUTLIER Pre-proline 0 N--CA 1.469 0.513 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.717 179.408 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.422 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.4 Cg_endo -84.44 56.08 4.72 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 121.856 1.704 . . . . 0.0 112.572 179.958 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -177.7 144.81 0.38 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.423 -179.935 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.1 tttp . . . . . 0 C--O 1.22 -0.496 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.478 -179.955 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 . . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 160.31 -33.85 0.42 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.658 -0.977 . . . . 0.0 110.658 -179.989 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.81 178.24 0.1 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.147 0.499 . . . . 0.0 110.575 179.951 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -135.59 150.83 49.79 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.396 179.845 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.428 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.52 152.66 20.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.179 -179.36 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -142.78 -52.51 0.38 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.524 179.636 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 169.97 154.74 0.18 Allowed Pre-proline 0 N--CA 1.468 0.445 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.866 179.679 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.428 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo -83.48 56.26 5.28 Favored 'Trans proline' 0 N--CA 1.473 0.32 0 C-N-CA 121.83 1.686 . . . . 0.0 112.568 179.854 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -82.96 119.73 24.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.316 179.913 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.22 -0.5 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.324 -179.907 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 89.69 -117.1 4.9 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 179.876 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.72 166.1 0.08 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.148 0.499 . . . . 0.0 110.464 -179.848 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.1 m -178.6 150.7 0.54 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.411 179.918 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -69.27 158.99 33.92 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.043 -179.396 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -152.47 -49.34 0.1 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.562 179.834 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 176.19 156.42 0.41 Allowed Pre-proline 0 CA--C 1.533 0.315 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.013 179.67 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -82.88 56.43 5.62 Favored 'Trans proline' 0 N--CA 1.473 0.275 0 C-N-CA 121.951 1.768 . . . . 0.0 112.598 179.958 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -124.56 102.62 7.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.396 179.915 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.221 -0.435 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.194 -179.969 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.339 0.59 . . . . 0.0 109.508 . . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 60.9 -135.34 49.13 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 179.849 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.16 -177.83 3.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.07 0.462 . . . . 0.0 110.375 -179.965 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.6 m -100.81 147.83 25.63 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.351 179.944 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -104.3 159.18 15.92 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.48 -179.3 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -152.28 -48.61 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.407 179.563 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 177.22 159.14 0.5 Allowed Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.084 179.724 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -81.91 56.25 5.79 Favored 'Trans proline' 0 N--CA 1.475 0.402 0 C-N-CA 121.902 1.735 . . . . 0.0 112.698 179.774 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 p30 44.36 -170.53 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.087 -0.961 . . . . 0.0 111.946 179.761 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.5 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.372 -179.771 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.0 mp . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 . . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -122.37 -91.6 1.08 Allowed Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.804 -0.918 . . . . 0.0 110.804 -179.946 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -176.69 162.09 2.16 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.143 0.496 . . . . 0.0 110.659 -179.939 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 7.7 t -132.88 153.84 50.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.175 179.846 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.45 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -81.67 119.21 23.53 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.728 -179.391 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.418 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 4.9 m-70 -117.01 -19.16 9.89 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.776 -179.381 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.45 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 32.0 mtt180 94.57 148.17 0.04 OUTLIER Pre-proline 0 N--CA 1.482 1.138 0 C-N-CA 123.952 0.901 . . . . 0.0 110.336 -179.423 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -83.82 48.86 2.69 Favored 'Trans proline' 0 N--CA 1.476 0.484 0 C-N-CA 121.881 1.72 . . . . 0.0 112.723 179.309 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.7 p-10 -107.56 118.03 35.66 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.598 -179.911 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.5 mtmt . . . . . 0 C--O 1.22 -0.459 0 CA-C-O 117.949 -1.024 . . . . 0.0 110.364 179.97 . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.1 pp . . . . . 0 N--CA 1.492 1.636 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 . . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -114.13 -109.88 2.86 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 -179.982 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.5 -175.6 0.11 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.122 0.487 . . . . 0.0 110.435 -179.949 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -159.02 157.89 32.09 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.579 179.86 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.432 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.3 153.56 19.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.041 -179.514 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -143.54 -54.46 0.38 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.69 179.505 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 171.53 154.14 0.22 Allowed Pre-proline 0 N--CA 1.467 0.381 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.077 179.755 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.432 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.4 Cg_endo -84.16 55.97 4.82 Favored 'Trans proline' 0 N--CA 1.474 0.343 0 C-N-CA 121.87 1.714 . . . . 0.0 112.654 179.996 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.89 84.38 2.82 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.414 179.966 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.9 tptt . . . . . 0 C--O 1.221 -0.433 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.337 179.997 . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 14.8 mt . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 . . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -149.26 -89.58 0.08 OUTLIER Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.891 -0.883 . . . . 0.0 110.891 179.998 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.41 -169.99 3.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.167 0.508 . . . . 0.0 110.436 -179.922 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.1 m -117.09 166.93 11.64 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.131 179.806 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -93.38 172.42 8.29 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.129 -179.247 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 4.1 t-160 -173.89 -42.64 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.729 179.745 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.3 mtt85 -179.93 155.75 0.73 Allowed Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.235 179.433 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -83.13 56.67 5.62 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 121.951 1.767 . . . . 0.0 112.704 -179.852 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -139.79 123.83 17.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.212 -0.903 . . . . 0.0 110.288 179.902 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.436 179.996 . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 . . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -105.89 -72.31 0.83 Allowed Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -179.765 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -114.24 124.7 52.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.083 0.468 . . . . 0.0 110.585 -179.729 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.14 145.53 32.39 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.16 179.743 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -103.12 163.57 12.15 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.555 0.693 . . . . 0.0 111.362 -179.31 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -159.9 -48.51 0.05 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.255 179.688 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.16 157.7 0.37 Allowed Pre-proline 0 CA--C 1.532 0.278 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.959 179.54 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -81.53 56.26 5.89 Favored 'Trans proline' 0 N--CA 1.474 0.333 0 C-N-CA 121.864 1.709 . . . . 0.0 112.614 179.537 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -115.47 111.79 21.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.402 179.964 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.7 mtmm . . . . . 0 C--O 1.219 -0.528 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.335 179.993 . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.9 mt . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -154.51 -67.79 0.01 OUTLIER Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 -179.97 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -92.69 94.24 8.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.075 0.464 . . . . 0.0 110.486 179.971 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.7 m -124.26 136.18 53.95 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.544 0.688 . . . . 0.0 110.254 179.859 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -61.65 153.43 28.03 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.937 -1.028 . . . . 0.0 111.382 -179.179 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -146.64 -49.41 0.2 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.636 -1.165 . . . . 0.0 109.426 179.643 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.4 mtt180 176.09 157.34 0.41 Allowed Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.119 179.683 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -82.21 56.68 5.89 Favored 'Trans proline' 0 N--CA 1.474 0.375 0 C-N-CA 121.872 1.715 . . . . 0.0 112.663 179.838 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -106.8 172.56 6.75 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.402 179.959 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.6 mttt . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.308 -179.972 . . . . . . . . 0 0 . 1 . 041 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 136.37 -52.01 0.79 Allowed Glycine 0 CA--C 1.526 0.746 0 N-CA-C 110.76 -0.936 . . . . 0.0 110.76 -179.994 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.49 -165.85 1.79 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.879 0.371 . . . . 0.0 110.423 179.998 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.5 p 63.24 134.0 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 121.582 0.706 . . . . 0.0 110.864 179.994 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.434 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -98.86 132.7 44.0 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.018 -179.532 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.95 -62.11 1.59 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.211 179.226 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.8 mtp180 159.85 147.3 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.69 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.452 179.199 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.434 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.5 Cg_endo -86.24 53.29 3.07 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 121.905 1.737 . . . . 0.0 112.61 179.897 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 177.73 -173.53 0.13 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.282 179.927 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.328 179.942 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 4.6 tt . . . . . 0 N--CA 1.489 1.511 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 0 0 . 1 . 042 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -125.55 -97.2 1.09 Allowed Glycine 0 CA--C 1.524 0.644 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 -179.968 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.414 ' HB3' ' CD2' ' A' ' 6' ' ' HIS . . . 61.27 39.49 15.53 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.312 0.577 . . . . 0.0 110.379 -179.896 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.3 m 60.4 35.3 20.51 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.612 179.896 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.42 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER 61.29 118.88 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.65 179.279 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.414 ' CD2' ' HB3' ' A' ' 3' ' ' ALA . 8.9 m-70 -110.77 -49.61 3.02 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.014 178.53 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 158.92 151.57 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.719 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.631 179.239 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.42 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo -84.15 55.1 4.53 Favored 'Trans proline' 0 N--CA 1.474 0.377 0 C-N-CA 121.833 1.689 . . . . 0.0 112.624 179.872 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.7 t0 59.49 80.28 0.2 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.611 179.956 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 118.005 -0.997 . . . . 0.0 110.34 -179.934 . . . . . . . . 0 0 . 1 . 043 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 . . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 93.11 -133.81 11.88 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 179.739 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.84 -179.01 0.11 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.996 0.427 . . . . 0.0 110.629 -179.842 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.7 m 62.28 117.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.383 -179.866 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.402 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -116.32 158.6 23.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.908 -178.971 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -152.04 -50.44 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.609 -1.178 . . . . 0.0 108.752 179.319 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.9 mtp180 168.68 153.97 0.14 Allowed Pre-proline 0 N--CA 1.466 0.338 0 CA-C-N 115.032 -0.985 . . . . 0.0 109.723 179.175 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.402 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.2 Cg_endo -83.54 56.32 5.27 Favored 'Trans proline' 0 N--CA 1.473 0.303 0 C-N-CA 121.963 1.776 . . . . 0.0 112.598 -179.932 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -95.47 173.7 7.38 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.395 179.969 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.7 mmtp . . . . . 0 C--O 1.22 -0.485 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.375 -179.957 . . . . . . . . 0 0 . 1 . 044 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.2 mp . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 044 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.11 -38.86 96.28 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 -179.954 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -117.02 94.49 4.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.065 0.46 . . . . 0.0 110.545 -179.973 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 74.0 m -125.81 136.36 53.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.559 0.695 . . . . 0.0 110.342 179.726 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -67.64 166.9 14.11 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.44 -179.336 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -166.37 -45.9 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.352 179.793 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 176.33 153.38 0.37 Allowed Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.871 179.507 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -85.42 50.03 2.61 Favored 'Trans proline' 0 N--CA 1.476 0.455 0 C-N-CA 122.046 1.831 . . . . 0.0 113.187 -179.75 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.1 t70 59.48 161.42 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.68 179.729 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.3 mttm . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 118.024 -0.988 . . . . 0.0 110.126 179.852 . . . . . . . . 0 0 . 1 . 045 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.416 ' N ' ' CD1' ' A' ' 1' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.745 0 CA-C-O 120.746 0.307 . . . . 0.0 110.708 . . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 164.05 -81.79 0.12 Allowed Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.528 -1.029 . . . . 0.0 110.528 179.997 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.73 -174.6 3.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.22 0.533 . . . . 0.0 110.589 179.828 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.86 122.22 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.512 179.924 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.415 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -111.6 142.82 43.42 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.914 -179.245 . . . . . . . . 3 3 . 1 . 045 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -134.84 -51.37 0.78 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.567 -1.197 . . . . 0.0 108.782 178.939 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.1 mtt180 168.21 157.45 0.15 Allowed Pre-proline 0 N--CA 1.465 0.305 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.466 179.456 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.415 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 39.8 Cg_endo -80.18 56.76 6.2 Favored 'Trans proline' 0 N--CA 1.475 0.403 0 C-N-CA 121.67 1.58 . . . . 0.0 112.581 179.335 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -173.17 175.33 3.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.926 179.862 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.1 ttpm? . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.497 179.919 . . . . . . . . 0 0 . 1 . 046 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.416 0.627 . . . . 0.0 109.462 . . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 68.72 171.53 6.96 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 179.902 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.9 152.52 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.196 0.522 . . . . 0.0 110.744 179.987 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.5 p -147.04 145.77 29.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.488 179.975 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.412 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -70.49 128.85 37.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.554 -179.724 . . . . . . . . 3 3 . 1 . 046 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.99 -15.76 9.92 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.683 -179.159 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.412 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER 83.94 148.3 0.1 OUTLIER Pre-proline 0 N--CA 1.476 0.858 0 C-N-CA 122.713 0.405 . . . . 0.0 110.117 -179.154 . . . . . . . . 3 3 . 1 . 046 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -82.95 51.61 3.74 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 121.754 1.636 . . . . 0.0 112.673 179.125 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 t0 67.44 137.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.539 179.826 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.5 mttt . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.953 -1.022 . . . . 0.0 110.456 179.997 . . . . . . . . 0 0 . 1 . 047 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.2 tp . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 0 0 . 1 . 047 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 100.34 75.43 1.16 Allowed Glycine 0 CA--C 1.523 0.573 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 -179.98 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.01 -169.12 0.17 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.081 0.467 . . . . 0.0 110.303 179.965 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.58 153.08 20.06 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.965 179.847 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.406 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.56 151.26 22.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.323 -179.177 . . . . . . . . 3 3 . 1 . 047 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -143.01 -50.05 0.34 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.468 179.464 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 173.51 155.82 0.28 Allowed Pre-proline 0 N--CA 1.466 0.341 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.027 179.742 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.6 Cg_endo -83.55 56.3 5.26 Favored 'Trans proline' 0 N--CA 1.474 0.344 0 C-N-CA 121.904 1.736 . . . . 0.0 112.523 179.944 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -133.19 178.29 7.01 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.418 -179.985 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.406 -179.966 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 16.9 mt . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 0 0 . 1 . 048 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 153.83 80.15 0.03 OUTLIER Glycine 0 CA--C 1.524 0.613 0 N-CA-C 110.694 -0.963 . . . . 0.0 110.694 -179.989 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -177.67 134.88 0.17 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.998 0.428 . . . . 0.0 110.421 -179.962 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -152.21 139.2 19.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.337 179.878 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.406 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -109.73 155.62 21.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.479 -179.398 . . . . . . . . 3 3 . 1 . 048 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.28 -49.44 0.14 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.199 179.356 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 175.91 156.63 0.4 Allowed Pre-proline 0 CA--C 1.534 0.345 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.824 179.394 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo -83.04 56.83 5.73 Favored 'Trans proline' 0 N--CA 1.474 0.325 0 C-N-CA 121.961 1.774 . . . . 0.0 112.548 -179.974 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -143.79 123.57 13.41 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.463 179.946 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.221 -0.447 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.446 179.958 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.1 pp . . . . . 0 N--CA 1.494 1.745 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 . . . . . . . . . 0 0 . 1 . 049 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -122.63 -95.1 1.24 Allowed Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.833 -0.907 . . . . 0.0 110.833 -179.954 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.77 -179.84 0.56 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.056 0.455 . . . . 0.0 110.352 179.895 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.1 m -157.17 135.96 11.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.518 179.986 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.409 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -162.41 162.12 27.57 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.686 0.755 . . . . 0.0 111.788 -179.87 . . . . . . . . 3 3 . 1 . 049 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -154.03 -51.0 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.884 179.377 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 165.52 154.15 0.08 OUTLIER Pre-proline 0 N--CA 1.468 0.468 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.978 179.24 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.409 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.3 Cg_endo -83.06 57.94 6.12 Favored 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 121.936 1.757 . . . . 0.0 112.371 179.624 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.4 t0 64.45 138.43 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.558 -179.895 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.501 0 CA-C-O 118.043 -0.98 . . . . 0.0 110.279 -179.988 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 18.8 mt . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.345 0.593 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 050 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 98.07 -39.91 2.64 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.722 -0.951 . . . . 0.0 110.722 -179.914 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -172.09 140.16 1.17 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.026 0.441 . . . . 0.0 110.328 -179.979 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.0 m -102.68 36.39 2.2 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.636 0.731 . . . . 0.0 110.443 -179.985 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.425 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER 61.42 117.81 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.74 179.091 . . . . . . . . 3 3 . 1 . 050 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -112.57 -45.23 3.25 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.761 -1.108 . . . . 0.0 108.96 178.34 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.2 mtt180 162.43 153.65 0.04 OUTLIER Pre-proline 0 N--CA 1.47 0.556 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.89 179.268 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.425 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.0 Cg_endo -83.55 56.28 5.25 Favored 'Trans proline' 0 N--CA 1.473 0.323 0 C-N-CA 121.912 1.741 . . . . 0.0 112.613 -179.953 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -67.51 170.03 8.21 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.429 -179.993 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.6 mttt . . . . . 0 C--O 1.22 -0.482 0 CA-C-O 118.001 -0.999 . . . . 0.0 110.37 -179.962 . . . . . . . . 0 0 . 1 . 051 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 . . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 125.0 -72.96 0.43 Allowed Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.776 -0.929 . . . . 0.0 110.776 -179.91 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -128.77 178.55 6.27 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.132 0.492 . . . . 0.0 110.46 179.96 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.4 p -177.97 155.65 0.99 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.392 179.958 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.411 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -97.43 153.81 17.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.031 -179.457 . . . . . . . . 3 3 . 1 . 051 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -143.75 -59.74 0.4 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.427 179.622 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 172.79 153.49 0.24 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.922 179.588 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.411 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.4 Cg_endo -83.51 56.52 5.36 Favored 'Trans proline' 0 N--CA 1.473 0.318 0 C-N-CA 121.855 1.704 . . . . 0.0 112.507 179.871 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -119.7 158.16 27.04 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.467 -179.981 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.8 tttp . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.371 179.997 . . . . . . . . 0 0 . 1 . 052 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 39.1 mt . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 052 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -168.22 -138.15 2.4 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 -180.0 . . . . . . . . 1 1 . 1 . 052 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.6 42.07 14.52 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.281 0.562 . . . . 0.0 110.493 -179.997 . . . . . . . . 1 1 . 1 . 052 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 70.7 m -97.31 42.6 1.09 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.497 179.982 . . . . . . . . 1 1 . 1 . 052 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.429 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER 62.94 -173.77 0.15 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.69 0.757 . . . . 0.0 110.36 179.551 . . . . . . . . 3 3 . 1 . 052 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 174.24 -45.11 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.616 -1.174 . . . . 0.0 108.623 -179.762 . . . . . . . . 2 2 . 1 . 052 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 164.29 154.4 0.06 OUTLIER Pre-proline 0 N--CA 1.468 0.429 0 CA-C-N 114.86 -1.064 . . . . 0.0 109.703 179.179 . . . . . . . . 2 2 . 1 . 052 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.429 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.3 Cg_endo -83.18 56.76 5.63 Favored 'Trans proline' 0 N--CA 1.473 0.312 0 C-N-CA 121.864 1.709 . . . . 0.0 112.513 179.882 . . . . . . . . 2 2 . 1 . 052 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -166.18 -174.87 3.09 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.226 179.969 . . . . . . . . 1 1 . 1 . 052 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.22 -0.461 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.493 179.951 . . . . . . . . 1 1 . 1 . 053 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 12.7 mt . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 . . . . . . . . . 0 0 . 1 . 053 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 150.47 73.4 0.01 OUTLIER Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 179.988 . . . . . . . . 1 1 . 1 . 053 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.74 145.11 53.44 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.053 0.454 . . . . 0.0 110.376 179.847 . . . . . . . . 1 1 . 1 . 053 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.59 128.09 34.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.367 0.603 . . . . 0.0 110.614 -179.857 . . . . . . . . 2 2 . 1 . 053 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.424 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -177.59 145.21 0.41 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.816 179.799 . . . . . . . . 3 3 . 1 . 053 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -134.96 -51.12 0.77 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.547 -1.206 . . . . 0.0 108.898 178.819 . . . . . . . . 2 2 . 1 . 053 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 160.18 152.91 0.03 OUTLIER Pre-proline 0 N--CA 1.471 0.606 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.606 179.364 . . . . . . . . 1 1 . 1 . 053 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.424 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo -83.54 56.07 5.18 Favored 'Trans proline' 0 N--CA 1.473 0.319 0 C-N-CA 121.911 1.741 . . . . 0.0 112.537 179.784 . . . . . . . . 2 2 . 1 . 053 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -140.11 147.12 39.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.337 -179.991 . . . . . . . . 1 1 . 1 . 053 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.433 0 CA-C-O 117.952 -1.023 . . . . 0.0 110.508 -179.982 . . . . . . . . 1 1 . 1 . 054 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.0 pp . . . . . 0 N--CA 1.493 1.69 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 054 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -98.69 -87.42 1.9 Allowed Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.933 -0.867 . . . . 0.0 110.933 -179.917 . . . . . . . . 1 1 . 1 . 054 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.59 -179.22 0.1 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.029 0.442 . . . . 0.0 110.478 -179.937 . . . . . . . . 1 1 . 1 . 054 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.8 m -63.51 132.96 52.95 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.112 179.914 . . . . . . . . 1 1 . 1 . 054 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -107.71 172.71 6.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.66 -179.061 . . . . . . . . 2 2 . 1 . 054 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -176.63 -43.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.606 -1.179 . . . . 0.0 109.081 179.902 . . . . . . . . 2 2 . 1 . 054 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 173.84 154.26 0.28 Allowed Pre-proline 0 CA--C 1.534 0.338 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.805 179.284 . . . . . . . . 2 2 . 1 . 054 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -83.43 56.62 5.44 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 121.853 1.702 . . . . 0.0 112.794 -179.763 . . . . . . . . 1 1 . 1 . 054 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -102.56 44.81 0.99 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.195 179.786 . . . . . . . . 1 1 . 1 . 054 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.5 tttm . . . . . 0 C--O 1.221 -0.447 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.475 -179.991 . . . . . . . . 0 0 . 1 . 055 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.0 mp . . . . . 0 N--CA 1.491 1.604 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 . . . . . . . . . 0 0 . 1 . 055 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -137.03 114.54 1.14 Allowed Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.908 -0.877 . . . . 0.0 110.908 -179.886 . . . . . . . . 1 1 . 1 . 055 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -111.61 93.6 4.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.051 0.453 . . . . 0.0 110.234 179.811 . . . . . . . . 1 1 . 1 . 055 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 m -80.42 133.12 35.84 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.617 -179.722 . . . . . . . . 1 1 . 1 . 055 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.425 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -119.27 171.25 8.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.426 -179.601 . . . . . . . . 3 3 . 1 . 055 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -160.07 -64.99 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.168 179.596 . . . . . . . . 2 2 . 1 . 055 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.1 mtp180 169.54 150.89 0.14 Allowed Pre-proline 0 N--CA 1.468 0.453 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.857 179.043 . . . . . . . . 1 1 . 1 . 055 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.425 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.6 Cg_endo -83.82 56.32 5.13 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 121.924 1.749 . . . . 0.0 112.613 179.87 . . . . . . . . 2 2 . 1 . 055 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 t70 59.52 40.58 20.31 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.634 179.989 . . . . . . . . 1 1 . 1 . 055 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.1 mmtp . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.514 -179.929 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.0 p . . . . . 0 CA--C 1.518 -0.28 0 CA-C-O 121.396 0.617 . . . . 0.0 110.104 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.418 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -99.76 126.69 45.87 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.063 -179.226 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.401 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -117.7 -15.5 10.12 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.086 -0.961 . . . . 0.0 111.481 -179.627 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.418 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 8.8 mtp180 88.29 155.14 0.09 OUTLIER Pre-proline 0 N--CA 1.478 0.928 0 C-N-CA 123.332 0.653 . . . . 0.0 110.61 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo . . . . . 0 N--CA 1.477 0.537 0 C-N-CA 122.201 1.934 . . . . 0.0 113.43 179.428 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 CA--C 1.523 -0.092 0 CA-C-O 121.42 0.629 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.472 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -99.52 153.45 19.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.715 -179.495 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -133.32 -67.33 0.62 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.754 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 162.6 150.36 0.04 OUTLIER Pre-proline 0 N--CA 1.473 0.689 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.647 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.472 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 42.3 Cg_endo . . . . . 0 C--N 1.345 0.377 0 C-N-CA 122.034 1.823 . . . . 0.0 112.632 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.3 m . . . . . 0 CA--C 1.521 -0.157 0 CA-C-O 121.262 0.553 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.448 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.35 127.89 49.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.063 -179.565 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -108.68 -64.15 1.26 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.458 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 155.77 149.88 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.75 0 CA-C-N 114.821 -1.082 . . . . 0.0 109.474 179.358 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.448 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.4 Cg_endo . . . . . 0 C--N 1.344 0.308 0 C-N-CA 121.829 1.686 . . . . 0.0 112.378 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.462 0.172 0 CA-C-O 121.348 0.594 . . . . 0.0 110.386 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.462 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -93.78 125.78 38.59 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.895 -179.522 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -119.62 -14.42 9.08 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.641 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.462 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 17.9 mtt180 86.17 140.91 0.05 OUTLIER Pre-proline 0 N--CA 1.475 0.778 0 C-N-CA 123.335 0.654 . . . . 0.0 110.226 -179.284 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo . . . . . 0 C--N 1.348 0.519 0 C-N-CA 121.84 1.693 . . . . 0.0 113.538 179.952 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.517 -0.305 0 CA-C-O 121.309 0.576 . . . . 0.0 109.788 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.406 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.6 OUTLIER -99.25 144.27 28.56 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.633 -178.848 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.2 m170 -135.24 -46.43 0.7 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.762 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.1 mtt180 -178.64 160.67 1.1 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.121 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 39.9 Cg_endo . . . . . 0 C--N 1.345 0.352 0 C-N-CA 121.906 1.737 . . . . 0.0 112.672 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 CA--C 1.519 -0.24 0 CA-C-O 121.348 0.594 . . . . 0.0 110.782 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.474 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER 61.04 118.93 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.283 -0.872 . . . . 0.0 111.601 179.109 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.41 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 2.2 m170 -98.83 -61.44 1.37 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.107 178.409 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.41 ' CB ' ' O ' ' A' ' 6' ' ' HIS . 1.5 mtt180 148.71 145.8 0.0 OUTLIER Pre-proline 0 N--CA 1.48 1.052 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.486 179.074 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.474 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.8 Cg_endo . . . . . 0 C--N 1.344 0.333 0 C-N-CA 121.899 1.733 . . . . 0.0 112.445 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 CA--C 1.515 -0.367 0 CA-C-O 121.384 0.611 . . . . 0.0 110.062 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -93.63 157.32 16.23 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.852 -178.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -155.2 -48.17 0.08 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.362 -1.29 . . . . 0.0 109.122 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.19 162.26 3.5 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.09 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo . . . . . 0 N--CA 1.476 0.455 0 C-N-CA 121.863 1.709 . . . . 0.0 112.567 179.511 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 121.353 0.597 . . . . 0.0 109.435 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -99.29 158.42 15.71 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.817 -178.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -155.36 -47.32 0.08 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.277 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -161.58 156.81 20.46 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.309 -0.859 . . . . 0.0 109.917 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo . . . . . 0 N--CA 1.474 0.345 0 C-N-CA 121.972 1.781 . . . . 0.0 112.61 -179.994 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 CA--C 1.517 -0.31 0 CA-C-O 121.408 0.623 . . . . 0.0 110.074 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -93.03 167.29 11.89 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.479 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -170.56 -45.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.304 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.41 153.63 0.21 Allowed Pre-proline 0 N--CA 1.466 0.348 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.848 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo . . . . . 0 N--CA 1.476 0.461 0 C-N-CA 121.96 1.773 . . . . 0.0 112.983 179.705 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 CA--C 1.517 -0.308 0 CA-C-O 121.573 0.701 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.408 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 1.2 t90 -92.46 123.68 35.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.819 -1.082 . . . . 0.0 112.037 -178.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -115.54 -33.44 5.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.019 178.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.76 162.02 1.34 Allowed Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.238 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.408 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.5 Cg_endo . . . . . 0 N--CA 1.475 0.43 0 C-N-CA 121.941 1.761 . . . . 0.0 112.77 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 p . . . . . 0 CA--C 1.517 -0.306 0 CA-C-O 121.29 0.567 . . . . 0.0 109.898 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -96.61 147.84 23.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.667 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -140.41 -46.84 0.42 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.603 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -177.45 161.32 1.41 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.164 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo . . . . . 0 N--CA 1.476 0.45 0 C-N-CA 121.974 1.782 . . . . 0.0 113.249 -179.835 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 p . . . . . 0 CA--C 1.522 -0.112 0 CA-C-O 121.171 0.51 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.44 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -119.14 130.82 55.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.906 -179.624 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.04 -16.44 10.48 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.319 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.44 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 3.3 mtt180 82.02 147.39 0.1 Allowed Pre-proline 0 N--CA 1.473 0.709 0 C-N-CA 122.668 0.387 . . . . 0.0 110.308 -179.465 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo . . . . . 0 N--CA 1.474 0.348 0 C-N-CA 121.72 1.613 . . . . 0.0 112.397 178.892 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.519 -0.221 0 CA-C-O 121.285 0.564 . . . . 0.0 110.354 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -96.33 170.91 8.91 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.107 -179.325 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -170.1 -44.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.911 -1.04 . . . . 0.0 109.577 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.4 mtt85 179.77 158.09 0.77 Allowed Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.143 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo . . . . . 0 C--N 1.343 0.277 0 C-N-CA 121.955 1.77 . . . . 0.0 112.376 179.787 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.6 t . . . . . 0 CA--C 1.52 -0.2 0 CA-C-O 121.347 0.594 . . . . 0.0 110.469 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.429 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.3 OUTLIER -97.76 142.72 29.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.132 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -132.8 -48.93 0.88 Allowed 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.683 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 172.14 157.43 0.25 Allowed Pre-proline 0 CA--C 1.535 0.372 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.021 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.429 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.0 Cg_endo . . . . . 0 N--CA 1.473 0.293 0 C-N-CA 121.97 1.78 . . . . 0.0 112.365 179.729 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 CA--C 1.521 -0.159 0 CA-C-O 121.292 0.568 . . . . 0.0 110.399 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.44 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -99.76 147.47 25.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.009 -179.364 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -135.66 -55.69 0.78 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.541 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 167.4 153.34 0.11 Allowed Pre-proline 0 N--CA 1.468 0.467 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.778 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.44 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.4 Cg_endo . . . . . 0 C--N 1.343 0.281 0 C-N-CA 121.883 1.722 . . . . 0.0 112.327 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.7 p . . . . . 0 CA--C 1.518 -0.281 0 CA-C-O 121.32 0.581 . . . . 0.0 110.099 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -91.77 147.67 22.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.239 -178.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.66 -48.98 0.43 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.605 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 178.87 157.27 0.63 Allowed Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.282 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo . . . . . 0 N--CA 1.474 0.372 0 C-N-CA 121.977 1.785 . . . . 0.0 112.544 179.866 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.1 p . . . . . 0 CA--C 1.517 -0.303 0 CA-C-O 121.422 0.63 . . . . 0.0 110.141 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.416 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -90.54 135.06 33.94 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.48 -178.942 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -127.36 -46.4 1.48 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.746 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.4 mtp85 176.74 158.85 0.46 Allowed Pre-proline 0 CA--C 1.534 0.337 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.919 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.416 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.2 Cg_endo . . . . . 0 N--CA 1.476 0.461 0 C-N-CA 121.841 1.694 . . . . 0.0 112.725 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.8 m . . . . . 0 CA--C 1.52 -0.175 0 CA-C-O 121.256 0.551 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.478 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.2 OUTLIER -89.24 123.25 33.29 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.732 -179.372 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.405 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -123.65 -15.42 7.03 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.08 -179.238 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.478 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 32.9 mtp180 91.89 146.89 0.05 OUTLIER Pre-proline 0 N--CA 1.48 1.046 0 C-N-CA 123.83 0.852 . . . . 0.0 110.334 -179.195 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo . . . . . 0 N--CA 1.477 0.513 0 C-N-CA 121.924 1.749 . . . . 0.0 113.011 179.334 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.1 m . . . . . 0 CA--C 1.518 -0.261 0 CA-C-O 121.63 0.729 . . . . 0.0 110.531 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -108.15 157.78 18.0 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.354 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -153.14 -49.96 0.1 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.03 179.393 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 168.74 153.14 0.13 Allowed Pre-proline 0 N--CA 1.467 0.377 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.954 179.316 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo . . . . . 0 C--N 1.344 0.323 0 C-N-CA 121.984 1.79 . . . . 0.0 112.693 179.975 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.7 p . . . . . 0 CA--C 1.522 -0.115 0 CA-C-O 121.264 0.554 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.487 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -73.47 128.05 34.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.617 -179.73 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.4 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -125.51 -14.67 6.3 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.179 -178.981 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.487 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 27.8 mtm180 87.26 143.28 0.05 OUTLIER Pre-proline 0 N--CA 1.476 0.829 0 C-N-CA 123.245 0.618 . . . . 0.0 110.495 -179.258 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo . . . . . 0 N--CA 1.477 0.558 0 C-N-CA 121.927 1.751 . . . . 0.0 112.886 179.302 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.0 p . . . . . 0 C--O 1.231 0.115 0 CA-C-O 121.262 0.553 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.403 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -105.54 127.76 53.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.452 -179.749 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -117.66 -15.82 10.13 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.617 -179.287 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.403 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 0.0 OUTLIER 84.39 145.62 0.08 OUTLIER Pre-proline 0 N--CA 1.476 0.841 0 C-N-CA 122.822 0.449 . . . . 0.0 110.127 -179.409 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo . . . . . 0 C--N 1.347 0.465 0 C-N-CA 121.825 1.683 . . . . 0.0 112.931 179.32 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.6 m . . . . . 0 CA--C 1.519 -0.224 0 CA-C-O 121.394 0.616 . . . . 0.0 110.507 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -96.84 168.39 10.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.337 -179.257 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -164.48 -63.24 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.977 -1.01 . . . . 0.0 109.203 179.788 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.43 151.85 0.2 Allowed Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.915 179.322 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo . . . . . 0 N--CA 1.475 0.384 0 C-N-CA 122.133 1.889 . . . . 0.0 113.051 179.985 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.522 -0.131 0 CA-C-O 121.289 0.566 . . . . 0.0 110.516 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.457 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -140.2 147.43 40.06 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.424 -179.544 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.406 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 2.2 m-70 -123.03 -66.94 0.98 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.048 178.94 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.412 ' HG3' ' CZ3' ' A' ' 5' ' ' TRP . 16.8 mtp180 149.24 143.21 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.938 0 CA-C-N 114.776 -1.102 . . . . 0.0 109.534 178.936 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.457 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 43.1 Cg_endo . . . . . 0 C--N 1.347 0.451 0 C-N-CA 121.964 1.776 . . . . 0.0 112.384 179.546 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 31.1 t . . . . . 0 CA--C 1.517 -0.307 0 CA-C-O 121.469 0.652 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.42 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.8 OUTLIER -90.88 134.67 34.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.271 -179.13 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.2 m170 -124.03 -45.94 1.98 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.019 179.507 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.5 mtp85 173.31 160.33 0.29 Allowed Pre-proline 0 N--CA 1.466 0.326 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.016 179.926 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.42 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.0 Cg_endo . . . . . 0 N--CA 1.473 0.307 0 C-N-CA 121.897 1.732 . . . . 0.0 112.596 179.643 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.1 m . . . . . 0 CA--C 1.512 -0.488 0 CA-C-O 121.404 0.621 . . . . 0.0 109.373 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -97.11 139.5 33.01 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.021 -178.57 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -130.76 -44.29 1.08 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.748 -1.115 . . . . 0.0 109.708 179.293 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.4 mtp85 -171.07 161.8 5.42 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.013 -179.981 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo . . . . . 0 N--CA 1.475 0.422 0 C-N-CA 121.898 1.732 . . . . 0.0 112.646 179.678 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.3 m . . . . . 0 CA--C 1.52 -0.192 0 CA-C-O 121.679 0.752 . . . . 0.0 109.884 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.434 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -39.24 137.55 0.73 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.434 -1.257 . . . . 0.0 113.512 -178.698 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -130.96 -48.75 1.02 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.38 -1.282 . . . . 0.0 108.864 178.582 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.7 mtp180 165.16 154.33 0.07 OUTLIER Pre-proline 0 N--CA 1.468 0.473 0 CA-C-N 115.186 -0.916 . . . . 0.0 109.846 179.019 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.434 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.1 Cg_endo . . . . . 0 N--CA 1.475 0.399 0 C-N-CA 121.944 1.763 . . . . 0.0 112.687 -179.977 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.8 t . . . . . 0 CA--C 1.514 -0.408 0 CA-C-O 121.597 0.713 . . . . 0.0 109.887 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -63.84 134.79 55.85 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.672 -1.149 . . . . 0.0 112.262 -178.614 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -122.6 -43.21 2.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.469 -1.241 . . . . 0.0 109.619 179.071 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.47 167.34 1.01 Allowed Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.678 179.865 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo . . . . . 0 N--CA 1.475 0.414 0 C-N-CA 122.07 1.847 . . . . 0.0 112.778 179.514 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.519 -0.242 0 CA-C-O 121.35 0.595 . . . . 0.0 110.063 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -95.48 149.42 21.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.401 -179.172 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -145.81 -48.6 0.22 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.381 179.472 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 179.38 157.39 0.7 Allowed Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.091 179.552 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo . . . . . 0 N--CA 1.473 0.29 0 C-N-CA 121.939 1.759 . . . . 0.0 112.635 179.839 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.52 -0.197 0 CA-C-O 121.211 0.529 . . . . 0.0 110.552 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.74 173.75 10.05 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.364 -179.727 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -169.68 -56.75 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 114.575 -1.193 . . . . 0.0 108.823 179.62 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 169.43 151.37 0.14 Allowed Pre-proline 0 N--CA 1.467 0.402 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.755 178.812 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo . . . . . 0 C--N 1.344 0.311 0 C-N-CA 121.906 1.738 . . . . 0.0 112.536 179.998 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.8 m . . . . . 0 CA--C 1.519 -0.24 0 CA-C-O 121.618 0.723 . . . . 0.0 110.72 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.419 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -82.74 117.75 22.88 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.833 -178.923 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -111.99 -34.66 5.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.855 178.852 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 170.77 158.44 0.21 Allowed Pre-proline 0 CA--C 1.536 0.437 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.312 179.513 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.419 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 42.3 Cg_endo . . . . . 0 N--CA 1.476 0.483 0 C-N-CA 122.177 1.918 . . . . 0.0 113.249 -179.664 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.9 p . . . . . 0 CA--C 1.519 -0.244 0 CA-C-O 121.303 0.573 . . . . 0.0 110.006 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.428 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -101.36 139.78 36.56 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.223 -179.222 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -128.83 -48.93 1.24 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.638 179.456 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.7 mtp85 167.37 155.29 0.12 Allowed Pre-proline 0 N--CA 1.468 0.472 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.794 179.875 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.428 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.3 Cg_endo . . . . . 0 N--CA 1.474 0.354 0 C-N-CA 121.925 1.75 . . . . 0.0 112.524 -179.933 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.521 -0.172 0 CA-C-O 121.395 0.617 . . . . 0.0 110.291 . . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.432 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -106.32 153.75 21.75 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.213 -179.47 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -143.7 -55.13 0.38 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.181 179.523 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.8 mtt180 165.33 151.73 0.06 OUTLIER Pre-proline 0 N--CA 1.469 0.513 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.717 179.408 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.432 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.4 Cg_endo . . . . . 0 C--N 1.344 0.318 0 C-N-CA 121.856 1.704 . . . . 0.0 112.572 179.958 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.522 -0.13 0 CA-C-O 121.198 0.523 . . . . 0.0 110.396 . . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.434 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.52 152.66 20.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.179 -179.36 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -142.78 -52.51 0.38 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.524 179.636 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 169.97 154.74 0.18 Allowed Pre-proline 0 N--CA 1.468 0.445 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.866 179.679 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.434 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo . . . . . 0 N--CA 1.473 0.32 0 C-N-CA 121.83 1.686 . . . . 0.0 112.568 179.854 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 CA--C 1.519 -0.248 0 CA-C-O 121.494 0.664 . . . . 0.0 110.411 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -69.27 158.99 33.92 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.043 -179.396 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -152.47 -49.34 0.1 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.562 179.834 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 176.19 156.42 0.41 Allowed Pre-proline 0 CA--C 1.533 0.315 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.013 179.67 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo . . . . . 0 N--CA 1.473 0.275 0 C-N-CA 121.951 1.768 . . . . 0.0 112.598 179.958 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.6 m . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.313 0.577 . . . . 0.0 110.351 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -104.3 159.18 15.92 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.48 -179.3 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -152.28 -48.61 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.407 179.563 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 177.22 159.14 0.5 Allowed Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.084 179.724 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo . . . . . 0 N--CA 1.475 0.402 0 C-N-CA 121.902 1.735 . . . . 0.0 112.698 179.774 . . . . . . . . 0 0 . 1 . 036 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 7.7 t . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.343 0.592 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 036 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.484 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -81.67 119.21 23.53 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.728 -179.391 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.418 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 4.9 m-70 -117.01 -19.16 9.89 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.776 -179.381 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.484 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 32.0 mtt180 94.57 148.17 0.04 OUTLIER Pre-proline 0 N--CA 1.482 1.138 0 C-N-CA 123.952 0.901 . . . . 0.0 110.336 -179.423 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo . . . . . 0 N--CA 1.476 0.484 0 C-N-CA 121.881 1.72 . . . . 0.0 112.723 179.309 . . . . . . . . 0 0 . 1 . 037 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.151 0 CA-C-O 121.244 0.545 . . . . 0.0 110.579 . . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.439 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.3 153.56 19.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.041 -179.514 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -143.54 -54.46 0.38 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.69 179.505 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.41 ' HB2' ' NH1' ' A' ' 7' ' ' ARG . 0.9 OUTLIER 171.53 154.14 0.22 Allowed Pre-proline 0 N--CA 1.467 0.381 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.077 179.755 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.4 Cg_endo . . . . . 0 N--CA 1.474 0.343 0 C-N-CA 121.87 1.714 . . . . 0.0 112.654 179.996 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.1 m . . . . . 0 CA--C 1.519 -0.243 0 CA-C-O 121.359 0.6 . . . . 0.0 110.131 . . . . . . . . . 0 0 . 1 . 038 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -93.38 172.42 8.29 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.129 -179.247 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 4.1 t-160 -173.89 -42.64 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.729 179.745 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.3 mtt85 -179.93 155.75 0.73 Allowed Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.235 179.433 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo . . . . . 0 C--N 1.344 0.341 0 C-N-CA 121.951 1.767 . . . . 0.0 112.704 -179.852 . . . . . . . . 0 0 . 1 . 039 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.521 -0.136 0 CA-C-O 121.132 0.492 . . . . 0.0 110.16 . . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -103.12 163.57 12.15 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.555 0.693 . . . . 0.0 111.362 -179.31 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -159.9 -48.51 0.05 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.255 179.688 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.16 157.7 0.37 Allowed Pre-proline 0 CA--C 1.532 0.278 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.959 179.54 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo . . . . . 0 N--CA 1.474 0.333 0 C-N-CA 121.864 1.709 . . . . 0.0 112.614 179.537 . . . . . . . . 0 0 . 1 . 040 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.7 m . . . . . 0 CA--C 1.517 -0.321 0 CA-C-O 121.544 0.688 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 040 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -61.65 153.43 28.03 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.937 -1.028 . . . . 0.0 111.382 -179.179 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -146.64 -49.41 0.2 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.636 -1.165 . . . . 0.0 109.426 179.643 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.4 mtt180 176.09 157.34 0.41 Allowed Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.119 179.683 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo . . . . . 0 N--CA 1.474 0.375 0 C-N-CA 121.872 1.715 . . . . 0.0 112.663 179.838 . . . . . . . . 0 0 . 1 . 041 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.5 p . . . . . 0 CA--C 1.52 -0.205 0 CA-C-O 121.582 0.706 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 041 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.461 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -98.86 132.7 44.0 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.018 -179.532 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.95 -62.11 1.59 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.211 179.226 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.8 mtp180 159.85 147.3 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.69 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.452 179.199 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.461 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.5 Cg_endo . . . . . 0 C--N 1.344 0.341 0 C-N-CA 121.905 1.737 . . . . 0.0 112.61 179.897 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 CA--C 1.518 -0.257 0 CA-C-O 121.532 0.682 . . . . 0.0 110.612 . . . . . . . . . 0 0 . 1 . 042 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.437 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER 61.29 118.88 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.65 179.279 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -110.77 -49.61 3.02 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.014 178.53 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 158.92 151.57 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.719 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.631 179.239 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.437 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo . . . . . 0 N--CA 1.474 0.377 0 C-N-CA 121.833 1.689 . . . . 0.0 112.624 179.872 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.7 m . . . . . 0 CA--C 1.518 -0.274 0 CA-C-O 121.469 0.652 . . . . 0.0 110.383 . . . . . . . . . 0 0 . 1 . 043 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.406 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -116.32 158.6 23.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.908 -178.971 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -152.04 -50.44 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.609 -1.178 . . . . 0.0 108.752 179.319 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.9 mtp180 168.68 153.97 0.14 Allowed Pre-proline 0 N--CA 1.466 0.338 0 CA-C-N 115.032 -0.985 . . . . 0.0 109.723 179.175 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.2 Cg_endo . . . . . 0 N--CA 1.473 0.303 0 C-N-CA 121.963 1.776 . . . . 0.0 112.598 -179.932 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 74.0 m . . . . . 0 CA--C 1.517 -0.304 0 CA-C-O 121.559 0.695 . . . . 0.0 110.342 . . . . . . . . . 0 0 . 1 . 044 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -67.64 166.9 14.11 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.44 -179.336 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -166.37 -45.9 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.352 179.793 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.401 ' NH1' ' HB2' ' A' ' 7' ' ' ARG . 0.7 OUTLIER 176.33 153.38 0.37 Allowed Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.871 179.507 . . . . . . . . 3 3 . 1 . 044 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo . . . . . 0 N--CA 1.476 0.455 0 C-N-CA 122.046 1.831 . . . . 0.0 113.187 -179.75 . . . . . . . . 0 0 . 1 . 045 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.517 -0.31 0 CA-C-O 121.5 0.667 . . . . 0.0 110.512 . . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.427 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -111.6 142.82 43.42 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.914 -179.245 . . . . . . . . 3 3 . 1 . 045 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -134.84 -51.37 0.78 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.567 -1.197 . . . . 0.0 108.782 178.939 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.1 mtt180 168.21 157.45 0.15 Allowed Pre-proline 0 N--CA 1.465 0.305 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.466 179.456 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.427 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 39.8 Cg_endo . . . . . 0 N--CA 1.475 0.403 0 C-N-CA 121.67 1.58 . . . . 0.0 112.581 179.335 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.5 p . . . . . 0 CA--C 1.521 -0.17 0 CA-C-O 121.431 0.634 . . . . 0.0 110.488 . . . . . . . . . 0 0 . 1 . 046 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.441 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -70.49 128.85 37.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.554 -179.724 . . . . . . . . 3 3 . 1 . 046 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.99 -15.76 9.92 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.683 -179.159 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.441 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER 83.94 148.3 0.1 OUTLIER Pre-proline 0 N--CA 1.476 0.858 0 C-N-CA 122.713 0.405 . . . . 0.0 110.117 -179.154 . . . . . . . . 3 3 . 1 . 046 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo . . . . . 0 C--N 1.342 0.235 0 C-N-CA 121.754 1.636 . . . . 0.0 112.673 179.125 . . . . . . . . 0 0 . 1 . 047 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.522 -0.134 0 CA-C-O 121.228 0.537 . . . . 0.0 109.965 . . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.409 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.56 151.26 22.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.323 -179.177 . . . . . . . . 3 3 . 1 . 047 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -143.01 -50.05 0.34 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.468 179.464 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 173.51 155.82 0.28 Allowed Pre-proline 0 N--CA 1.466 0.341 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.027 179.742 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.409 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.6 Cg_endo . . . . . 0 N--CA 1.474 0.344 0 C-N-CA 121.904 1.736 . . . . 0.0 112.523 179.944 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.522 -0.117 0 CA-C-O 121.186 0.517 . . . . 0.0 110.337 . . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.406 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -109.73 155.62 21.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.479 -179.398 . . . . . . . . 3 3 . 1 . 048 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.28 -49.44 0.14 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.199 179.356 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 175.91 156.63 0.4 Allowed Pre-proline 0 CA--C 1.534 0.345 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.824 179.394 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo . . . . . 0 N--CA 1.474 0.325 0 C-N-CA 121.961 1.774 . . . . 0.0 112.548 -179.974 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.1 m . . . . . 0 C--O 1.232 0.139 0 CA-C-O 121.058 0.456 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 049 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.415 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -162.41 162.12 27.57 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.686 0.755 . . . . 0.0 111.788 -179.87 . . . . . . . . 3 3 . 1 . 049 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -154.03 -51.0 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.884 179.377 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 165.52 154.15 0.08 OUTLIER Pre-proline 0 N--CA 1.468 0.468 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.978 179.24 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.415 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.3 Cg_endo . . . . . 0 C--N 1.343 0.245 0 C-N-CA 121.936 1.757 . . . . 0.0 112.371 179.624 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.0 m . . . . . 0 CA--C 1.516 -0.328 0 CA-C-O 121.636 0.731 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 050 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.439 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER 61.42 117.81 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.74 179.091 . . . . . . . . 3 3 . 1 . 050 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -112.57 -45.23 3.25 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.761 -1.108 . . . . 0.0 108.96 178.34 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.2 mtt180 162.43 153.65 0.04 OUTLIER Pre-proline 0 N--CA 1.47 0.556 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.89 179.268 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.0 Cg_endo . . . . . 0 N--CA 1.473 0.323 0 C-N-CA 121.912 1.741 . . . . 0.0 112.613 -179.953 . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 CA--C 1.52 -0.199 0 CA-C-O 121.257 0.551 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 051 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.423 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -97.43 153.81 17.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.031 -179.457 . . . . . . . . 3 3 . 1 . 051 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -143.75 -59.74 0.4 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.427 179.622 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 172.79 153.49 0.24 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.922 179.588 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.423 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.4 Cg_endo . . . . . 0 N--CA 1.473 0.318 0 C-N-CA 121.855 1.704 . . . . 0.0 112.507 179.871 . . . . . . . . 1 1 . 1 . 052 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 70.7 m . . . . . 0 C--O 1.234 0.267 0 CA-C-O 121.398 0.618 . . . . 0.0 110.497 . . . . . . . . . 0 0 . 1 . 052 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.433 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER 62.94 -173.77 0.15 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.69 0.757 . . . . 0.0 110.36 179.551 . . . . . . . . 3 3 . 1 . 052 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 174.24 -45.11 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.616 -1.174 . . . . 0.0 108.623 -179.762 . . . . . . . . 2 2 . 1 . 052 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 164.29 154.4 0.06 OUTLIER Pre-proline 0 N--CA 1.468 0.429 0 CA-C-N 114.86 -1.064 . . . . 0.0 109.703 179.179 . . . . . . . . 2 2 . 1 . 052 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.433 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.3 Cg_endo . . . . . 0 N--CA 1.473 0.312 0 C-N-CA 121.864 1.709 . . . . 0.0 112.513 179.882 . . . . . . . . 1 1 . 1 . 053 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.519 -0.242 0 CA-C-O 121.367 0.603 . . . . 0.0 110.614 . . . . . . . . . 1 1 . 1 . 053 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.439 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -177.59 145.21 0.41 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.816 179.799 . . . . . . . . 3 3 . 1 . 053 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -134.96 -51.12 0.77 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.547 -1.206 . . . . 0.0 108.898 178.819 . . . . . . . . 2 2 . 1 . 053 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 160.18 152.91 0.03 OUTLIER Pre-proline 0 N--CA 1.471 0.606 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.606 179.364 . . . . . . . . 1 1 . 1 . 053 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo . . . . . 0 N--CA 1.473 0.319 0 C-N-CA 121.911 1.741 . . . . 0.0 112.537 179.784 . . . . . . . . 1 1 . 1 . 054 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.8 m . . . . . 0 CA--C 1.519 -0.245 0 CA-C-O 121.305 0.574 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 054 nuclear build core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -107.71 172.71 6.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.66 -179.061 . . . . . . . . 2 2 . 1 . 054 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -176.63 -43.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.606 -1.179 . . . . 0.0 109.081 179.902 . . . . . . . . 2 2 . 1 . 054 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 173.84 154.26 0.28 Allowed Pre-proline 0 CA--C 1.534 0.338 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.805 179.284 . . . . . . . . 2 2 . 1 . 054 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo . . . . . 0 C--N 1.343 0.263 0 C-N-CA 121.853 1.702 . . . . 0.0 112.794 -179.763 . . . . . . . . 0 0 . 1 . 055 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 m . . . . . 0 CA--C 1.52 -0.186 0 CA-C-O 121.302 0.572 . . . . 0.0 110.617 . . . . . . . . . 0 0 . 1 . 055 nuclear build core ' A' A ' 5' ' ' TRP . . . . . 0.44 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -119.27 171.25 8.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.426 -179.601 . . . . . . . . 3 3 . 1 . 055 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -160.07 -64.99 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.168 179.596 . . . . . . . . 2 2 . 1 . 055 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.1 mtp180 169.54 150.89 0.14 Allowed Pre-proline 0 N--CA 1.468 0.453 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.857 179.043 . . . . . . . . 1 1 . 1 . 055 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.44 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.6 Cg_endo . . . . . 0 C--N 1.345 0.344 0 C-N-CA 121.924 1.749 . . . . 0.0 112.613 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.453 ' N ' HD12 ' A' ' 1' ' ' LEU . 5.0 mp . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -148.08 -115.65 0.84 Allowed Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -127.78 -166.73 1.65 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.923 0.392 . . . . 0.0 110.297 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.0 p -63.39 131.93 49.81 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.396 0.617 . . . . 0.0 110.104 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.418 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -99.76 126.69 45.87 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.063 -179.226 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.401 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -117.7 -15.5 10.12 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.086 -0.961 . . . . 0.0 111.481 -179.627 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.418 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 8.8 mtp180 88.29 155.14 0.09 OUTLIER Pre-proline 0 N--CA 1.478 0.928 0 C-N-CA 123.332 0.653 . . . . 0.0 110.61 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -83.01 45.83 1.99 Allowed 'Trans proline' 0 N--CA 1.477 0.537 0 C-N-CA 122.201 1.934 . . . . 0.0 113.43 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 53.12 75.8 0.23 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.259 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.219 -0.524 0 CA-C-O 118.022 -0.99 . . . . 0.0 110.371 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 114.55 70.77 0.51 Allowed Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.2 173.87 15.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.983 0.42 . . . . 0.0 110.247 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.2 m -150.27 155.98 40.71 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.42 0.629 . . . . 0.0 110.985 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.472 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -99.52 153.45 19.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.715 -179.495 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -133.32 -67.33 0.62 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.754 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 162.6 150.36 0.04 OUTLIER Pre-proline 0 N--CA 1.473 0.689 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.647 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.472 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 42.3 Cg_endo -86.12 52.6 2.96 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.034 1.823 . . . . 0.0 112.632 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.8 t70 60.12 39.02 20.05 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.447 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt . . . . . 0 C--O 1.22 -0.487 0 CA-C-O 118.064 -0.969 . . . . 0.0 110.364 -179.999 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.1 mp . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 109.335 -0.616 . . . . 0.0 109.335 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 86.6 -125.35 7.37 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.71 -173.61 0.13 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.044 0.45 . . . . 0.0 110.553 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.3 m -111.38 152.48 27.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.534 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.448 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.35 127.89 49.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.063 -179.565 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -108.68 -64.15 1.26 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.458 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 155.77 149.88 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.75 0 CA-C-N 114.821 -1.082 . . . . 0.0 109.474 179.358 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.448 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.4 Cg_endo -84.19 55.71 4.72 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 121.829 1.686 . . . . 0.0 112.378 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -151.34 49.2 0.83 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.468 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 118.007 -0.996 . . . . 0.0 110.622 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.1 tp . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -108.58 68.39 0.22 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -133.65 -172.6 3.01 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.11 0.481 . . . . 0.0 110.486 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 63.23 120.89 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.386 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.462 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -93.78 125.78 38.59 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.895 -179.522 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -119.62 -14.42 9.08 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.641 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.462 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 17.9 mtt180 86.17 140.91 0.05 OUTLIER Pre-proline 0 N--CA 1.475 0.778 0 C-N-CA 123.335 0.654 . . . . 0.0 110.226 -179.284 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -84.19 46.8 2.06 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 121.84 1.693 . . . . 0.0 113.538 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -128.38 118.15 22.66 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.233 0.54 . . . . 0.0 110.482 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.5 tttt . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.334 -179.907 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.457 HD13 ' HA ' ' A' ' 1' ' ' LEU . 3.7 mm? . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -79.64 162.15 46.96 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.513 -1.035 . . . . 0.0 110.513 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.71 -165.48 0.21 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 120.83 0.348 . . . . 0.0 110.295 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.43 158.33 15.65 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.309 0.576 . . . . 0.0 109.788 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.406 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.6 OUTLIER -99.25 144.27 28.56 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.633 -178.848 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.2 m170 -135.24 -46.43 0.7 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.762 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.1 mtt180 -178.64 160.67 1.1 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.121 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 39.9 Cg_endo -81.29 56.73 6.14 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 121.906 1.737 . . . . 0.0 112.672 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.9 t0 61.46 156.09 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.527 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.3 tttt . . . . . 0 C--O 1.22 -0.458 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.439 179.998 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 14.2 mt . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 97.39 169.84 33.11 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 110.874 -0.89 . . . . 0.0 110.874 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -94.09 67.54 3.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.519 0.676 . . . . 0.0 110.368 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.2 m 60.48 33.81 20.53 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.782 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.474 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER 61.04 118.93 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.283 -0.872 . . . . 0.0 111.601 179.109 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.41 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 2.2 m170 -98.83 -61.44 1.37 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.107 178.409 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.41 ' CB ' ' O ' ' A' ' 6' ' ' HIS . 1.5 mtt180 148.71 145.8 0.0 OUTLIER Pre-proline 0 N--CA 1.48 1.052 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.486 179.074 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.474 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.8 Cg_endo -85.55 55.58 3.97 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 121.899 1.733 . . . . 0.0 112.445 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -156.74 -179.49 8.25 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.465 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 43.9 mttm . . . . . 0 C--O 1.22 -0.448 0 CA-C-O 117.963 -1.017 . . . . 0.0 110.438 179.96 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -137.99 30.61 2.54 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 111.091 -0.803 . . . . 0.0 111.091 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -169.27 131.07 1.17 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.224 0.535 . . . . 0.0 110.658 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.4 m -172.18 136.22 0.83 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.062 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -93.63 157.32 16.23 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.852 -178.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -155.2 -48.17 0.08 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.362 -1.29 . . . . 0.0 109.122 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.19 162.26 3.5 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.09 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -81.1 55.28 5.6 Favored 'Trans proline' 0 N--CA 1.476 0.455 0 C-N-CA 121.863 1.709 . . . . 0.0 112.567 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -175.23 97.92 0.08 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.976 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.8 mtmt . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.417 -179.738 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 161.15 -169.65 36.78 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.1 -165.71 0.22 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.97 0.414 . . . . 0.0 110.271 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.53 165.58 14.2 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.353 0.597 . . . . 0.0 109.435 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -99.29 158.42 15.71 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.817 -178.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -155.36 -47.32 0.08 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.277 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -161.58 156.81 20.46 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.309 -0.859 . . . . 0.0 109.917 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -83.58 55.45 4.92 Favored 'Trans proline' 0 N--CA 1.474 0.345 0 C-N-CA 121.972 1.781 . . . . 0.0 112.61 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -96.09 87.45 4.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.393 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.2 mtpt . . . . . 0 C--O 1.221 -0.436 0 CA-C-O 117.929 -1.034 . . . . 0.0 110.346 179.952 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.431 ' HA ' HD22 ' A' ' 1' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -163.63 -109.22 0.23 Allowed Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -175.86 -178.21 1.03 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.026 0.441 . . . . 0.0 110.543 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.3 m -116.94 164.13 15.16 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.074 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -93.03 167.29 11.89 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.479 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -170.56 -45.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.304 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.41 153.63 0.21 Allowed Pre-proline 0 N--CA 1.466 0.348 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.848 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -86.07 47.44 1.83 Allowed 'Trans proline' 0 N--CA 1.476 0.461 0 C-N-CA 121.96 1.773 . . . . 0.0 112.983 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.8 t70 60.1 81.48 0.18 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.595 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.6 tttt . . . . . 0 C--O 1.219 -0.511 0 CA-C-O 118.064 -0.97 . . . . 0.0 110.597 179.996 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.4 mp . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -93.93 117.02 5.38 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.16 177.44 7.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.072 0.463 . . . . 0.0 110.406 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.4 t -178.52 158.32 1.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.573 0.701 . . . . 0.0 110.772 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.408 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 1.2 t90 -92.46 123.68 35.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.819 -1.082 . . . . 0.0 112.037 -178.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -115.54 -33.44 5.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.019 178.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.76 162.02 1.34 Allowed Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.238 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.408 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.5 Cg_endo -81.89 55.35 5.43 Favored 'Trans proline' 0 N--CA 1.475 0.43 0 C-N-CA 121.941 1.761 . . . . 0.0 112.77 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -107.28 64.34 0.63 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.377 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.2 tptp . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 118.055 -0.974 . . . . 0.0 110.545 179.955 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.474 HD23 ' N ' ' A' ' 2' ' ' GLY . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.474 ' N ' HD23 ' A' ' 1' ' ' LEU . . . 165.23 86.22 0.06 OUTLIER Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -88.12 111.9 22.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.199 0.523 . . . . 0.0 110.689 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 p -105.22 145.82 30.12 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.898 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -96.61 147.84 23.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.667 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -140.41 -46.84 0.42 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.603 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -177.45 161.32 1.41 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.164 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -81.17 54.44 5.21 Favored 'Trans proline' 0 N--CA 1.476 0.45 0 C-N-CA 121.974 1.782 . . . . 0.0 113.249 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 57.24 -176.5 0.06 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.813 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.316 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.2 mp . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 169.74 -165.56 38.92 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.751 -0.939 . . . . 0.0 110.751 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -90.19 179.35 5.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.029 0.442 . . . . 0.0 110.447 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 p -99.52 132.94 44.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.275 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.44 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -119.14 130.82 55.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.906 -179.624 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.04 -16.44 10.48 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.319 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.44 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 3.3 mtt180 82.02 147.39 0.1 Allowed Pre-proline 0 N--CA 1.473 0.709 0 C-N-CA 122.668 0.387 . . . . 0.0 110.308 -179.465 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -83.43 52.13 3.78 Favored 'Trans proline' 0 N--CA 1.474 0.348 0 C-N-CA 121.72 1.613 . . . . 0.0 112.397 178.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 41.94 95.65 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 115.406 -0.815 . . . . 0.0 112.014 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.6 ttpt . . . . . 0 C--O 1.22 -0.458 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.578 -179.99 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 4.4 tp . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 148.6 -83.52 0.18 Allowed Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.731 -0.948 . . . . 0.0 110.731 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.82 162.29 0.06 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.101 0.477 . . . . 0.0 110.6 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -124.87 155.82 38.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.354 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -96.33 170.91 8.91 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.107 -179.325 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -170.1 -44.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.911 -1.04 . . . . 0.0 109.577 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.4 mtt85 179.77 158.09 0.77 Allowed Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.143 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -82.28 57.8 6.33 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 121.955 1.77 . . . . 0.0 112.376 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.5 t70 64.31 68.45 0.55 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.328 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.5 pttt . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.572 -179.973 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.432 HD22 ' HA ' ' A' ' 1' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -130.25 58.59 0.7 Allowed Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.822 -0.911 . . . . 0.0 110.822 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -90.45 162.1 15.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.008 0.432 . . . . 0.0 110.481 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.6 t -118.25 156.01 29.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.469 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.429 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.3 OUTLIER -97.76 142.72 29.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.132 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -132.8 -48.93 0.88 Allowed 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.683 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 172.14 157.43 0.25 Allowed Pre-proline 0 CA--C 1.535 0.372 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.021 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.429 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.0 Cg_endo -83.21 56.98 5.7 Favored 'Trans proline' 0 N--CA 1.473 0.293 0 C-N-CA 121.97 1.78 . . . . 0.0 112.365 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -68.68 116.89 9.71 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.496 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.7 mttm . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.398 179.966 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.0 tt . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -62.02 -74.74 0.37 Allowed Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.819 -0.912 . . . . 0.0 110.819 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.64 -177.75 0.11 Allowed 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.014 0.435 . . . . 0.0 110.4 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.9 p -130.42 156.27 45.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.399 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.44 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -99.76 147.47 25.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.009 -179.364 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -135.66 -55.69 0.78 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.541 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 167.4 153.34 0.11 Allowed Pre-proline 0 N--CA 1.468 0.467 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.778 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.44 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.4 Cg_endo -84.15 56.74 5.1 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 121.883 1.722 . . . . 0.0 112.327 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -169.42 84.74 0.14 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.31 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.404 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 7.3 mt . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 95.2 -119.01 6.03 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -72.47 -171.85 0.86 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.069 0.461 . . . . 0.0 110.469 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.7 p -123.25 166.68 14.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.099 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -91.77 147.67 22.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.239 -178.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.66 -48.98 0.43 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.605 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 178.87 157.27 0.63 Allowed Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.282 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -82.9 56.6 5.69 Favored 'Trans proline' 0 N--CA 1.474 0.372 0 C-N-CA 121.977 1.785 . . . . 0.0 112.544 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -132.59 118.03 18.68 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.47 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.1 ttpp . . . . . 0 C--O 1.22 -0.477 0 CA-C-O 118.103 -0.951 . . . . 0.0 110.428 -179.977 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.4 tp . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 105.79 -159.91 15.08 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.799 -0.92 . . . . 0.0 110.799 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.69 167.79 20.69 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.207 0.527 . . . . 0.0 110.643 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.1 p -150.52 158.22 43.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.141 179.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.416 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -90.54 135.06 33.94 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.48 -178.942 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -127.36 -46.4 1.48 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.746 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.4 mtp85 176.74 158.85 0.46 Allowed Pre-proline 0 CA--C 1.534 0.337 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.919 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.416 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.2 Cg_endo -82.04 56.03 5.67 Favored 'Trans proline' 0 N--CA 1.476 0.461 0 C-N-CA 121.841 1.694 . . . . 0.0 112.725 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -90.91 89.1 7.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.511 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? . . . . . 0 C--O 1.22 -0.462 0 CA-C-O 117.997 -1.002 . . . . 0.0 110.431 -179.881 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 7.0 mt . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -78.1 -134.71 0.83 Allowed Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.712 -0.955 . . . . 0.0 110.712 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.86 174.0 3.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.229 0.538 . . . . 0.0 110.561 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.8 m -163.04 156.29 19.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.317 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.478 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.2 OUTLIER -89.24 123.25 33.29 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.732 -179.372 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.405 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -123.65 -15.42 7.03 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.08 -179.238 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.478 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 32.9 mtp180 91.89 146.89 0.05 OUTLIER Pre-proline 0 N--CA 1.48 1.046 0 C-N-CA 123.83 0.852 . . . . 0.0 110.334 -179.195 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -84.64 47.59 2.19 Favored 'Trans proline' 0 N--CA 1.477 0.513 0 C-N-CA 121.924 1.749 . . . . 0.0 113.011 179.334 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -77.8 113.99 16.22 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.351 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.4 tttm . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.401 -179.931 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.0 mp . . . . . 0 N--CA 1.492 1.673 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.47 144.7 48.84 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.5 -174.52 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.176 0.512 . . . . 0.0 110.614 -179.811 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.1 m 63.12 126.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.531 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -108.15 157.78 18.0 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.354 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -153.14 -49.96 0.1 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.03 179.393 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 168.74 153.14 0.13 Allowed Pre-proline 0 N--CA 1.467 0.377 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.954 179.316 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -83.46 55.89 5.15 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 121.984 1.79 . . . . 0.0 112.693 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -65.47 118.09 8.93 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.306 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.7 mttp . . . . . 0 C--O 1.22 -0.482 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.43 179.988 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.597 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -86.45 -157.12 29.54 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.801 -0.919 . . . . 0.0 110.801 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.15 166.62 5.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.119 0.485 . . . . 0.0 110.421 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.7 p -174.23 141.32 0.73 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.492 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.487 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -73.47 128.05 34.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.617 -179.73 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.4 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -125.51 -14.67 6.3 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.179 -178.981 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.487 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 27.8 mtm180 87.26 143.28 0.05 OUTLIER Pre-proline 0 N--CA 1.476 0.829 0 C-N-CA 123.245 0.618 . . . . 0.0 110.495 -179.258 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -82.15 51.21 3.71 Favored 'Trans proline' 0 N--CA 1.477 0.558 0 C-N-CA 121.927 1.751 . . . . 0.0 112.886 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.1 t70 57.71 103.86 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.737 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.9 tttm . . . . . 0 C--O 1.221 -0.429 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.508 179.999 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.62 HD12 ' O ' ' A' ' 1' ' ' LEU . 3.6 pp . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.027 0.441 . . . . 0.0 109.866 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 85.53 -99.73 2.39 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.823 -0.911 . . . . 0.0 110.823 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.84 -173.63 0.13 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.095 0.474 . . . . 0.0 110.568 179.945 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.0 p -100.31 143.21 30.76 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.363 -179.994 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.403 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -105.54 127.76 53.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.452 -179.749 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -117.66 -15.82 10.13 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.617 -179.287 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.403 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 0.0 OUTLIER 84.39 145.62 0.08 OUTLIER Pre-proline 0 N--CA 1.476 0.841 0 C-N-CA 122.822 0.449 . . . . 0.0 110.127 -179.409 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -85.0 48.43 2.33 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 121.825 1.683 . . . . 0.0 112.931 179.32 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 24.5 t70 61.1 156.65 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.503 179.979 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 117.953 -1.022 . . . . 0.0 110.431 -179.965 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.1 mt . . . . . 0 N--CA 1.489 1.482 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -166.89 134.3 3.22 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 -179.994 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.41 -177.8 0.1 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.072 0.463 . . . . 0.0 110.551 179.906 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.6 m -156.6 159.82 38.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.507 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -96.84 168.39 10.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.337 -179.257 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -164.48 -63.24 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.977 -1.01 . . . . 0.0 109.203 179.788 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.43 151.85 0.2 Allowed Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.915 179.322 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -87.02 46.52 1.45 Allowed 'Trans proline' 0 N--CA 1.475 0.384 0 C-N-CA 122.133 1.889 . . . . 0.0 113.051 179.985 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.3 t70 57.32 88.98 0.05 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.776 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? . . . . . 0 C--O 1.221 -0.406 0 CA-C-O 117.908 -1.044 . . . . 0.0 110.415 -179.894 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.458 HD13 ' HA ' ' A' ' 1' ' ' LEU . 2.7 mm? . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -143.0 104.55 0.36 Allowed Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 179.997 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.24 160.5 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.058 0.456 . . . . 0.0 110.58 179.972 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -115.39 123.8 49.59 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.516 -179.978 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.457 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -140.2 147.43 40.06 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.424 -179.544 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.406 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 2.2 m-70 -123.03 -66.94 0.98 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.048 178.94 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.412 ' HG3' ' CZ3' ' A' ' 5' ' ' TRP . 16.8 mtp180 149.24 143.21 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.938 0 CA-C-N 114.776 -1.102 . . . . 0.0 109.534 178.936 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.457 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 43.1 Cg_endo -87.61 52.22 2.26 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 121.964 1.776 . . . . 0.0 112.384 179.546 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -89.85 164.23 14.7 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.688 -179.686 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.7 mtpp . . . . . 0 C--O 1.22 -0.484 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.424 179.979 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.453 HD22 ' HB2' ' A' ' 3' ' ' ALA . 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 . . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 66.4 51.51 42.42 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.702 -0.959 . . . . 0.0 110.702 -179.894 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.453 ' HB2' HD22 ' A' ' 1' ' ' LEU . . . -82.95 -178.24 7.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.166 0.508 . . . . 0.0 110.446 -179.918 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 31.1 t -143.56 163.21 33.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.397 -179.994 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.42 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.8 OUTLIER -90.88 134.67 34.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.271 -179.13 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.2 m170 -124.03 -45.94 1.98 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.019 179.507 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.5 mtp85 173.31 160.33 0.29 Allowed Pre-proline 0 N--CA 1.466 0.326 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.016 179.926 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.42 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.0 Cg_endo -82.34 55.74 5.48 Favored 'Trans proline' 0 N--CA 1.473 0.307 0 C-N-CA 121.897 1.732 . . . . 0.0 112.596 179.643 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -125.4 146.33 49.65 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.398 179.846 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.3 ttmt . . . . . 0 C--O 1.22 -0.485 0 CA-C-O 118.058 -0.972 . . . . 0.0 110.544 -179.98 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 159.29 -112.39 0.52 Allowed Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.804 -0.918 . . . . 0.0 110.804 179.942 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -178.11 -164.72 0.09 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.945 0.402 . . . . 0.0 110.167 -179.803 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.1 m -76.94 156.11 32.24 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 121.404 0.621 . . . . 0.0 109.373 179.321 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -97.11 139.5 33.01 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.021 -178.57 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -130.76 -44.29 1.08 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.748 -1.115 . . . . 0.0 109.708 179.293 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.4 mtp85 -171.07 161.8 5.42 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.013 -179.981 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -81.42 56.19 5.89 Favored 'Trans proline' 0 N--CA 1.475 0.422 0 C-N-CA 121.898 1.732 . . . . 0.0 112.646 179.678 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -78.23 152.01 32.82 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.331 179.965 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.0 mttp . . . . . 0 C--O 1.219 -0.504 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.437 179.939 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -88.94 -163.07 39.1 Favored Glycine 0 CA--C 1.523 0.581 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 -179.797 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -148.84 47.89 1.01 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.481 0.657 . . . . 0.0 109.937 -179.716 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.3 m 61.07 96.46 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.884 -179.175 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.434 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -39.24 137.55 0.73 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.434 -1.257 . . . . 0.0 113.512 -178.698 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -130.96 -48.75 1.02 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.38 -1.282 . . . . 0.0 108.864 178.582 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.7 mtp180 165.16 154.33 0.07 OUTLIER Pre-proline 0 N--CA 1.468 0.473 0 CA-C-N 115.186 -0.916 . . . . 0.0 109.846 179.019 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.434 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.1 Cg_endo -82.87 55.59 5.29 Favored 'Trans proline' 0 N--CA 1.475 0.399 0 C-N-CA 121.944 1.763 . . . . 0.0 112.687 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -154.69 80.4 1.09 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.154 179.864 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 50.8 mttt . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.598 -179.887 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 8.0 tt . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 178.06 -95.05 0.1 OUTLIER Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 -179.944 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -104.16 40.06 1.53 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.284 0.564 . . . . 0.0 110.458 179.985 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.8 t -105.81 129.53 53.98 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.597 0.713 . . . . 0.0 109.887 179.593 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -63.84 134.79 55.85 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.672 -1.149 . . . . 0.0 112.262 -178.614 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -122.6 -43.21 2.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.469 -1.241 . . . . 0.0 109.619 179.071 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.47 167.34 1.01 Allowed Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.678 179.865 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -81.0 54.94 5.48 Favored 'Trans proline' 0 N--CA 1.475 0.414 0 C-N-CA 122.07 1.847 . . . . 0.0 112.778 179.514 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.1 p30 44.57 -170.85 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 115.192 -0.913 . . . . 0.0 112.026 179.751 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt . . . . . 0 C--O 1.221 -0.405 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.323 -179.717 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.1 tp . . . . . 0 N--CA 1.491 1.579 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 117.72 -161.68 13.25 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.576 -1.01 . . . . 0.0 110.576 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.34 152.85 42.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.256 0.55 . . . . 0.0 110.7 179.922 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 179.65 145.12 0.18 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.063 179.633 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -95.48 149.42 21.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.401 -179.172 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -145.81 -48.6 0.22 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.381 179.472 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 179.38 157.39 0.7 Allowed Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.091 179.552 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -82.54 56.8 5.85 Favored 'Trans proline' 0 N--CA 1.473 0.29 0 C-N-CA 121.939 1.759 . . . . 0.0 112.635 179.839 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -119.52 83.18 2.0 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.447 179.952 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.1 ttpt . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.408 -179.913 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.8 mp . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -99.56 -35.24 4.72 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 179.883 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -178.4 91.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.007 0.432 . . . . 0.0 110.31 179.992 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -116.92 130.7 56.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.552 -179.966 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.74 173.75 10.05 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.364 -179.727 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -169.68 -56.75 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 114.575 -1.193 . . . . 0.0 108.823 179.62 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 169.43 151.37 0.14 Allowed Pre-proline 0 N--CA 1.467 0.402 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.755 178.812 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -83.97 56.93 5.26 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 121.906 1.738 . . . . 0.0 112.536 179.998 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -115.79 146.87 41.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.44 179.993 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.4 tptt . . . . . 0 C--O 1.219 -0.523 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.604 179.966 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.649 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 60.42 -96.78 0.1 OUTLIER Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 -179.785 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -132.49 122.19 24.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.972 0.415 . . . . 0.0 110.207 179.441 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.8 m -127.37 145.71 50.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.618 0.723 . . . . 0.0 110.72 -179.912 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.419 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -82.74 117.75 22.88 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.833 -178.923 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -111.99 -34.66 5.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.855 178.852 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 170.77 158.44 0.21 Allowed Pre-proline 0 CA--C 1.536 0.437 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.312 179.513 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.419 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 42.3 Cg_endo -82.62 55.11 5.16 Favored 'Trans proline' 0 N--CA 1.476 0.483 0 C-N-CA 122.177 1.918 . . . . 0.0 113.249 -179.664 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.2 t70 54.64 86.19 0.05 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.199 179.671 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.9 ttmt . . . . . 0 C--O 1.22 -0.448 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.551 179.854 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.4 tt . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -84.22 83.29 1.63 Allowed Glycine 0 CA--C 1.523 0.587 0 N-CA-C 110.564 -1.014 . . . . 0.0 110.564 179.844 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -172.64 -166.66 0.39 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.956 0.408 . . . . 0.0 110.3 -179.872 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.9 p -96.36 155.52 16.73 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 121.303 0.573 . . . . 0.0 110.006 179.791 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.428 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -101.36 139.78 36.56 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.223 -179.222 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -128.83 -48.93 1.24 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.638 179.456 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.7 mtp85 167.37 155.29 0.12 Allowed Pre-proline 0 N--CA 1.468 0.472 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.794 179.875 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.428 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.3 Cg_endo -84.02 55.87 4.86 Favored 'Trans proline' 0 N--CA 1.474 0.354 0 C-N-CA 121.925 1.75 . . . . 0.0 112.524 -179.933 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -107.49 139.4 42.06 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.559 -179.89 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.8 ttmt . . . . . 0 C--O 1.22 -0.46 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.356 179.983 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.8 mt . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -161.22 60.2 0.29 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 179.978 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.95 83.81 0.14 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.093 0.473 . . . . 0.0 110.516 -179.868 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.55 134.16 55.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.395 0.617 . . . . 0.0 110.291 179.964 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.432 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -106.32 153.75 21.75 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.213 -179.47 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -143.7 -55.13 0.38 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.181 179.523 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.8 mtt180 165.33 151.73 0.06 OUTLIER Pre-proline 0 N--CA 1.469 0.513 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.717 179.408 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.432 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.4 Cg_endo -84.44 56.08 4.72 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 121.856 1.704 . . . . 0.0 112.572 179.958 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -177.7 144.81 0.38 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.423 -179.935 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.1 tttp . . . . . 0 C--O 1.22 -0.496 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.478 -179.955 . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 . . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 160.31 -33.85 0.42 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.658 -0.977 . . . . 0.0 110.658 -179.989 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.81 178.24 0.1 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.147 0.499 . . . . 0.0 110.575 179.951 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -135.59 150.83 49.79 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.396 179.845 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.434 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.52 152.66 20.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.179 -179.36 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -142.78 -52.51 0.38 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.524 179.636 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 169.97 154.74 0.18 Allowed Pre-proline 0 N--CA 1.468 0.445 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.866 179.679 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.434 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo -83.48 56.26 5.28 Favored 'Trans proline' 0 N--CA 1.473 0.32 0 C-N-CA 121.83 1.686 . . . . 0.0 112.568 179.854 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -82.96 119.73 24.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.316 179.913 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.22 -0.5 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.324 -179.907 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 89.69 -117.1 4.9 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 179.876 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.72 166.1 0.08 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.148 0.499 . . . . 0.0 110.464 -179.848 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.1 m -178.6 150.7 0.54 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.411 179.918 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -69.27 158.99 33.92 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.043 -179.396 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -152.47 -49.34 0.1 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.562 179.834 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 176.19 156.42 0.41 Allowed Pre-proline 0 CA--C 1.533 0.315 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.013 179.67 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -82.88 56.43 5.62 Favored 'Trans proline' 0 N--CA 1.473 0.275 0 C-N-CA 121.951 1.768 . . . . 0.0 112.598 179.958 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -124.56 102.62 7.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.396 179.915 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.221 -0.435 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.194 -179.969 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.429 HD22 ' HA ' ' A' ' 1' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.339 0.59 . . . . 0.0 109.508 . . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 60.9 -135.34 49.13 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 179.849 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.16 -177.83 3.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.07 0.462 . . . . 0.0 110.375 -179.965 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.6 m -100.81 147.83 25.63 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.351 179.944 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -104.3 159.18 15.92 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.48 -179.3 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -152.28 -48.61 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.407 179.563 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 177.22 159.14 0.5 Allowed Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.084 179.724 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -81.91 56.25 5.79 Favored 'Trans proline' 0 N--CA 1.475 0.402 0 C-N-CA 121.902 1.735 . . . . 0.0 112.698 179.774 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 p30 44.36 -170.53 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.087 -0.961 . . . . 0.0 111.946 179.761 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.5 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.372 -179.771 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.0 mp . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 . . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -122.37 -91.6 1.08 Allowed Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.804 -0.918 . . . . 0.0 110.804 -179.946 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -176.69 162.09 2.16 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.143 0.496 . . . . 0.0 110.659 -179.939 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 7.7 t -132.88 153.84 50.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.175 179.846 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.484 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -81.67 119.21 23.53 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.728 -179.391 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.418 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 4.9 m-70 -117.01 -19.16 9.89 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.776 -179.381 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.484 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 32.0 mtt180 94.57 148.17 0.04 OUTLIER Pre-proline 0 N--CA 1.482 1.138 0 C-N-CA 123.952 0.901 . . . . 0.0 110.336 -179.423 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -83.82 48.86 2.69 Favored 'Trans proline' 0 N--CA 1.476 0.484 0 C-N-CA 121.881 1.72 . . . . 0.0 112.723 179.309 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.7 p-10 -107.56 118.03 35.66 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.598 -179.911 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.5 mtmt . . . . . 0 C--O 1.22 -0.459 0 CA-C-O 117.949 -1.024 . . . . 0.0 110.364 179.97 . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.456 HD12 ' O ' ' A' ' 1' ' ' LEU . 1.1 pp . . . . . 0 N--CA 1.492 1.636 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 . . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -114.13 -109.88 2.86 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 -179.982 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.5 -175.6 0.11 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.122 0.487 . . . . 0.0 110.435 -179.949 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -159.02 157.89 32.09 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.579 179.86 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.439 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.3 153.56 19.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.041 -179.514 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -143.54 -54.46 0.38 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.69 179.505 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.41 ' HB2' ' NH1' ' A' ' 7' ' ' ARG . 0.9 OUTLIER 171.53 154.14 0.22 Allowed Pre-proline 0 N--CA 1.467 0.381 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.077 179.755 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.4 Cg_endo -84.16 55.97 4.82 Favored 'Trans proline' 0 N--CA 1.474 0.343 0 C-N-CA 121.87 1.714 . . . . 0.0 112.654 179.996 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.89 84.38 2.82 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.414 179.966 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.9 tptt . . . . . 0 C--O 1.221 -0.433 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.337 179.997 . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 14.8 mt . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 . . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -149.26 -89.58 0.08 OUTLIER Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.891 -0.883 . . . . 0.0 110.891 179.998 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.41 -169.99 3.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.167 0.508 . . . . 0.0 110.436 -179.922 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.1 m -117.09 166.93 11.64 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.131 179.806 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -93.38 172.42 8.29 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.129 -179.247 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 4.1 t-160 -173.89 -42.64 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.729 179.745 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.3 mtt85 -179.93 155.75 0.73 Allowed Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.235 179.433 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -83.13 56.67 5.62 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 121.951 1.767 . . . . 0.0 112.704 -179.852 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -139.79 123.83 17.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.212 -0.903 . . . . 0.0 110.288 179.902 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.436 179.996 . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 . . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -105.89 -72.31 0.83 Allowed Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -179.765 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -114.24 124.7 52.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.083 0.468 . . . . 0.0 110.585 -179.729 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.14 145.53 32.39 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.16 179.743 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -103.12 163.57 12.15 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.555 0.693 . . . . 0.0 111.362 -179.31 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -159.9 -48.51 0.05 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.255 179.688 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.16 157.7 0.37 Allowed Pre-proline 0 CA--C 1.532 0.278 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.959 179.54 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -81.53 56.26 5.89 Favored 'Trans proline' 0 N--CA 1.474 0.333 0 C-N-CA 121.864 1.709 . . . . 0.0 112.614 179.537 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -115.47 111.79 21.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.402 179.964 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.7 mtmm . . . . . 0 C--O 1.219 -0.528 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.335 179.993 . . . . . . . . 0 0 . 1 . 040 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.9 mt . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 0 0 . 1 . 040 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -154.51 -67.79 0.01 OUTLIER Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 -179.97 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -92.69 94.24 8.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.075 0.464 . . . . 0.0 110.486 179.971 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.7 m -124.26 136.18 53.95 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.544 0.688 . . . . 0.0 110.254 179.859 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -61.65 153.43 28.03 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.937 -1.028 . . . . 0.0 111.382 -179.179 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -146.64 -49.41 0.2 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.636 -1.165 . . . . 0.0 109.426 179.643 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.4 mtt180 176.09 157.34 0.41 Allowed Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.119 179.683 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -82.21 56.68 5.89 Favored 'Trans proline' 0 N--CA 1.474 0.375 0 C-N-CA 121.872 1.715 . . . . 0.0 112.663 179.838 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -106.8 172.56 6.75 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.402 179.959 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.6 mttt . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.308 -179.972 . . . . . . . . 0 0 . 1 . 041 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 136.37 -52.01 0.79 Allowed Glycine 0 CA--C 1.526 0.746 0 N-CA-C 110.76 -0.936 . . . . 0.0 110.76 -179.994 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.49 -165.85 1.79 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.879 0.371 . . . . 0.0 110.423 179.998 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.5 p 63.24 134.0 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 121.582 0.706 . . . . 0.0 110.864 179.994 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.461 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -98.86 132.7 44.0 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.018 -179.532 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.95 -62.11 1.59 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.211 179.226 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.8 mtp180 159.85 147.3 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.69 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.452 179.199 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.461 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.5 Cg_endo -86.24 53.29 3.07 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 121.905 1.737 . . . . 0.0 112.61 179.897 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 177.73 -173.53 0.13 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.282 179.927 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.328 179.942 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.427 ' C ' HD23 ' A' ' 1' ' ' LEU . 4.6 tt . . . . . 0 N--CA 1.489 1.511 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -125.55 -97.2 1.09 Allowed Glycine 0 CA--C 1.524 0.644 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 -179.968 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.27 39.49 15.53 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.312 0.577 . . . . 0.0 110.379 -179.896 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.3 m 60.4 35.3 20.51 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.612 179.896 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.437 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER 61.29 118.88 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.65 179.279 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -110.77 -49.61 3.02 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.014 178.53 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 158.92 151.57 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.719 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.631 179.239 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.437 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo -84.15 55.1 4.53 Favored 'Trans proline' 0 N--CA 1.474 0.377 0 C-N-CA 121.833 1.689 . . . . 0.0 112.624 179.872 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.7 t0 59.49 80.28 0.2 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.611 179.956 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 118.005 -0.997 . . . . 0.0 110.34 -179.934 . . . . . . . . 0 0 . 1 . 043 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 . . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 93.11 -133.81 11.88 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 179.739 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.84 -179.01 0.11 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.996 0.427 . . . . 0.0 110.629 -179.842 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.7 m 62.28 117.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.383 -179.866 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.406 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -116.32 158.6 23.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.908 -178.971 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -152.04 -50.44 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.609 -1.178 . . . . 0.0 108.752 179.319 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.9 mtp180 168.68 153.97 0.14 Allowed Pre-proline 0 N--CA 1.466 0.338 0 CA-C-N 115.032 -0.985 . . . . 0.0 109.723 179.175 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.2 Cg_endo -83.54 56.32 5.27 Favored 'Trans proline' 0 N--CA 1.473 0.303 0 C-N-CA 121.963 1.776 . . . . 0.0 112.598 -179.932 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -95.47 173.7 7.38 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.395 179.969 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.7 mmtp . . . . . 0 C--O 1.22 -0.485 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.375 -179.957 . . . . . . . . 0 0 . 1 . 044 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.2 mp . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 044 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.11 -38.86 96.28 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 -179.954 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -117.02 94.49 4.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.065 0.46 . . . . 0.0 110.545 -179.973 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 74.0 m -125.81 136.36 53.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.559 0.695 . . . . 0.0 110.342 179.726 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -67.64 166.9 14.11 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.44 -179.336 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -166.37 -45.9 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.352 179.793 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.401 ' NH1' ' HB2' ' A' ' 7' ' ' ARG . 0.7 OUTLIER 176.33 153.38 0.37 Allowed Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.871 179.507 . . . . . . . . 3 3 . 1 . 044 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -85.42 50.03 2.61 Favored 'Trans proline' 0 N--CA 1.476 0.455 0 C-N-CA 122.046 1.831 . . . . 0.0 113.187 -179.75 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.1 t70 59.48 161.42 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.68 179.729 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.3 mttm . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 118.024 -0.988 . . . . 0.0 110.126 179.852 . . . . . . . . 0 0 . 1 . 045 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.675 HD13 ' N ' ' A' ' 1' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.745 0 CA-C-O 120.746 0.307 . . . . 0.0 110.708 . . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 164.05 -81.79 0.12 Allowed Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.528 -1.029 . . . . 0.0 110.528 179.997 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.73 -174.6 3.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.22 0.533 . . . . 0.0 110.589 179.828 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.86 122.22 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.512 179.924 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.427 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -111.6 142.82 43.42 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.914 -179.245 . . . . . . . . 3 3 . 1 . 045 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -134.84 -51.37 0.78 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.567 -1.197 . . . . 0.0 108.782 178.939 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.1 mtt180 168.21 157.45 0.15 Allowed Pre-proline 0 N--CA 1.465 0.305 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.466 179.456 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.427 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 39.8 Cg_endo -80.18 56.76 6.2 Favored 'Trans proline' 0 N--CA 1.475 0.403 0 C-N-CA 121.67 1.58 . . . . 0.0 112.581 179.335 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -173.17 175.33 3.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.926 179.862 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.1 ttpm? . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.497 179.919 . . . . . . . . 0 0 . 1 . 046 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.416 0.627 . . . . 0.0 109.462 . . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 68.72 171.53 6.96 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 179.902 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.9 152.52 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.196 0.522 . . . . 0.0 110.744 179.987 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.5 p -147.04 145.77 29.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.488 179.975 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.441 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -70.49 128.85 37.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.554 -179.724 . . . . . . . . 3 3 . 1 . 046 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.99 -15.76 9.92 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.683 -179.159 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.441 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER 83.94 148.3 0.1 OUTLIER Pre-proline 0 N--CA 1.476 0.858 0 C-N-CA 122.713 0.405 . . . . 0.0 110.117 -179.154 . . . . . . . . 3 3 . 1 . 046 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -82.95 51.61 3.74 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 121.754 1.636 . . . . 0.0 112.673 179.125 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 t0 67.44 137.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.539 179.826 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.5 mttt . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.953 -1.022 . . . . 0.0 110.456 179.997 . . . . . . . . 0 0 . 1 . 047 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.2 tp . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 0 0 . 1 . 047 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 100.34 75.43 1.16 Allowed Glycine 0 CA--C 1.523 0.573 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 -179.98 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.01 -169.12 0.17 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.081 0.467 . . . . 0.0 110.303 179.965 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.58 153.08 20.06 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.965 179.847 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.409 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.56 151.26 22.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.323 -179.177 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -143.01 -50.05 0.34 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.468 179.464 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 173.51 155.82 0.28 Allowed Pre-proline 0 N--CA 1.466 0.341 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.027 179.742 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.409 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.6 Cg_endo -83.55 56.3 5.26 Favored 'Trans proline' 0 N--CA 1.474 0.344 0 C-N-CA 121.904 1.736 . . . . 0.0 112.523 179.944 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -133.19 178.29 7.01 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.418 -179.985 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.406 -179.966 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 16.9 mt . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 0 0 . 1 . 048 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 153.83 80.15 0.03 OUTLIER Glycine 0 CA--C 1.524 0.613 0 N-CA-C 110.694 -0.963 . . . . 0.0 110.694 -179.989 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -177.67 134.88 0.17 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.998 0.428 . . . . 0.0 110.421 -179.962 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -152.21 139.2 19.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.337 179.878 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.406 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -109.73 155.62 21.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.479 -179.398 . . . . . . . . 3 3 . 1 . 048 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.28 -49.44 0.14 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.199 179.356 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 175.91 156.63 0.4 Allowed Pre-proline 0 CA--C 1.534 0.345 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.824 179.394 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo -83.04 56.83 5.73 Favored 'Trans proline' 0 N--CA 1.474 0.325 0 C-N-CA 121.961 1.774 . . . . 0.0 112.548 -179.974 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -143.79 123.57 13.41 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.463 179.946 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.221 -0.447 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.446 179.958 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.594 HD12 ' O ' ' A' ' 1' ' ' LEU . 1.1 pp . . . . . 0 N--CA 1.494 1.745 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 . . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -122.63 -95.1 1.24 Allowed Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.833 -0.907 . . . . 0.0 110.833 -179.954 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.77 -179.84 0.56 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.056 0.455 . . . . 0.0 110.352 179.895 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.1 m -157.17 135.96 11.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.518 179.986 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.415 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -162.41 162.12 27.57 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.686 0.755 . . . . 0.0 111.788 -179.87 . . . . . . . . 3 3 . 1 . 049 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -154.03 -51.0 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.884 179.377 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 165.52 154.15 0.08 OUTLIER Pre-proline 0 N--CA 1.468 0.468 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.978 179.24 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.415 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.3 Cg_endo -83.06 57.94 6.12 Favored 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 121.936 1.757 . . . . 0.0 112.371 179.624 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.4 t0 64.45 138.43 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.558 -179.895 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.501 0 CA-C-O 118.043 -0.98 . . . . 0.0 110.279 -179.988 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 18.8 mt . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.345 0.593 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 050 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 98.07 -39.91 2.64 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.722 -0.951 . . . . 0.0 110.722 -179.914 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -172.09 140.16 1.17 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.026 0.441 . . . . 0.0 110.328 -179.979 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.0 m -102.68 36.39 2.2 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.636 0.731 . . . . 0.0 110.443 -179.985 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.439 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER 61.42 117.81 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.74 179.091 . . . . . . . . 3 3 . 1 . 050 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -112.57 -45.23 3.25 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.761 -1.108 . . . . 0.0 108.96 178.34 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.2 mtt180 162.43 153.65 0.04 OUTLIER Pre-proline 0 N--CA 1.47 0.556 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.89 179.268 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.0 Cg_endo -83.55 56.28 5.25 Favored 'Trans proline' 0 N--CA 1.473 0.323 0 C-N-CA 121.912 1.741 . . . . 0.0 112.613 -179.953 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -67.51 170.03 8.21 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.429 -179.993 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.6 mttt . . . . . 0 C--O 1.22 -0.482 0 CA-C-O 118.001 -0.999 . . . . 0.0 110.37 -179.962 . . . . . . . . 0 0 . 1 . 051 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 . . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 125.0 -72.96 0.43 Allowed Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.776 -0.929 . . . . 0.0 110.776 -179.91 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -128.77 178.55 6.27 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.132 0.492 . . . . 0.0 110.46 179.96 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.4 p -177.97 155.65 0.99 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.392 179.958 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.423 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -97.43 153.81 17.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.031 -179.457 . . . . . . . . 3 3 . 1 . 051 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -143.75 -59.74 0.4 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.427 179.622 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 172.79 153.49 0.24 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.922 179.588 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.423 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.4 Cg_endo -83.51 56.52 5.36 Favored 'Trans proline' 0 N--CA 1.473 0.318 0 C-N-CA 121.855 1.704 . . . . 0.0 112.507 179.871 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -119.7 158.16 27.04 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.467 -179.981 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.8 tttp . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.371 179.997 . . . . . . . . 0 0 . 1 . 052 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 39.1 mt . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 052 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -168.22 -138.15 2.4 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 -180.0 . . . . . . . . 1 1 . 1 . 052 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.6 42.07 14.52 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.281 0.562 . . . . 0.0 110.493 -179.997 . . . . . . . . 1 1 . 1 . 052 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 70.7 m -97.31 42.6 1.09 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.497 179.982 . . . . . . . . 1 1 . 1 . 052 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.433 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER 62.94 -173.77 0.15 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.69 0.757 . . . . 0.0 110.36 179.551 . . . . . . . . 3 3 . 1 . 052 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 174.24 -45.11 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.616 -1.174 . . . . 0.0 108.623 -179.762 . . . . . . . . 2 2 . 1 . 052 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 164.29 154.4 0.06 OUTLIER Pre-proline 0 N--CA 1.468 0.429 0 CA-C-N 114.86 -1.064 . . . . 0.0 109.703 179.179 . . . . . . . . 2 2 . 1 . 052 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.433 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.3 Cg_endo -83.18 56.76 5.63 Favored 'Trans proline' 0 N--CA 1.473 0.312 0 C-N-CA 121.864 1.709 . . . . 0.0 112.513 179.882 . . . . . . . . 2 2 . 1 . 052 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -166.18 -174.87 3.09 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.226 179.969 . . . . . . . . 1 1 . 1 . 052 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.22 -0.461 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.493 179.951 . . . . . . . . 1 1 . 1 . 053 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 12.7 mt . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 . . . . . . . . . 0 0 . 1 . 053 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 150.47 73.4 0.01 OUTLIER Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 179.988 . . . . . . . . 1 1 . 1 . 053 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.74 145.11 53.44 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.053 0.454 . . . . 0.0 110.376 179.847 . . . . . . . . 1 1 . 1 . 053 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.59 128.09 34.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.367 0.603 . . . . 0.0 110.614 -179.857 . . . . . . . . 2 2 . 1 . 053 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.439 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -177.59 145.21 0.41 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.816 179.799 . . . . . . . . 3 3 . 1 . 053 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -134.96 -51.12 0.77 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.547 -1.206 . . . . 0.0 108.898 178.819 . . . . . . . . 2 2 . 1 . 053 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 160.18 152.91 0.03 OUTLIER Pre-proline 0 N--CA 1.471 0.606 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.606 179.364 . . . . . . . . 1 1 . 1 . 053 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo -83.54 56.07 5.18 Favored 'Trans proline' 0 N--CA 1.473 0.319 0 C-N-CA 121.911 1.741 . . . . 0.0 112.537 179.784 . . . . . . . . 2 2 . 1 . 053 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -140.11 147.12 39.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.337 -179.991 . . . . . . . . 1 1 . 1 . 053 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.433 0 CA-C-O 117.952 -1.023 . . . . 0.0 110.508 -179.982 . . . . . . . . 1 1 . 1 . 054 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.0 pp . . . . . 0 N--CA 1.493 1.69 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 054 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -98.69 -87.42 1.9 Allowed Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.933 -0.867 . . . . 0.0 110.933 -179.917 . . . . . . . . 1 1 . 1 . 054 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.59 -179.22 0.1 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.029 0.442 . . . . 0.0 110.478 -179.937 . . . . . . . . 1 1 . 1 . 054 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.8 m -63.51 132.96 52.95 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.112 179.914 . . . . . . . . 1 1 . 1 . 054 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -107.71 172.71 6.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.66 -179.061 . . . . . . . . 2 2 . 1 . 054 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -176.63 -43.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.606 -1.179 . . . . 0.0 109.081 179.902 . . . . . . . . 2 2 . 1 . 054 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 173.84 154.26 0.28 Allowed Pre-proline 0 CA--C 1.534 0.338 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.805 179.284 . . . . . . . . 2 2 . 1 . 054 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -83.43 56.62 5.44 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 121.853 1.702 . . . . 0.0 112.794 -179.763 . . . . . . . . 1 1 . 1 . 054 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -102.56 44.81 0.99 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.195 179.786 . . . . . . . . 1 1 . 1 . 054 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.5 tttm . . . . . 0 C--O 1.221 -0.447 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.475 -179.991 . . . . . . . . 0 0 . 1 . 055 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.0 mp . . . . . 0 N--CA 1.491 1.604 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 . . . . . . . . . 0 0 . 1 . 055 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -137.03 114.54 1.14 Allowed Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.908 -0.877 . . . . 0.0 110.908 -179.886 . . . . . . . . 1 1 . 1 . 055 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -111.61 93.6 4.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.051 0.453 . . . . 0.0 110.234 179.811 . . . . . . . . 1 1 . 1 . 055 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 m -80.42 133.12 35.84 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.617 -179.722 . . . . . . . . 1 1 . 1 . 055 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.44 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -119.27 171.25 8.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.426 -179.601 . . . . . . . . 3 3 . 1 . 055 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -160.07 -64.99 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.168 179.596 . . . . . . . . 2 2 . 1 . 055 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.1 mtp180 169.54 150.89 0.14 Allowed Pre-proline 0 N--CA 1.468 0.453 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.857 179.043 . . . . . . . . 1 1 . 1 . 055 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.44 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.6 Cg_endo -83.82 56.32 5.13 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 121.924 1.749 . . . . 0.0 112.613 179.87 . . . . . . . . 2 2 . 1 . 055 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 t70 59.52 40.58 20.31 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.634 179.989 . . . . . . . . 1 1 . 1 . 055 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.1 mmtp . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.514 -179.929 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.0 p . . . . . 0 CA--C 1.518 -0.28 0 CA-C-O 121.396 0.617 . . . . 0.0 110.104 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.418 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -99.76 126.69 45.87 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.063 -179.226 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.401 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -117.7 -15.5 10.12 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.086 -0.961 . . . . 0.0 111.481 -179.627 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.418 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 8.8 mtp180 88.29 155.14 0.09 OUTLIER Pre-proline 0 N--CA 1.478 0.928 0 C-N-CA 123.332 0.653 . . . . 0.0 110.61 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo . . . . . 0 N--CA 1.477 0.537 0 C-N-CA 122.201 1.934 . . . . 0.0 113.43 179.428 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 CA--C 1.523 -0.092 0 CA-C-O 121.42 0.629 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.472 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -99.52 153.45 19.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.715 -179.495 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -133.32 -67.33 0.62 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.754 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 162.6 150.36 0.04 OUTLIER Pre-proline 0 N--CA 1.473 0.689 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.647 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.472 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 42.3 Cg_endo . . . . . 0 C--N 1.345 0.377 0 C-N-CA 122.034 1.823 . . . . 0.0 112.632 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.3 m . . . . . 0 CA--C 1.521 -0.157 0 CA-C-O 121.262 0.553 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.448 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.35 127.89 49.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.063 -179.565 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -108.68 -64.15 1.26 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.458 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 155.77 149.88 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.75 0 CA-C-N 114.821 -1.082 . . . . 0.0 109.474 179.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.448 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.4 Cg_endo . . . . . 0 C--N 1.344 0.308 0 C-N-CA 121.829 1.686 . . . . 0.0 112.378 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.462 0.172 0 CA-C-O 121.348 0.594 . . . . 0.0 110.386 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.462 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -93.78 125.78 38.59 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.895 -179.522 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -119.62 -14.42 9.08 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.641 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.462 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 17.9 mtt180 86.17 140.91 0.05 OUTLIER Pre-proline 0 N--CA 1.475 0.778 0 C-N-CA 123.335 0.654 . . . . 0.0 110.226 -179.284 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo . . . . . 0 C--N 1.348 0.519 0 C-N-CA 121.84 1.693 . . . . 0.0 113.538 179.952 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.517 -0.305 0 CA-C-O 121.309 0.576 . . . . 0.0 109.788 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.406 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.6 OUTLIER -99.25 144.27 28.56 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.633 -178.848 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.2 m170 -135.24 -46.43 0.7 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.762 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.1 mtt180 -178.64 160.67 1.1 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.121 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 39.9 Cg_endo . . . . . 0 C--N 1.345 0.352 0 C-N-CA 121.906 1.737 . . . . 0.0 112.672 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 CA--C 1.519 -0.24 0 CA-C-O 121.348 0.594 . . . . 0.0 110.782 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.474 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER 61.04 118.93 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.283 -0.872 . . . . 0.0 111.601 179.109 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.41 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 2.2 m170 -98.83 -61.44 1.37 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.107 178.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.41 ' CB ' ' O ' ' A' ' 6' ' ' HIS . 1.5 mtt180 148.71 145.8 0.0 OUTLIER Pre-proline 0 N--CA 1.48 1.052 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.486 179.074 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.474 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.8 Cg_endo . . . . . 0 C--N 1.344 0.333 0 C-N-CA 121.899 1.733 . . . . 0.0 112.445 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 CA--C 1.515 -0.367 0 CA-C-O 121.384 0.611 . . . . 0.0 110.062 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -93.63 157.32 16.23 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.852 -178.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -155.2 -48.17 0.08 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.362 -1.29 . . . . 0.0 109.122 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.19 162.26 3.5 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.09 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo . . . . . 0 N--CA 1.476 0.455 0 C-N-CA 121.863 1.709 . . . . 0.0 112.567 179.511 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 121.353 0.597 . . . . 0.0 109.435 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -99.29 158.42 15.71 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.817 -178.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -155.36 -47.32 0.08 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.277 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -161.58 156.81 20.46 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.309 -0.859 . . . . 0.0 109.917 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo . . . . . 0 N--CA 1.474 0.345 0 C-N-CA 121.972 1.781 . . . . 0.0 112.61 -179.994 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 CA--C 1.517 -0.31 0 CA-C-O 121.408 0.623 . . . . 0.0 110.074 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -93.03 167.29 11.89 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.479 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -170.56 -45.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.304 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.41 153.63 0.21 Allowed Pre-proline 0 N--CA 1.466 0.348 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.848 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo . . . . . 0 N--CA 1.476 0.461 0 C-N-CA 121.96 1.773 . . . . 0.0 112.983 179.705 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 CA--C 1.517 -0.308 0 CA-C-O 121.573 0.701 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.408 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 1.2 t90 -92.46 123.68 35.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.819 -1.082 . . . . 0.0 112.037 -178.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -115.54 -33.44 5.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.019 178.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.76 162.02 1.34 Allowed Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.238 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.408 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.5 Cg_endo . . . . . 0 N--CA 1.475 0.43 0 C-N-CA 121.941 1.761 . . . . 0.0 112.77 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 p . . . . . 0 CA--C 1.517 -0.306 0 CA-C-O 121.29 0.567 . . . . 0.0 109.898 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -96.61 147.84 23.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.667 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -140.41 -46.84 0.42 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.603 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -177.45 161.32 1.41 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.164 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo . . . . . 0 N--CA 1.476 0.45 0 C-N-CA 121.974 1.782 . . . . 0.0 113.249 -179.835 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 p . . . . . 0 CA--C 1.522 -0.112 0 CA-C-O 121.171 0.51 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.44 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -119.14 130.82 55.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.906 -179.624 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.04 -16.44 10.48 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.319 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.44 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 3.3 mtt180 82.02 147.39 0.1 Allowed Pre-proline 0 N--CA 1.473 0.709 0 C-N-CA 122.668 0.387 . . . . 0.0 110.308 -179.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo . . . . . 0 N--CA 1.474 0.348 0 C-N-CA 121.72 1.613 . . . . 0.0 112.397 178.892 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.519 -0.221 0 CA-C-O 121.285 0.564 . . . . 0.0 110.354 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -96.33 170.91 8.91 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.107 -179.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -170.1 -44.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.911 -1.04 . . . . 0.0 109.577 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.4 mtt85 179.77 158.09 0.77 Allowed Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.143 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo . . . . . 0 C--N 1.343 0.277 0 C-N-CA 121.955 1.77 . . . . 0.0 112.376 179.787 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.6 t . . . . . 0 CA--C 1.52 -0.2 0 CA-C-O 121.347 0.594 . . . . 0.0 110.469 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.429 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.3 OUTLIER -97.76 142.72 29.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.132 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -132.8 -48.93 0.88 Allowed 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.683 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 172.14 157.43 0.25 Allowed Pre-proline 0 CA--C 1.535 0.372 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.021 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.429 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.0 Cg_endo . . . . . 0 N--CA 1.473 0.293 0 C-N-CA 121.97 1.78 . . . . 0.0 112.365 179.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.9 p . . . . . 0 CA--C 1.521 -0.159 0 CA-C-O 121.292 0.568 . . . . 0.0 110.399 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.44 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -99.76 147.47 25.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.009 -179.364 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -135.66 -55.69 0.78 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.541 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 167.4 153.34 0.11 Allowed Pre-proline 0 N--CA 1.468 0.467 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.778 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.44 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.4 Cg_endo . . . . . 0 C--N 1.343 0.281 0 C-N-CA 121.883 1.722 . . . . 0.0 112.327 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.7 p . . . . . 0 CA--C 1.518 -0.281 0 CA-C-O 121.32 0.581 . . . . 0.0 110.099 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -91.77 147.67 22.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.239 -178.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.66 -48.98 0.43 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.605 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 178.87 157.27 0.63 Allowed Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.282 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo . . . . . 0 N--CA 1.474 0.372 0 C-N-CA 121.977 1.785 . . . . 0.0 112.544 179.866 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.1 p . . . . . 0 CA--C 1.517 -0.303 0 CA-C-O 121.422 0.63 . . . . 0.0 110.141 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.416 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -90.54 135.06 33.94 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.48 -178.942 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -127.36 -46.4 1.48 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.746 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.4 mtp85 176.74 158.85 0.46 Allowed Pre-proline 0 CA--C 1.534 0.337 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.919 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.416 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.2 Cg_endo . . . . . 0 N--CA 1.476 0.461 0 C-N-CA 121.841 1.694 . . . . 0.0 112.725 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.8 m . . . . . 0 CA--C 1.52 -0.175 0 CA-C-O 121.256 0.551 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.478 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.2 OUTLIER -89.24 123.25 33.29 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.732 -179.372 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.405 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -123.65 -15.42 7.03 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.08 -179.238 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.478 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 32.9 mtp180 91.89 146.89 0.05 OUTLIER Pre-proline 0 N--CA 1.48 1.046 0 C-N-CA 123.83 0.852 . . . . 0.0 110.334 -179.195 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo . . . . . 0 N--CA 1.477 0.513 0 C-N-CA 121.924 1.749 . . . . 0.0 113.011 179.334 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.1 m . . . . . 0 CA--C 1.518 -0.261 0 CA-C-O 121.63 0.729 . . . . 0.0 110.531 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -108.15 157.78 18.0 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.354 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -153.14 -49.96 0.1 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.03 179.393 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 168.74 153.14 0.13 Allowed Pre-proline 0 N--CA 1.467 0.377 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.954 179.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo . . . . . 0 C--N 1.344 0.323 0 C-N-CA 121.984 1.79 . . . . 0.0 112.693 179.975 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.7 p . . . . . 0 CA--C 1.522 -0.115 0 CA-C-O 121.264 0.554 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.487 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -73.47 128.05 34.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.617 -179.73 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.4 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -125.51 -14.67 6.3 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.179 -178.981 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.487 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 27.8 mtm180 87.26 143.28 0.05 OUTLIER Pre-proline 0 N--CA 1.476 0.829 0 C-N-CA 123.245 0.618 . . . . 0.0 110.495 -179.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo . . . . . 0 N--CA 1.477 0.558 0 C-N-CA 121.927 1.751 . . . . 0.0 112.886 179.302 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.0 p . . . . . 0 C--O 1.231 0.115 0 CA-C-O 121.262 0.553 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.403 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -105.54 127.76 53.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.452 -179.749 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -117.66 -15.82 10.13 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.617 -179.287 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.403 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 0.0 OUTLIER 84.39 145.62 0.08 OUTLIER Pre-proline 0 N--CA 1.476 0.841 0 C-N-CA 122.822 0.449 . . . . 0.0 110.127 -179.409 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo . . . . . 0 C--N 1.347 0.465 0 C-N-CA 121.825 1.683 . . . . 0.0 112.931 179.32 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.6 m . . . . . 0 CA--C 1.519 -0.224 0 CA-C-O 121.394 0.616 . . . . 0.0 110.507 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -96.84 168.39 10.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.337 -179.257 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -164.48 -63.24 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.977 -1.01 . . . . 0.0 109.203 179.788 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.43 151.85 0.2 Allowed Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.915 179.322 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo . . . . . 0 N--CA 1.475 0.384 0 C-N-CA 122.133 1.889 . . . . 0.0 113.051 179.985 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.522 -0.131 0 CA-C-O 121.289 0.566 . . . . 0.0 110.516 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.457 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -140.2 147.43 40.06 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.424 -179.544 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.406 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 2.2 m-70 -123.03 -66.94 0.98 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.048 178.94 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.412 ' HG3' ' CZ3' ' A' ' 5' ' ' TRP . 16.8 mtp180 149.24 143.21 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.938 0 CA-C-N 114.776 -1.102 . . . . 0.0 109.534 178.936 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.457 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 43.1 Cg_endo . . . . . 0 C--N 1.347 0.451 0 C-N-CA 121.964 1.776 . . . . 0.0 112.384 179.546 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 31.1 t . . . . . 0 CA--C 1.517 -0.307 0 CA-C-O 121.469 0.652 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.42 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.8 OUTLIER -90.88 134.67 34.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.271 -179.13 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.2 m170 -124.03 -45.94 1.98 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.019 179.507 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.5 mtp85 173.31 160.33 0.29 Allowed Pre-proline 0 N--CA 1.466 0.326 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.016 179.926 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.42 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.0 Cg_endo . . . . . 0 N--CA 1.473 0.307 0 C-N-CA 121.897 1.732 . . . . 0.0 112.596 179.643 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.1 m . . . . . 0 CA--C 1.512 -0.488 0 CA-C-O 121.404 0.621 . . . . 0.0 109.373 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -97.11 139.5 33.01 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.021 -178.57 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -130.76 -44.29 1.08 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.748 -1.115 . . . . 0.0 109.708 179.293 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.4 mtp85 -171.07 161.8 5.42 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.013 -179.981 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo . . . . . 0 N--CA 1.475 0.422 0 C-N-CA 121.898 1.732 . . . . 0.0 112.646 179.678 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.3 m . . . . . 0 CA--C 1.52 -0.192 0 CA-C-O 121.679 0.752 . . . . 0.0 109.884 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.434 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -39.24 137.55 0.73 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.434 -1.257 . . . . 0.0 113.512 -178.698 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -130.96 -48.75 1.02 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.38 -1.282 . . . . 0.0 108.864 178.582 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.7 mtp180 165.16 154.33 0.07 OUTLIER Pre-proline 0 N--CA 1.468 0.473 0 CA-C-N 115.186 -0.916 . . . . 0.0 109.846 179.019 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.434 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.1 Cg_endo . . . . . 0 N--CA 1.475 0.399 0 C-N-CA 121.944 1.763 . . . . 0.0 112.687 -179.977 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.8 t . . . . . 0 CA--C 1.514 -0.408 0 CA-C-O 121.597 0.713 . . . . 0.0 109.887 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -63.84 134.79 55.85 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.672 -1.149 . . . . 0.0 112.262 -178.614 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -122.6 -43.21 2.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.469 -1.241 . . . . 0.0 109.619 179.071 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.47 167.34 1.01 Allowed Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.678 179.865 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo . . . . . 0 N--CA 1.475 0.414 0 C-N-CA 122.07 1.847 . . . . 0.0 112.778 179.514 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.519 -0.242 0 CA-C-O 121.35 0.595 . . . . 0.0 110.063 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -95.48 149.42 21.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.401 -179.172 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -145.81 -48.6 0.22 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.381 179.472 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 179.38 157.39 0.7 Allowed Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.091 179.552 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo . . . . . 0 N--CA 1.473 0.29 0 C-N-CA 121.939 1.759 . . . . 0.0 112.635 179.839 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.52 -0.197 0 CA-C-O 121.211 0.529 . . . . 0.0 110.552 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.74 173.75 10.05 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.364 -179.727 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 -169.68 -56.75 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 114.575 -1.193 . . . . 0.0 108.823 179.62 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 169.43 151.37 0.14 Allowed Pre-proline 0 N--CA 1.467 0.402 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.755 178.812 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo . . . . . 0 C--N 1.344 0.311 0 C-N-CA 121.906 1.738 . . . . 0.0 112.536 179.998 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.8 m . . . . . 0 CA--C 1.519 -0.24 0 CA-C-O 121.618 0.723 . . . . 0.0 110.72 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.419 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -82.74 117.75 22.88 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.833 -178.923 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -111.99 -34.66 5.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.855 178.852 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 170.77 158.44 0.21 Allowed Pre-proline 0 CA--C 1.536 0.437 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.312 179.513 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.419 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 42.3 Cg_endo . . . . . 0 N--CA 1.476 0.483 0 C-N-CA 122.177 1.918 . . . . 0.0 113.249 -179.664 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.9 p . . . . . 0 CA--C 1.519 -0.244 0 CA-C-O 121.303 0.573 . . . . 0.0 110.006 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.428 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -101.36 139.78 36.56 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.223 -179.222 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -128.83 -48.93 1.24 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.638 179.456 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.7 mtp85 167.37 155.29 0.12 Allowed Pre-proline 0 N--CA 1.468 0.472 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.794 179.875 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.428 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.3 Cg_endo . . . . . 0 N--CA 1.474 0.354 0 C-N-CA 121.925 1.75 . . . . 0.0 112.524 -179.933 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.521 -0.172 0 CA-C-O 121.395 0.617 . . . . 0.0 110.291 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.432 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -106.32 153.75 21.75 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.213 -179.47 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -143.7 -55.13 0.38 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.181 179.523 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.8 mtt180 165.33 151.73 0.06 OUTLIER Pre-proline 0 N--CA 1.469 0.513 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.717 179.408 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.432 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.4 Cg_endo . . . . . 0 C--N 1.344 0.318 0 C-N-CA 121.856 1.704 . . . . 0.0 112.572 179.958 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.522 -0.13 0 CA-C-O 121.198 0.523 . . . . 0.0 110.396 . . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.434 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.52 152.66 20.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.179 -179.36 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -142.78 -52.51 0.38 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.524 179.636 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 169.97 154.74 0.18 Allowed Pre-proline 0 N--CA 1.468 0.445 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.866 179.679 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.434 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo . . . . . 0 N--CA 1.473 0.32 0 C-N-CA 121.83 1.686 . . . . 0.0 112.568 179.854 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 CA--C 1.519 -0.248 0 CA-C-O 121.494 0.664 . . . . 0.0 110.411 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -69.27 158.99 33.92 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.043 -179.396 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -152.47 -49.34 0.1 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.562 179.834 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 176.19 156.42 0.41 Allowed Pre-proline 0 CA--C 1.533 0.315 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.013 179.67 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo . . . . . 0 N--CA 1.473 0.275 0 C-N-CA 121.951 1.768 . . . . 0.0 112.598 179.958 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.6 m . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.313 0.577 . . . . 0.0 110.351 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -104.3 159.18 15.92 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.48 -179.3 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -152.28 -48.61 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.407 179.563 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 177.22 159.14 0.5 Allowed Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.084 179.724 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo . . . . . 0 N--CA 1.475 0.402 0 C-N-CA 121.902 1.735 . . . . 0.0 112.698 179.774 . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 7.7 t . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.343 0.592 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.484 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -81.67 119.21 23.53 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.728 -179.391 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.418 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 4.9 m-70 -117.01 -19.16 9.89 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.776 -179.381 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.484 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 32.0 mtt180 94.57 148.17 0.04 OUTLIER Pre-proline 0 N--CA 1.482 1.138 0 C-N-CA 123.952 0.901 . . . . 0.0 110.336 -179.423 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo . . . . . 0 N--CA 1.476 0.484 0 C-N-CA 121.881 1.72 . . . . 0.0 112.723 179.309 . . . . . . . . 0 0 . 1 . 037 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.151 0 CA-C-O 121.244 0.545 . . . . 0.0 110.579 . . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.439 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.3 153.56 19.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.041 -179.514 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -143.54 -54.46 0.38 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.69 179.505 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.41 ' HB2' ' NH1' ' A' ' 7' ' ' ARG . 0.9 OUTLIER 171.53 154.14 0.22 Allowed Pre-proline 0 N--CA 1.467 0.381 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.077 179.755 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.4 Cg_endo . . . . . 0 N--CA 1.474 0.343 0 C-N-CA 121.87 1.714 . . . . 0.0 112.654 179.996 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.1 m . . . . . 0 CA--C 1.519 -0.243 0 CA-C-O 121.359 0.6 . . . . 0.0 110.131 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -93.38 172.42 8.29 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.129 -179.247 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 4.1 t-160 -173.89 -42.64 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.729 179.745 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.3 mtt85 -179.93 155.75 0.73 Allowed Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.235 179.433 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo . . . . . 0 C--N 1.344 0.341 0 C-N-CA 121.951 1.767 . . . . 0.0 112.704 -179.852 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.521 -0.136 0 CA-C-O 121.132 0.492 . . . . 0.0 110.16 . . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -103.12 163.57 12.15 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.555 0.693 . . . . 0.0 111.362 -179.31 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -159.9 -48.51 0.05 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.255 179.688 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.16 157.7 0.37 Allowed Pre-proline 0 CA--C 1.532 0.278 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.959 179.54 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo . . . . . 0 N--CA 1.474 0.333 0 C-N-CA 121.864 1.709 . . . . 0.0 112.614 179.537 . . . . . . . . 0 0 . 1 . 040 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.7 m . . . . . 0 CA--C 1.517 -0.321 0 CA-C-O 121.544 0.688 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -61.65 153.43 28.03 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.937 -1.028 . . . . 0.0 111.382 -179.179 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -146.64 -49.41 0.2 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.636 -1.165 . . . . 0.0 109.426 179.643 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.4 mtt180 176.09 157.34 0.41 Allowed Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.119 179.683 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo . . . . . 0 N--CA 1.474 0.375 0 C-N-CA 121.872 1.715 . . . . 0.0 112.663 179.838 . . . . . . . . 0 0 . 1 . 041 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.5 p . . . . . 0 CA--C 1.52 -0.205 0 CA-C-O 121.582 0.706 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 041 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.461 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -98.86 132.7 44.0 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.018 -179.532 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.95 -62.11 1.59 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.211 179.226 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.8 mtp180 159.85 147.3 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.69 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.452 179.199 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.461 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.5 Cg_endo . . . . . 0 C--N 1.344 0.341 0 C-N-CA 121.905 1.737 . . . . 0.0 112.61 179.897 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 CA--C 1.518 -0.257 0 CA-C-O 121.532 0.682 . . . . 0.0 110.612 . . . . . . . . . 0 0 . 1 . 042 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.437 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER 61.29 118.88 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.65 179.279 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -110.77 -49.61 3.02 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.014 178.53 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 158.92 151.57 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.719 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.631 179.239 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.437 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo . . . . . 0 N--CA 1.474 0.377 0 C-N-CA 121.833 1.689 . . . . 0.0 112.624 179.872 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.7 m . . . . . 0 CA--C 1.518 -0.274 0 CA-C-O 121.469 0.652 . . . . 0.0 110.383 . . . . . . . . . 0 0 . 1 . 043 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.406 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -116.32 158.6 23.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.908 -178.971 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -152.04 -50.44 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.609 -1.178 . . . . 0.0 108.752 179.319 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.9 mtp180 168.68 153.97 0.14 Allowed Pre-proline 0 N--CA 1.466 0.338 0 CA-C-N 115.032 -0.985 . . . . 0.0 109.723 179.175 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.2 Cg_endo . . . . . 0 N--CA 1.473 0.303 0 C-N-CA 121.963 1.776 . . . . 0.0 112.598 -179.932 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 74.0 m . . . . . 0 CA--C 1.517 -0.304 0 CA-C-O 121.559 0.695 . . . . 0.0 110.342 . . . . . . . . . 0 0 . 1 . 044 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -67.64 166.9 14.11 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.44 -179.336 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -166.37 -45.9 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.352 179.793 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.401 ' NH1' ' HB2' ' A' ' 7' ' ' ARG . 0.7 OUTLIER 176.33 153.38 0.37 Allowed Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.871 179.507 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo . . . . . 0 N--CA 1.476 0.455 0 C-N-CA 122.046 1.831 . . . . 0.0 113.187 -179.75 . . . . . . . . 0 0 . 1 . 045 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.517 -0.31 0 CA-C-O 121.5 0.667 . . . . 0.0 110.512 . . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.427 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -111.6 142.82 43.42 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.914 -179.245 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -134.84 -51.37 0.78 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.567 -1.197 . . . . 0.0 108.782 178.939 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.1 mtt180 168.21 157.45 0.15 Allowed Pre-proline 0 N--CA 1.465 0.305 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.466 179.456 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.427 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 39.8 Cg_endo . . . . . 0 N--CA 1.475 0.403 0 C-N-CA 121.67 1.58 . . . . 0.0 112.581 179.335 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.5 p . . . . . 0 CA--C 1.521 -0.17 0 CA-C-O 121.431 0.634 . . . . 0.0 110.488 . . . . . . . . . 0 0 . 1 . 046 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.441 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -70.49 128.85 37.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.554 -179.724 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.99 -15.76 9.92 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.683 -179.159 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.441 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER 83.94 148.3 0.1 OUTLIER Pre-proline 0 N--CA 1.476 0.858 0 C-N-CA 122.713 0.405 . . . . 0.0 110.117 -179.154 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo . . . . . 0 C--N 1.342 0.235 0 C-N-CA 121.754 1.636 . . . . 0.0 112.673 179.125 . . . . . . . . 0 0 . 1 . 047 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.522 -0.134 0 CA-C-O 121.228 0.537 . . . . 0.0 109.965 . . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.409 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.56 151.26 22.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.323 -179.177 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -143.01 -50.05 0.34 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.468 179.464 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 173.51 155.82 0.28 Allowed Pre-proline 0 N--CA 1.466 0.341 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.027 179.742 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.409 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.6 Cg_endo . . . . . 0 N--CA 1.474 0.344 0 C-N-CA 121.904 1.736 . . . . 0.0 112.523 179.944 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.522 -0.117 0 CA-C-O 121.186 0.517 . . . . 0.0 110.337 . . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.406 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -109.73 155.62 21.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.479 -179.398 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.28 -49.44 0.14 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.199 179.356 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 175.91 156.63 0.4 Allowed Pre-proline 0 CA--C 1.534 0.345 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.824 179.394 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo . . . . . 0 N--CA 1.474 0.325 0 C-N-CA 121.961 1.774 . . . . 0.0 112.548 -179.974 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.1 m . . . . . 0 C--O 1.232 0.139 0 CA-C-O 121.058 0.456 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 049 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.415 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -162.41 162.12 27.57 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.686 0.755 . . . . 0.0 111.788 -179.87 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -154.03 -51.0 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.884 179.377 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 165.52 154.15 0.08 OUTLIER Pre-proline 0 N--CA 1.468 0.468 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.978 179.24 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.415 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.3 Cg_endo . . . . . 0 C--N 1.343 0.245 0 C-N-CA 121.936 1.757 . . . . 0.0 112.371 179.624 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.0 m . . . . . 0 CA--C 1.516 -0.328 0 CA-C-O 121.636 0.731 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 050 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.439 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER 61.42 117.81 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.74 179.091 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -112.57 -45.23 3.25 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.761 -1.108 . . . . 0.0 108.96 178.34 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.2 mtt180 162.43 153.65 0.04 OUTLIER Pre-proline 0 N--CA 1.47 0.556 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.89 179.268 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.0 Cg_endo . . . . . 0 N--CA 1.473 0.323 0 C-N-CA 121.912 1.741 . . . . 0.0 112.613 -179.953 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 CA--C 1.52 -0.199 0 CA-C-O 121.257 0.551 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 051 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.423 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -97.43 153.81 17.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.031 -179.457 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -143.75 -59.74 0.4 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.427 179.622 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 172.79 153.49 0.24 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.922 179.588 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.423 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.4 Cg_endo . . . . . 0 N--CA 1.473 0.318 0 C-N-CA 121.855 1.704 . . . . 0.0 112.507 179.871 . . . . . . . . 1 1 . 1 . 052 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 70.7 m . . . . . 0 C--O 1.234 0.267 0 CA-C-O 121.398 0.618 . . . . 0.0 110.497 . . . . . . . . . 0 0 . 1 . 052 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.433 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER 62.94 -173.77 0.15 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.69 0.757 . . . . 0.0 110.36 179.551 . . . . . . . . 3 3 . 1 . 052 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 174.24 -45.11 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.616 -1.174 . . . . 0.0 108.623 -179.762 . . . . . . . . 2 2 . 1 . 052 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 164.29 154.4 0.06 OUTLIER Pre-proline 0 N--CA 1.468 0.429 0 CA-C-N 114.86 -1.064 . . . . 0.0 109.703 179.179 . . . . . . . . 2 2 . 1 . 052 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.433 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.3 Cg_endo . . . . . 0 N--CA 1.473 0.312 0 C-N-CA 121.864 1.709 . . . . 0.0 112.513 179.882 . . . . . . . . 1 1 . 1 . 053 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.519 -0.242 0 CA-C-O 121.367 0.603 . . . . 0.0 110.614 . . . . . . . . . 1 1 . 1 . 053 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.439 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -177.59 145.21 0.41 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.816 179.799 . . . . . . . . 3 3 . 1 . 053 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -134.96 -51.12 0.77 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.547 -1.206 . . . . 0.0 108.898 178.819 . . . . . . . . 2 2 . 1 . 053 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 160.18 152.91 0.03 OUTLIER Pre-proline 0 N--CA 1.471 0.606 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.606 179.364 . . . . . . . . 1 1 . 1 . 053 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo . . . . . 0 N--CA 1.473 0.319 0 C-N-CA 121.911 1.741 . . . . 0.0 112.537 179.784 . . . . . . . . 1 1 . 1 . 054 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.8 m . . . . . 0 CA--C 1.519 -0.245 0 CA-C-O 121.305 0.574 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 054 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -107.71 172.71 6.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.66 -179.061 . . . . . . . . 2 2 . 1 . 054 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -176.63 -43.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.606 -1.179 . . . . 0.0 109.081 179.902 . . . . . . . . 2 2 . 1 . 054 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 173.84 154.26 0.28 Allowed Pre-proline 0 CA--C 1.534 0.338 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.805 179.284 . . . . . . . . 2 2 . 1 . 054 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo . . . . . 0 C--N 1.343 0.263 0 C-N-CA 121.853 1.702 . . . . 0.0 112.794 -179.763 . . . . . . . . 0 0 . 1 . 055 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 m . . . . . 0 CA--C 1.52 -0.186 0 CA-C-O 121.302 0.572 . . . . 0.0 110.617 . . . . . . . . . 0 0 . 1 . 055 nuclear nobuild core ' A' A ' 5' ' ' TRP . . . . . 0.44 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -119.27 171.25 8.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.426 -179.601 . . . . . . . . 3 3 . 1 . 055 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -160.07 -64.99 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.168 179.596 . . . . . . . . 2 2 . 1 . 055 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.1 mtp180 169.54 150.89 0.14 Allowed Pre-proline 0 N--CA 1.468 0.453 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.857 179.043 . . . . . . . . 1 1 . 1 . 055 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.44 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.6 Cg_endo . . . . . 0 C--N 1.345 0.344 0 C-N-CA 121.924 1.749 . . . . 0.0 112.613 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.453 HD12 ' N ' ' A' ' 1' ' ' LEU . 5.0 mp . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -148.08 -115.65 0.84 Allowed Glycine 0 CA--C 1.526 0.725 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -127.78 -166.73 1.65 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.923 0.392 . . . . 0.0 110.297 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.0 p -63.39 131.93 49.81 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.396 0.617 . . . . 0.0 110.104 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.418 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -99.76 126.69 45.87 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.063 -179.226 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.401 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -117.7 -15.5 10.12 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.086 -0.961 . . . . 0.0 111.481 -179.627 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.418 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 8.8 mtp180 88.29 155.14 0.09 OUTLIER Pre-proline 0 N--CA 1.478 0.928 0 C-N-CA 123.332 0.653 . . . . 0.0 110.61 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -83.01 45.83 1.99 Allowed 'Trans proline' 0 N--CA 1.477 0.537 0 C-N-CA 122.201 1.934 . . . . 0.0 113.43 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 53.12 75.8 0.23 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.259 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.219 -0.524 0 CA-C-O 118.022 -0.99 . . . . 0.0 110.371 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 114.55 70.77 0.51 Allowed Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.2 173.87 15.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.983 0.42 . . . . 0.0 110.247 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.2 m -150.27 155.98 40.71 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.42 0.629 . . . . 0.0 110.985 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.472 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -99.52 153.45 19.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.715 -179.495 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -133.32 -67.33 0.62 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.754 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 162.6 150.36 0.04 OUTLIER Pre-proline 0 N--CA 1.473 0.689 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.647 179.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.472 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 42.3 Cg_endo -86.12 52.6 2.96 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.034 1.823 . . . . 0.0 112.632 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.8 t70 60.12 39.02 20.05 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.447 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt . . . . . 0 C--O 1.22 -0.487 0 CA-C-O 118.064 -0.969 . . . . 0.0 110.364 -179.999 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.1 mp . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 109.335 -0.616 . . . . 0.0 109.335 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 86.6 -125.35 7.37 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.71 -173.61 0.13 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.044 0.45 . . . . 0.0 110.553 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.3 m -111.38 152.48 27.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.534 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.448 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.35 127.89 49.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.063 -179.565 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -108.68 -64.15 1.26 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.458 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 155.77 149.88 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.75 0 CA-C-N 114.821 -1.082 . . . . 0.0 109.474 179.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.448 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.4 Cg_endo -84.19 55.71 4.72 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 121.829 1.686 . . . . 0.0 112.378 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -151.34 49.2 0.83 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.468 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 118.007 -0.996 . . . . 0.0 110.622 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.1 tp . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -108.58 68.39 0.22 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.719 -0.952 . . . . 0.0 110.719 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -133.65 -172.6 3.01 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.11 0.481 . . . . 0.0 110.486 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 63.23 120.89 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.386 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.462 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -93.78 125.78 38.59 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.895 -179.522 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -119.62 -14.42 9.08 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.641 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.462 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 17.9 mtt180 86.17 140.91 0.05 OUTLIER Pre-proline 0 N--CA 1.475 0.778 0 C-N-CA 123.335 0.654 . . . . 0.0 110.226 -179.284 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -84.19 46.8 2.06 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 121.84 1.693 . . . . 0.0 113.538 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -128.38 118.15 22.66 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.233 0.54 . . . . 0.0 110.482 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.5 tttt . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.334 -179.907 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.457 HD13 ' HA ' ' A' ' 1' ' ' LEU . 3.7 mm? . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -79.64 162.15 46.96 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.513 -1.035 . . . . 0.0 110.513 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.71 -165.48 0.21 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 120.83 0.348 . . . . 0.0 110.295 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.43 158.33 15.65 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.309 0.576 . . . . 0.0 109.788 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.406 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.6 OUTLIER -99.25 144.27 28.56 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.633 -178.848 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.2 m170 -135.24 -46.43 0.7 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.762 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.1 mtt180 -178.64 160.67 1.1 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.121 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 39.9 Cg_endo -81.29 56.73 6.14 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 121.906 1.737 . . . . 0.0 112.672 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.9 t0 61.46 156.09 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.527 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.3 tttt . . . . . 0 C--O 1.22 -0.458 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.439 179.998 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 14.2 mt . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 97.39 169.84 33.11 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 110.874 -0.89 . . . . 0.0 110.874 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -94.09 67.54 3.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.519 0.676 . . . . 0.0 110.368 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.2 m 60.48 33.81 20.53 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.782 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.474 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER 61.04 118.93 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.283 -0.872 . . . . 0.0 111.601 179.109 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.41 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 2.2 m170 -98.83 -61.44 1.37 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.107 178.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.41 ' CB ' ' O ' ' A' ' 6' ' ' HIS . 1.5 mtt180 148.71 145.8 0.0 OUTLIER Pre-proline 0 N--CA 1.48 1.052 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.486 179.074 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.474 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.8 Cg_endo -85.55 55.58 3.97 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 121.899 1.733 . . . . 0.0 112.445 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -156.74 -179.49 8.25 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.465 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 43.9 mttm . . . . . 0 C--O 1.22 -0.448 0 CA-C-O 117.963 -1.017 . . . . 0.0 110.438 179.96 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -137.99 30.61 2.54 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 111.091 -0.803 . . . . 0.0 111.091 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -169.27 131.07 1.17 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.224 0.535 . . . . 0.0 110.658 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.4 m -172.18 136.22 0.83 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.062 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -93.63 157.32 16.23 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.852 -178.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -155.2 -48.17 0.08 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.362 -1.29 . . . . 0.0 109.122 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.19 162.26 3.5 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.09 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -81.1 55.28 5.6 Favored 'Trans proline' 0 N--CA 1.476 0.455 0 C-N-CA 121.863 1.709 . . . . 0.0 112.567 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -175.23 97.92 0.08 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.976 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.8 mtmt . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.417 -179.738 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 161.15 -169.65 36.78 Favored Glycine 0 CA--C 1.525 0.672 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.1 -165.71 0.22 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.97 0.414 . . . . 0.0 110.271 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.53 165.58 14.2 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.353 0.597 . . . . 0.0 109.435 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -99.29 158.42 15.71 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.817 -178.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -155.36 -47.32 0.08 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.277 179.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.1 mtt85 -161.58 156.81 20.46 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.309 -0.859 . . . . 0.0 109.917 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -83.58 55.45 4.92 Favored 'Trans proline' 0 N--CA 1.474 0.345 0 C-N-CA 121.972 1.781 . . . . 0.0 112.61 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -96.09 87.45 4.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.393 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.2 mtpt . . . . . 0 C--O 1.221 -0.436 0 CA-C-O 117.929 -1.034 . . . . 0.0 110.346 179.952 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.431 ' HA ' HD22 ' A' ' 1' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -163.63 -109.22 0.23 Allowed Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -175.86 -178.21 1.03 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.026 0.441 . . . . 0.0 110.543 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.3 m -116.94 164.13 15.16 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.074 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -93.03 167.29 11.89 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.479 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -170.56 -45.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.304 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.41 153.63 0.21 Allowed Pre-proline 0 N--CA 1.466 0.348 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.848 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -86.07 47.44 1.83 Allowed 'Trans proline' 0 N--CA 1.476 0.461 0 C-N-CA 121.96 1.773 . . . . 0.0 112.983 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.8 t70 60.1 81.48 0.18 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.595 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.6 tttt . . . . . 0 C--O 1.219 -0.511 0 CA-C-O 118.064 -0.97 . . . . 0.0 110.597 179.996 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.4 mp . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -93.93 117.02 5.38 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.16 177.44 7.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.072 0.463 . . . . 0.0 110.406 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.4 t -178.52 158.32 1.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.573 0.701 . . . . 0.0 110.772 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.408 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 1.2 t90 -92.46 123.68 35.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.819 -1.082 . . . . 0.0 112.037 -178.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -115.54 -33.44 5.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.019 178.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -177.76 162.02 1.34 Allowed Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.238 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.408 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.5 Cg_endo -81.89 55.35 5.43 Favored 'Trans proline' 0 N--CA 1.475 0.43 0 C-N-CA 121.941 1.761 . . . . 0.0 112.77 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -107.28 64.34 0.63 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.377 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.2 tptp . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 118.055 -0.974 . . . . 0.0 110.545 179.955 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.474 HD23 ' N ' ' A' ' 2' ' ' GLY . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.474 ' N ' HD23 ' A' ' 1' ' ' LEU . . . 165.23 86.22 0.06 OUTLIER Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.715 -0.954 . . . . 0.0 110.715 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -88.12 111.9 22.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.199 0.523 . . . . 0.0 110.689 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 p -105.22 145.82 30.12 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.898 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -96.61 147.84 23.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.667 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -140.41 -46.84 0.42 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.603 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -177.45 161.32 1.41 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.164 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -81.17 54.44 5.21 Favored 'Trans proline' 0 N--CA 1.476 0.45 0 C-N-CA 121.974 1.782 . . . . 0.0 113.249 -179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 57.24 -176.5 0.06 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.813 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.316 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.2 mp . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 169.74 -165.56 38.92 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.751 -0.939 . . . . 0.0 110.751 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -90.19 179.35 5.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.029 0.442 . . . . 0.0 110.447 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 p -99.52 132.94 44.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.275 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.44 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -119.14 130.82 55.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.906 -179.624 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.04 -16.44 10.48 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.319 -179.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.44 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 3.3 mtt180 82.02 147.39 0.1 Allowed Pre-proline 0 N--CA 1.473 0.709 0 C-N-CA 122.668 0.387 . . . . 0.0 110.308 -179.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -83.43 52.13 3.78 Favored 'Trans proline' 0 N--CA 1.474 0.348 0 C-N-CA 121.72 1.613 . . . . 0.0 112.397 178.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 41.94 95.65 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 115.406 -0.815 . . . . 0.0 112.014 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.6 ttpt . . . . . 0 C--O 1.22 -0.458 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.578 -179.99 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 4.4 tp . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 148.6 -83.52 0.18 Allowed Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.731 -0.948 . . . . 0.0 110.731 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.82 162.29 0.06 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.101 0.477 . . . . 0.0 110.6 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -124.87 155.82 38.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.354 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -96.33 170.91 8.91 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.107 -179.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -170.1 -44.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.911 -1.04 . . . . 0.0 109.577 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.4 mtt85 179.77 158.09 0.77 Allowed Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.143 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -82.28 57.8 6.33 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 121.955 1.77 . . . . 0.0 112.376 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.5 t70 64.31 68.45 0.55 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.328 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.5 pttt . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.572 -179.973 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.432 HD22 ' HA ' ' A' ' 1' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -130.25 58.59 0.7 Allowed Glycine 0 CA--C 1.525 0.66 0 N-CA-C 110.822 -0.911 . . . . 0.0 110.822 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -90.45 162.1 15.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.008 0.432 . . . . 0.0 110.481 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.6 t -118.25 156.01 29.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.469 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.429 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.3 OUTLIER -97.76 142.72 29.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.132 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -132.8 -48.93 0.88 Allowed 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.683 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.2 mtt180 172.14 157.43 0.25 Allowed Pre-proline 0 CA--C 1.535 0.372 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.021 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.429 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.0 Cg_endo -83.21 56.98 5.7 Favored 'Trans proline' 0 N--CA 1.473 0.293 0 C-N-CA 121.97 1.78 . . . . 0.0 112.365 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -68.68 116.89 9.71 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.496 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.7 mttm . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.398 179.966 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.0 tt . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -62.02 -74.74 0.37 Allowed Glycine 0 CA--C 1.525 0.669 0 N-CA-C 110.819 -0.912 . . . . 0.0 110.819 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.64 -177.75 0.11 Allowed 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.014 0.435 . . . . 0.0 110.4 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.9 p -130.42 156.27 45.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.399 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.44 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -99.76 147.47 25.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.009 -179.364 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -135.66 -55.69 0.78 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.541 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 167.4 153.34 0.11 Allowed Pre-proline 0 N--CA 1.468 0.467 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.778 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.44 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.4 Cg_endo -84.15 56.74 5.1 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 121.883 1.722 . . . . 0.0 112.327 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -169.42 84.74 0.14 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.31 -179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.404 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 7.3 mt . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 95.2 -119.01 6.03 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -72.47 -171.85 0.86 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.069 0.461 . . . . 0.0 110.469 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.7 p -123.25 166.68 14.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.099 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -91.77 147.67 22.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.239 -178.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.66 -48.98 0.43 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.605 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 178.87 157.27 0.63 Allowed Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.282 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -82.9 56.6 5.69 Favored 'Trans proline' 0 N--CA 1.474 0.372 0 C-N-CA 121.977 1.785 . . . . 0.0 112.544 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -132.59 118.03 18.68 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.47 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.1 ttpp . . . . . 0 C--O 1.22 -0.477 0 CA-C-O 118.103 -0.951 . . . . 0.0 110.428 -179.977 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.4 tp . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 105.79 -159.91 15.08 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.799 -0.92 . . . . 0.0 110.799 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.69 167.79 20.69 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.207 0.527 . . . . 0.0 110.643 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.1 p -150.52 158.22 43.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.141 179.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.416 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -90.54 135.06 33.94 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.48 -178.942 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -127.36 -46.4 1.48 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.746 179.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.4 mtp85 176.74 158.85 0.46 Allowed Pre-proline 0 CA--C 1.534 0.337 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.919 179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.416 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.2 Cg_endo -82.04 56.03 5.67 Favored 'Trans proline' 0 N--CA 1.476 0.461 0 C-N-CA 121.841 1.694 . . . . 0.0 112.725 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -90.91 89.1 7.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.511 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? . . . . . 0 C--O 1.22 -0.462 0 CA-C-O 117.997 -1.002 . . . . 0.0 110.431 -179.881 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 7.0 mt . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -78.1 -134.71 0.83 Allowed Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.712 -0.955 . . . . 0.0 110.712 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.86 174.0 3.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.229 0.538 . . . . 0.0 110.561 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.8 m -163.04 156.29 19.49 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.317 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.478 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.2 OUTLIER -89.24 123.25 33.29 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.732 -179.372 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.405 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -123.65 -15.42 7.03 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.08 -179.238 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.478 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 32.9 mtp180 91.89 146.89 0.05 OUTLIER Pre-proline 0 N--CA 1.48 1.046 0 C-N-CA 123.83 0.852 . . . . 0.0 110.334 -179.195 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -84.64 47.59 2.19 Favored 'Trans proline' 0 N--CA 1.477 0.513 0 C-N-CA 121.924 1.749 . . . . 0.0 113.011 179.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -77.8 113.99 16.22 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.351 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.4 tttm . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.401 -179.931 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.0 mp . . . . . 0 N--CA 1.492 1.673 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.47 144.7 48.84 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.507 -1.037 . . . . 0.0 110.507 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.5 -174.52 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.176 0.512 . . . . 0.0 110.614 -179.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.1 m 63.12 126.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.531 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -108.15 157.78 18.0 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.354 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -153.14 -49.96 0.1 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.03 179.393 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 168.74 153.14 0.13 Allowed Pre-proline 0 N--CA 1.467 0.377 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.954 179.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -83.46 55.89 5.15 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 121.984 1.79 . . . . 0.0 112.693 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -65.47 118.09 8.93 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.306 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.7 mttp . . . . . 0 C--O 1.22 -0.482 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.43 179.988 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.597 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -86.45 -157.12 29.54 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.801 -0.919 . . . . 0.0 110.801 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.15 166.62 5.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.119 0.485 . . . . 0.0 110.421 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.7 p -174.23 141.32 0.73 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.492 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.487 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -73.47 128.05 34.41 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.617 -179.73 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.4 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -125.51 -14.67 6.3 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.179 -178.981 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.487 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 27.8 mtm180 87.26 143.28 0.05 OUTLIER Pre-proline 0 N--CA 1.476 0.829 0 C-N-CA 123.245 0.618 . . . . 0.0 110.495 -179.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -82.15 51.21 3.71 Favored 'Trans proline' 0 N--CA 1.477 0.558 0 C-N-CA 121.927 1.751 . . . . 0.0 112.886 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.1 t70 57.71 103.86 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.737 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.9 tttm . . . . . 0 C--O 1.221 -0.429 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.508 179.999 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.62 ' O ' HD12 ' A' ' 1' ' ' LEU . 3.6 pp . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.027 0.441 . . . . 0.0 109.866 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 85.53 -99.73 2.39 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 110.823 -0.911 . . . . 0.0 110.823 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.84 -173.63 0.13 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.095 0.474 . . . . 0.0 110.568 179.945 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.0 p -100.31 143.21 30.76 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.363 -179.994 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.403 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -105.54 127.76 53.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.452 -179.749 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -117.66 -15.82 10.13 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.617 -179.287 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.403 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 0.0 OUTLIER 84.39 145.62 0.08 OUTLIER Pre-proline 0 N--CA 1.476 0.841 0 C-N-CA 122.822 0.449 . . . . 0.0 110.127 -179.409 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -85.0 48.43 2.33 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 121.825 1.683 . . . . 0.0 112.931 179.32 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 24.5 t70 61.1 156.65 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.503 179.979 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 117.953 -1.022 . . . . 0.0 110.431 -179.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.1 mt . . . . . 0 N--CA 1.489 1.482 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -166.89 134.3 3.22 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 110.837 -0.905 . . . . 0.0 110.837 -179.994 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.41 -177.8 0.1 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.072 0.463 . . . . 0.0 110.551 179.906 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.6 m -156.6 159.82 38.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.507 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -96.84 168.39 10.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.337 -179.257 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -164.48 -63.24 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.977 -1.01 . . . . 0.0 109.203 179.788 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.43 151.85 0.2 Allowed Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.915 179.322 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -87.02 46.52 1.45 Allowed 'Trans proline' 0 N--CA 1.475 0.384 0 C-N-CA 122.133 1.889 . . . . 0.0 113.051 179.985 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.3 t70 57.32 88.98 0.05 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.776 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? . . . . . 0 C--O 1.221 -0.406 0 CA-C-O 117.908 -1.044 . . . . 0.0 110.415 -179.894 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.458 ' HA ' HD13 ' A' ' 1' ' ' LEU . 2.7 mm? . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -143.0 104.55 0.36 Allowed Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 179.997 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.24 160.5 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.058 0.456 . . . . 0.0 110.58 179.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -115.39 123.8 49.59 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.516 -179.978 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.457 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -140.2 147.43 40.06 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.424 -179.544 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.406 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 2.2 m-70 -123.03 -66.94 0.98 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.048 178.94 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.412 ' HG3' ' CZ3' ' A' ' 5' ' ' TRP . 16.8 mtp180 149.24 143.21 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.938 0 CA-C-N 114.776 -1.102 . . . . 0.0 109.534 178.936 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.457 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 43.1 Cg_endo -87.61 52.22 2.26 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 121.964 1.776 . . . . 0.0 112.384 179.546 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -89.85 164.23 14.7 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.688 -179.686 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.7 mtpp . . . . . 0 C--O 1.22 -0.484 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.424 179.979 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.453 HD22 ' HB2' ' A' ' 3' ' ' ALA . 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 66.4 51.51 42.42 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.702 -0.959 . . . . 0.0 110.702 -179.894 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.453 ' HB2' HD22 ' A' ' 1' ' ' LEU . . . -82.95 -178.24 7.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.166 0.508 . . . . 0.0 110.446 -179.918 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 31.1 t -143.56 163.21 33.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.397 -179.994 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.42 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.8 OUTLIER -90.88 134.67 34.28 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.271 -179.13 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.2 m170 -124.03 -45.94 1.98 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.019 179.507 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.5 mtp85 173.31 160.33 0.29 Allowed Pre-proline 0 N--CA 1.466 0.326 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.016 179.926 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.42 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.0 Cg_endo -82.34 55.74 5.48 Favored 'Trans proline' 0 N--CA 1.473 0.307 0 C-N-CA 121.897 1.732 . . . . 0.0 112.596 179.643 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -125.4 146.33 49.65 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.398 179.846 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.3 ttmt . . . . . 0 C--O 1.22 -0.485 0 CA-C-O 118.058 -0.972 . . . . 0.0 110.544 -179.98 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 159.29 -112.39 0.52 Allowed Glycine 0 CA--C 1.524 0.652 0 N-CA-C 110.804 -0.918 . . . . 0.0 110.804 179.942 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -178.11 -164.72 0.09 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.945 0.402 . . . . 0.0 110.167 -179.803 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.1 m -76.94 156.11 32.24 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 121.404 0.621 . . . . 0.0 109.373 179.321 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -97.11 139.5 33.01 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.021 -178.57 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -130.76 -44.29 1.08 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.748 -1.115 . . . . 0.0 109.708 179.293 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.4 mtp85 -171.07 161.8 5.42 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.013 -179.981 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -81.42 56.19 5.89 Favored 'Trans proline' 0 N--CA 1.475 0.422 0 C-N-CA 121.898 1.732 . . . . 0.0 112.646 179.678 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -78.23 152.01 32.82 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.331 179.965 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.0 mttp . . . . . 0 C--O 1.219 -0.504 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.437 179.939 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -88.94 -163.07 39.1 Favored Glycine 0 CA--C 1.523 0.581 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 -179.797 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -148.84 47.89 1.01 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.481 0.657 . . . . 0.0 109.937 -179.716 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.3 m 61.07 96.46 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.884 -179.175 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.434 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -39.24 137.55 0.73 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.434 -1.257 . . . . 0.0 113.512 -178.698 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -130.96 -48.75 1.02 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.38 -1.282 . . . . 0.0 108.864 178.582 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.7 mtp180 165.16 154.33 0.07 OUTLIER Pre-proline 0 N--CA 1.468 0.473 0 CA-C-N 115.186 -0.916 . . . . 0.0 109.846 179.019 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.434 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.1 Cg_endo -82.87 55.59 5.29 Favored 'Trans proline' 0 N--CA 1.475 0.399 0 C-N-CA 121.944 1.763 . . . . 0.0 112.687 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -154.69 80.4 1.09 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.154 179.864 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 50.8 mttt . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.598 -179.887 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 8.0 tt . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 178.06 -95.05 0.1 OUTLIER Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.813 -0.915 . . . . 0.0 110.813 -179.944 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -104.16 40.06 1.53 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.284 0.564 . . . . 0.0 110.458 179.985 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.8 t -105.81 129.53 53.98 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.597 0.713 . . . . 0.0 109.887 179.593 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -63.84 134.79 55.85 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.672 -1.149 . . . . 0.0 112.262 -178.614 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -122.6 -43.21 2.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.469 -1.241 . . . . 0.0 109.619 179.071 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.47 167.34 1.01 Allowed Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.678 179.865 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -81.0 54.94 5.48 Favored 'Trans proline' 0 N--CA 1.475 0.414 0 C-N-CA 122.07 1.847 . . . . 0.0 112.778 179.514 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.1 p30 44.57 -170.85 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 115.192 -0.913 . . . . 0.0 112.026 179.751 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.0 ttmt . . . . . 0 C--O 1.221 -0.405 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.323 -179.717 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.1 tp . . . . . 0 N--CA 1.491 1.579 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 117.72 -161.68 13.25 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.576 -1.01 . . . . 0.0 110.576 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.34 152.85 42.11 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.256 0.55 . . . . 0.0 110.7 179.922 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 179.65 145.12 0.18 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.063 179.633 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -95.48 149.42 21.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.401 -179.172 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -145.81 -48.6 0.22 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.381 179.472 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 179.38 157.39 0.7 Allowed Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.091 179.552 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -82.54 56.8 5.85 Favored 'Trans proline' 0 N--CA 1.473 0.29 0 C-N-CA 121.939 1.759 . . . . 0.0 112.635 179.839 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -119.52 83.18 2.0 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.447 179.952 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.1 ttpt . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.408 -179.913 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.8 mp . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -99.56 -35.24 4.72 Favored Glycine 0 CA--C 1.523 0.573 0 N-CA-C 110.724 -0.95 . . . . 0.0 110.724 179.883 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -178.4 91.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.007 0.432 . . . . 0.0 110.31 179.992 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -116.92 130.7 56.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.552 -179.966 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.74 173.75 10.05 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.364 -179.727 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 -169.68 -56.75 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 114.575 -1.193 . . . . 0.0 108.823 179.62 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 169.43 151.37 0.14 Allowed Pre-proline 0 N--CA 1.467 0.402 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.755 178.812 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -83.97 56.93 5.26 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 121.906 1.738 . . . . 0.0 112.536 179.998 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -115.79 146.87 41.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.44 179.993 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.4 tptt . . . . . 0 C--O 1.219 -0.523 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.604 179.966 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.649 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 60.42 -96.78 0.1 OUTLIER Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.418 -1.073 . . . . 0.0 110.418 -179.785 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -132.49 122.19 24.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.972 0.415 . . . . 0.0 110.207 179.441 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.8 m -127.37 145.71 50.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.618 0.723 . . . . 0.0 110.72 -179.912 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.419 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -82.74 117.75 22.88 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.833 -178.923 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -111.99 -34.66 5.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.855 178.852 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 170.77 158.44 0.21 Allowed Pre-proline 0 CA--C 1.536 0.437 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.312 179.513 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.419 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 42.3 Cg_endo -82.62 55.11 5.16 Favored 'Trans proline' 0 N--CA 1.476 0.483 0 C-N-CA 122.177 1.918 . . . . 0.0 113.249 -179.664 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.2 t70 54.64 86.19 0.05 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.199 179.671 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.9 ttmt . . . . . 0 C--O 1.22 -0.448 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.551 179.854 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.4 tt . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -84.22 83.29 1.63 Allowed Glycine 0 CA--C 1.523 0.587 0 N-CA-C 110.564 -1.014 . . . . 0.0 110.564 179.844 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -172.64 -166.66 0.39 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.956 0.408 . . . . 0.0 110.3 -179.872 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.9 p -96.36 155.52 16.73 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 121.303 0.573 . . . . 0.0 110.006 179.791 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.428 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -101.36 139.78 36.56 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.223 -179.222 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -128.83 -48.93 1.24 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.638 179.456 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.7 mtp85 167.37 155.29 0.12 Allowed Pre-proline 0 N--CA 1.468 0.472 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.794 179.875 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.428 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.3 Cg_endo -84.02 55.87 4.86 Favored 'Trans proline' 0 N--CA 1.474 0.354 0 C-N-CA 121.925 1.75 . . . . 0.0 112.524 -179.933 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -107.49 139.4 42.06 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.559 -179.89 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.8 ttmt . . . . . 0 C--O 1.22 -0.46 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.356 179.983 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.8 mt . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -161.22 60.2 0.29 Allowed Glycine 0 CA--C 1.525 0.671 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 179.978 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.95 83.81 0.14 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.093 0.473 . . . . 0.0 110.516 -179.868 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.55 134.16 55.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.395 0.617 . . . . 0.0 110.291 179.964 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.432 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -106.32 153.75 21.75 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.32 -0.855 . . . . 0.0 111.213 -179.47 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -143.7 -55.13 0.38 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.181 179.523 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.8 mtt180 165.33 151.73 0.06 OUTLIER Pre-proline 0 N--CA 1.469 0.513 0 CA-C-N 115.186 -0.915 . . . . 0.0 109.717 179.408 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.432 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.4 Cg_endo -84.44 56.08 4.72 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 121.856 1.704 . . . . 0.0 112.572 179.958 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -177.7 144.81 0.38 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.423 -179.935 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 23.1 tttp . . . . . 0 C--O 1.22 -0.496 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.478 -179.955 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 . . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 160.31 -33.85 0.42 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.658 -0.977 . . . . 0.0 110.658 -179.989 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.81 178.24 0.1 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.147 0.499 . . . . 0.0 110.575 179.951 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -135.59 150.83 49.79 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.396 179.845 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.434 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.52 152.66 20.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.179 -179.36 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -142.78 -52.51 0.38 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.524 179.636 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 169.97 154.74 0.18 Allowed Pre-proline 0 N--CA 1.468 0.445 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.866 179.679 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.434 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo -83.48 56.26 5.28 Favored 'Trans proline' 0 N--CA 1.473 0.32 0 C-N-CA 121.83 1.686 . . . . 0.0 112.568 179.854 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -82.96 119.73 24.81 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.316 179.913 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.22 -0.5 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.324 -179.907 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 89.69 -117.1 4.9 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.85 -0.9 . . . . 0.0 110.85 179.876 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.72 166.1 0.08 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.148 0.499 . . . . 0.0 110.464 -179.848 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.1 m -178.6 150.7 0.54 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.411 179.918 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -69.27 158.99 33.92 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.043 -179.396 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -152.47 -49.34 0.1 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.562 179.834 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 176.19 156.42 0.41 Allowed Pre-proline 0 CA--C 1.533 0.315 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.013 179.67 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -82.88 56.43 5.62 Favored 'Trans proline' 0 N--CA 1.473 0.275 0 C-N-CA 121.951 1.768 . . . . 0.0 112.598 179.958 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 -124.56 102.62 7.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.396 179.915 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.221 -0.435 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.194 -179.969 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.429 HD22 ' HA ' ' A' ' 1' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 121.339 0.59 . . . . 0.0 109.508 . . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 60.9 -135.34 49.13 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 111.011 -0.836 . . . . 0.0 111.011 179.849 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.16 -177.83 3.64 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.07 0.462 . . . . 0.0 110.375 -179.965 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.6 m -100.81 147.83 25.63 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.351 179.944 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -104.3 159.18 15.92 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.48 -179.3 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -152.28 -48.61 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.407 179.563 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 177.22 159.14 0.5 Allowed Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.084 179.724 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -81.91 56.25 5.79 Favored 'Trans proline' 0 N--CA 1.475 0.402 0 C-N-CA 121.902 1.735 . . . . 0.0 112.698 179.774 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 p30 44.36 -170.53 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.087 -0.961 . . . . 0.0 111.946 179.761 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.5 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.372 -179.771 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.0 mp . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -122.37 -91.6 1.08 Allowed Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.804 -0.918 . . . . 0.0 110.804 -179.946 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -176.69 162.09 2.16 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.143 0.496 . . . . 0.0 110.659 -179.939 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 7.7 t -132.88 153.84 50.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.175 179.846 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.484 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -81.67 119.21 23.53 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.728 -179.391 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.418 ' O ' ' CB ' ' A' ' 7' ' ' ARG . 4.9 m-70 -117.01 -19.16 9.89 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.776 -179.381 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.484 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 32.0 mtt180 94.57 148.17 0.04 OUTLIER Pre-proline 0 N--CA 1.482 1.138 0 C-N-CA 123.952 0.901 . . . . 0.0 110.336 -179.423 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -83.82 48.86 2.69 Favored 'Trans proline' 0 N--CA 1.476 0.484 0 C-N-CA 121.881 1.72 . . . . 0.0 112.723 179.309 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.7 p-10 -107.56 118.03 35.66 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.598 -179.911 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.5 mtmt . . . . . 0 C--O 1.22 -0.459 0 CA-C-O 117.949 -1.024 . . . . 0.0 110.364 179.97 . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.456 ' O ' HD12 ' A' ' 1' ' ' LEU . 1.1 pp . . . . . 0 N--CA 1.492 1.636 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 . . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -114.13 -109.88 2.86 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 -179.982 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.5 -175.6 0.11 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.122 0.487 . . . . 0.0 110.435 -179.949 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -159.02 157.89 32.09 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.579 179.86 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.439 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.3 153.56 19.88 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.041 -179.514 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -143.54 -54.46 0.38 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.69 179.505 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.41 ' HB2' ' NH1' ' A' ' 7' ' ' ARG . 0.9 OUTLIER 171.53 154.14 0.22 Allowed Pre-proline 0 N--CA 1.467 0.381 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.077 179.755 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.4 Cg_endo -84.16 55.97 4.82 Favored 'Trans proline' 0 N--CA 1.474 0.343 0 C-N-CA 121.87 1.714 . . . . 0.0 112.654 179.996 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -75.89 84.38 2.82 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.414 179.966 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.9 tptt . . . . . 0 C--O 1.221 -0.433 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.337 179.997 . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 14.8 mt . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -149.26 -89.58 0.08 OUTLIER Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.891 -0.883 . . . . 0.0 110.891 179.998 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.41 -169.99 3.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.167 0.508 . . . . 0.0 110.436 -179.922 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.1 m -117.09 166.93 11.64 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.131 179.806 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -93.38 172.42 8.29 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.236 -0.893 . . . . 0.0 111.129 -179.247 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 4.1 t-160 -173.89 -42.64 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.729 179.745 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.3 mtt85 -179.93 155.75 0.73 Allowed Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.235 179.433 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -83.13 56.67 5.62 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 121.951 1.767 . . . . 0.0 112.704 -179.852 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -139.79 123.83 17.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.212 -0.903 . . . . 0.0 110.288 179.902 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.6 mmtp . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.436 179.996 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 . . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -105.89 -72.31 0.83 Allowed Glycine 0 CA--C 1.526 0.754 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 -179.765 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -114.24 124.7 52.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.083 0.468 . . . . 0.0 110.585 -179.729 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -107.14 145.53 32.39 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.16 179.743 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -103.12 163.57 12.15 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.555 0.693 . . . . 0.0 111.362 -179.31 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -159.9 -48.51 0.05 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.255 179.688 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.16 157.7 0.37 Allowed Pre-proline 0 CA--C 1.532 0.278 0 CA-C-N 115.162 -0.927 . . . . 0.0 109.959 179.54 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -81.53 56.26 5.89 Favored 'Trans proline' 0 N--CA 1.474 0.333 0 C-N-CA 121.864 1.709 . . . . 0.0 112.614 179.537 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -115.47 111.79 21.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.402 179.964 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.7 mtmm . . . . . 0 C--O 1.219 -0.528 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.335 179.993 . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.9 mt . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -154.51 -67.79 0.01 OUTLIER Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 -179.97 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -92.69 94.24 8.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.075 0.464 . . . . 0.0 110.486 179.971 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.7 m -124.26 136.18 53.95 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.544 0.688 . . . . 0.0 110.254 179.859 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -61.65 153.43 28.03 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.937 -1.028 . . . . 0.0 111.382 -179.179 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -146.64 -49.41 0.2 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.636 -1.165 . . . . 0.0 109.426 179.643 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.4 mtt180 176.09 157.34 0.41 Allowed Pre-proline 0 CA--C 1.534 0.347 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.119 179.683 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -82.21 56.68 5.89 Favored 'Trans proline' 0 N--CA 1.474 0.375 0 C-N-CA 121.872 1.715 . . . . 0.0 112.663 179.838 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -106.8 172.56 6.75 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.402 179.959 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.6 mttt . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.308 -179.972 . . . . . . . . 0 0 . 1 . 041 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 . . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 136.37 -52.01 0.79 Allowed Glycine 0 CA--C 1.526 0.746 0 N-CA-C 110.76 -0.936 . . . . 0.0 110.76 -179.994 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.49 -165.85 1.79 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.879 0.371 . . . . 0.0 110.423 179.998 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.5 p 63.24 134.0 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 121.582 0.706 . . . . 0.0 110.864 179.994 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.461 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -98.86 132.7 44.0 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.018 -179.532 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.95 -62.11 1.59 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.211 179.226 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.8 mtp180 159.85 147.3 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.69 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.452 179.199 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.461 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.5 Cg_endo -86.24 53.29 3.07 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 121.905 1.737 . . . . 0.0 112.61 179.897 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 177.73 -173.53 0.13 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.282 179.927 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.328 179.942 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.427 HD23 ' C ' ' A' ' 1' ' ' LEU . 4.6 tt . . . . . 0 N--CA 1.489 1.511 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -125.55 -97.2 1.09 Allowed Glycine 0 CA--C 1.524 0.644 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 -179.968 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.27 39.49 15.53 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.312 0.577 . . . . 0.0 110.379 -179.896 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.3 m 60.4 35.3 20.51 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.612 179.896 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.437 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER 61.29 118.88 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.65 179.279 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -110.77 -49.61 3.02 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.014 178.53 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 158.92 151.57 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.719 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.631 179.239 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.437 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo -84.15 55.1 4.53 Favored 'Trans proline' 0 N--CA 1.474 0.377 0 C-N-CA 121.833 1.689 . . . . 0.0 112.624 179.872 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.7 t0 59.49 80.28 0.2 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.611 179.956 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 118.005 -0.997 . . . . 0.0 110.34 -179.934 . . . . . . . . 0 0 . 1 . 043 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 . . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 93.11 -133.81 11.88 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 179.739 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.84 -179.01 0.11 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.996 0.427 . . . . 0.0 110.629 -179.842 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.7 m 62.28 117.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.383 -179.866 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.406 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -116.32 158.6 23.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.908 -178.971 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -152.04 -50.44 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.609 -1.178 . . . . 0.0 108.752 179.319 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 3.9 mtp180 168.68 153.97 0.14 Allowed Pre-proline 0 N--CA 1.466 0.338 0 CA-C-N 115.032 -0.985 . . . . 0.0 109.723 179.175 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.2 Cg_endo -83.54 56.32 5.27 Favored 'Trans proline' 0 N--CA 1.473 0.303 0 C-N-CA 121.963 1.776 . . . . 0.0 112.598 -179.932 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -95.47 173.7 7.38 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.395 179.969 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.7 mmtp . . . . . 0 C--O 1.22 -0.485 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.375 -179.957 . . . . . . . . 0 0 . 1 . 044 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.2 mp . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 044 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.11 -38.86 96.28 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.881 -0.888 . . . . 0.0 110.881 -179.954 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -117.02 94.49 4.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.065 0.46 . . . . 0.0 110.545 -179.973 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 74.0 m -125.81 136.36 53.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.559 0.695 . . . . 0.0 110.342 179.726 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -67.64 166.9 14.11 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.44 -179.336 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -166.37 -45.9 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.352 179.793 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.401 ' NH1' ' HB2' ' A' ' 7' ' ' ARG . 0.7 OUTLIER 176.33 153.38 0.37 Allowed Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.871 179.507 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -85.42 50.03 2.61 Favored 'Trans proline' 0 N--CA 1.476 0.455 0 C-N-CA 122.046 1.831 . . . . 0.0 113.187 -179.75 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.1 t70 59.48 161.42 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.68 179.729 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.3 mttm . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 118.024 -0.988 . . . . 0.0 110.126 179.852 . . . . . . . . 0 0 . 1 . 045 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.675 HD13 ' N ' ' A' ' 1' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.745 0 CA-C-O 120.746 0.307 . . . . 0.0 110.708 . . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 164.05 -81.79 0.12 Allowed Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.528 -1.029 . . . . 0.0 110.528 179.997 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -131.73 -174.6 3.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.22 0.533 . . . . 0.0 110.589 179.828 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.86 122.22 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.512 179.924 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.427 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -111.6 142.82 43.42 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.914 -179.245 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -134.84 -51.37 0.78 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 114.567 -1.197 . . . . 0.0 108.782 178.939 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.1 mtt180 168.21 157.45 0.15 Allowed Pre-proline 0 N--CA 1.465 0.305 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.466 179.456 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.427 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 39.8 Cg_endo -80.18 56.76 6.2 Favored 'Trans proline' 0 N--CA 1.475 0.403 0 C-N-CA 121.67 1.58 . . . . 0.0 112.581 179.335 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -173.17 175.33 3.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.926 179.862 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.1 ttpm? . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.497 179.919 . . . . . . . . 0 0 . 1 . 046 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.416 0.627 . . . . 0.0 109.462 . . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 68.72 171.53 6.96 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 179.902 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.9 152.52 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.196 0.522 . . . . 0.0 110.744 179.987 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.5 p -147.04 145.77 29.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.488 179.975 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.441 ' CZ3' ' HG2' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -70.49 128.85 37.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.554 -179.724 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.99 -15.76 9.92 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.683 -179.159 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.441 ' HG2' ' CZ3' ' A' ' 5' ' ' TRP . 0.1 OUTLIER 83.94 148.3 0.1 OUTLIER Pre-proline 0 N--CA 1.476 0.858 0 C-N-CA 122.713 0.405 . . . . 0.0 110.117 -179.154 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -82.95 51.61 3.74 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 121.754 1.636 . . . . 0.0 112.673 179.125 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 t0 67.44 137.3 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.539 179.826 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.5 mttt . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.953 -1.022 . . . . 0.0 110.456 179.997 . . . . . . . . 0 0 . 1 . 047 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.2 tp . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 0 0 . 1 . 047 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 100.34 75.43 1.16 Allowed Glycine 0 CA--C 1.523 0.573 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 -179.98 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.01 -169.12 0.17 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.081 0.467 . . . . 0.0 110.303 179.965 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.58 153.08 20.06 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.965 179.847 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.409 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -102.56 151.26 22.53 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.323 -179.177 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -143.01 -50.05 0.34 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.468 179.464 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 173.51 155.82 0.28 Allowed Pre-proline 0 N--CA 1.466 0.341 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.027 179.742 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.409 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.6 Cg_endo -83.55 56.3 5.26 Favored 'Trans proline' 0 N--CA 1.474 0.344 0 C-N-CA 121.904 1.736 . . . . 0.0 112.523 179.944 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -133.19 178.29 7.01 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.418 -179.985 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.406 -179.966 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 16.9 mt . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 0 0 . 1 . 048 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 153.83 80.15 0.03 OUTLIER Glycine 0 CA--C 1.524 0.613 0 N-CA-C 110.694 -0.963 . . . . 0.0 110.694 -179.989 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -177.67 134.88 0.17 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.998 0.428 . . . . 0.0 110.421 -179.962 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -152.21 139.2 19.09 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.337 179.878 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.406 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -109.73 155.62 21.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.479 -179.398 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.28 -49.44 0.14 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.199 179.356 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 175.91 156.63 0.4 Allowed Pre-proline 0 CA--C 1.534 0.345 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.824 179.394 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo -83.04 56.83 5.73 Favored 'Trans proline' 0 N--CA 1.474 0.325 0 C-N-CA 121.961 1.774 . . . . 0.0 112.548 -179.974 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -143.79 123.57 13.41 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.463 179.946 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.221 -0.447 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.446 179.958 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.594 ' O ' HD12 ' A' ' 1' ' ' LEU . 1.1 pp . . . . . 0 N--CA 1.494 1.745 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 . . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -122.63 -95.1 1.24 Allowed Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.833 -0.907 . . . . 0.0 110.833 -179.954 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.77 -179.84 0.56 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.056 0.455 . . . . 0.0 110.352 179.895 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.1 m -157.17 135.96 11.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.518 179.986 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.415 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -162.41 162.12 27.57 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 121.686 0.755 . . . . 0.0 111.788 -179.87 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -154.03 -51.0 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.884 179.377 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 165.52 154.15 0.08 OUTLIER Pre-proline 0 N--CA 1.468 0.468 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.978 179.24 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.415 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.3 Cg_endo -83.06 57.94 6.12 Favored 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 121.936 1.757 . . . . 0.0 112.371 179.624 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.4 t0 64.45 138.43 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.558 -179.895 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.501 0 CA-C-O 118.043 -0.98 . . . . 0.0 110.279 -179.988 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 18.8 mt . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.345 0.593 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 050 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 98.07 -39.91 2.64 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.722 -0.951 . . . . 0.0 110.722 -179.914 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -172.09 140.16 1.17 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.026 0.441 . . . . 0.0 110.328 -179.979 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.0 m -102.68 36.39 2.2 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.636 0.731 . . . . 0.0 110.443 -179.985 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.439 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.1 OUTLIER 61.42 117.81 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.74 179.091 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -112.57 -45.23 3.25 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.761 -1.108 . . . . 0.0 108.96 178.34 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.2 mtt180 162.43 153.65 0.04 OUTLIER Pre-proline 0 N--CA 1.47 0.556 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.89 179.268 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 41.0 Cg_endo -83.55 56.28 5.25 Favored 'Trans proline' 0 N--CA 1.473 0.323 0 C-N-CA 121.912 1.741 . . . . 0.0 112.613 -179.953 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -67.51 170.03 8.21 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.429 -179.993 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 22.6 mttt . . . . . 0 C--O 1.22 -0.482 0 CA-C-O 118.001 -0.999 . . . . 0.0 110.37 -179.962 . . . . . . . . 0 0 . 1 . 051 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 . . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 125.0 -72.96 0.43 Allowed Glycine 0 CA--C 1.524 0.641 0 N-CA-C 110.776 -0.929 . . . . 0.0 110.776 -179.91 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -128.77 178.55 6.27 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.132 0.492 . . . . 0.0 110.46 179.96 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.4 p -177.97 155.65 0.99 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.392 179.958 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.423 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -97.43 153.81 17.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.031 -179.457 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -143.75 -59.74 0.4 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.427 179.622 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 172.79 153.49 0.24 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 115.296 -0.865 . . . . 0.0 109.922 179.588 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.423 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.4 Cg_endo -83.51 56.52 5.36 Favored 'Trans proline' 0 N--CA 1.473 0.318 0 C-N-CA 121.855 1.704 . . . . 0.0 112.507 179.871 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -119.7 158.16 27.04 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.467 -179.981 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.8 tttp . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 118.019 -0.991 . . . . 0.0 110.371 179.997 . . . . . . . . 0 0 . 1 . 052 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 39.1 mt . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 052 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -168.22 -138.15 2.4 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.74 -0.944 . . . . 0.0 110.74 -180.0 . . . . . . . . 1 1 . 1 . 052 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.6 42.07 14.52 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.281 0.562 . . . . 0.0 110.493 -179.997 . . . . . . . . 1 1 . 1 . 052 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 70.7 m -97.31 42.6 1.09 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.497 179.982 . . . . . . . . 1 1 . 1 . 052 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.433 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER 62.94 -173.77 0.15 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.69 0.757 . . . . 0.0 110.36 179.551 . . . . . . . . 3 3 . 1 . 052 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 174.24 -45.11 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.616 -1.174 . . . . 0.0 108.623 -179.762 . . . . . . . . 2 2 . 1 . 052 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 164.29 154.4 0.06 OUTLIER Pre-proline 0 N--CA 1.468 0.429 0 CA-C-N 114.86 -1.064 . . . . 0.0 109.703 179.179 . . . . . . . . 2 2 . 1 . 052 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.433 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.3 Cg_endo -83.18 56.76 5.63 Favored 'Trans proline' 0 N--CA 1.473 0.312 0 C-N-CA 121.864 1.709 . . . . 0.0 112.513 179.882 . . . . . . . . 2 2 . 1 . 052 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -166.18 -174.87 3.09 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.226 179.969 . . . . . . . . 1 1 . 1 . 052 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.22 -0.461 0 CA-C-O 117.972 -1.013 . . . . 0.0 110.493 179.951 . . . . . . . . 1 1 . 1 . 053 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 12.7 mt . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 . . . . . . . . . 0 0 . 1 . 053 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 150.47 73.4 0.01 OUTLIER Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 179.988 . . . . . . . . 1 1 . 1 . 053 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.74 145.11 53.44 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.053 0.454 . . . . 0.0 110.376 179.847 . . . . . . . . 1 1 . 1 . 053 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.59 128.09 34.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.367 0.603 . . . . 0.0 110.614 -179.857 . . . . . . . . 2 2 . 1 . 053 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.439 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -177.59 145.21 0.41 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.816 179.799 . . . . . . . . 3 3 . 1 . 053 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -134.96 -51.12 0.77 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.547 -1.206 . . . . 0.0 108.898 178.819 . . . . . . . . 2 2 . 1 . 053 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 9.4 mtp180 160.18 152.91 0.03 OUTLIER Pre-proline 0 N--CA 1.471 0.606 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.606 179.364 . . . . . . . . 1 1 . 1 . 053 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.5 Cg_endo -83.54 56.07 5.18 Favored 'Trans proline' 0 N--CA 1.473 0.319 0 C-N-CA 121.911 1.741 . . . . 0.0 112.537 179.784 . . . . . . . . 2 2 . 1 . 053 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -140.11 147.12 39.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.337 -179.991 . . . . . . . . 1 1 . 1 . 053 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.433 0 CA-C-O 117.952 -1.023 . . . . 0.0 110.508 -179.982 . . . . . . . . 1 1 . 1 . 054 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.0 pp . . . . . 0 N--CA 1.493 1.69 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 054 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -98.69 -87.42 1.9 Allowed Glycine 0 CA--C 1.524 0.643 0 N-CA-C 110.933 -0.867 . . . . 0.0 110.933 -179.917 . . . . . . . . 1 1 . 1 . 054 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.59 -179.22 0.1 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.029 0.442 . . . . 0.0 110.478 -179.937 . . . . . . . . 1 1 . 1 . 054 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.8 m -63.51 132.96 52.95 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.112 179.914 . . . . . . . . 1 1 . 1 . 054 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -107.71 172.71 6.68 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.66 -179.061 . . . . . . . . 2 2 . 1 . 054 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -176.63 -43.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 114.606 -1.179 . . . . 0.0 109.081 179.902 . . . . . . . . 2 2 . 1 . 054 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 173.84 154.26 0.28 Allowed Pre-proline 0 CA--C 1.534 0.338 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.805 179.284 . . . . . . . . 2 2 . 1 . 054 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -83.43 56.62 5.44 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 121.853 1.702 . . . . 0.0 112.794 -179.763 . . . . . . . . 1 1 . 1 . 054 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -102.56 44.81 0.99 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.195 179.786 . . . . . . . . 1 1 . 1 . 054 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.5 tttm . . . . . 0 C--O 1.221 -0.447 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.475 -179.991 . . . . . . . . 0 0 . 1 . 055 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.0 mp . . . . . 0 N--CA 1.491 1.604 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 . . . . . . . . . 0 0 . 1 . 055 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -137.03 114.54 1.14 Allowed Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.908 -0.877 . . . . 0.0 110.908 -179.886 . . . . . . . . 1 1 . 1 . 055 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -111.61 93.6 4.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.051 0.453 . . . . 0.0 110.234 179.811 . . . . . . . . 1 1 . 1 . 055 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 m -80.42 133.12 35.84 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.617 -179.722 . . . . . . . . 1 1 . 1 . 055 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.44 ' CH2' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -119.27 171.25 8.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.426 -179.601 . . . . . . . . 3 3 . 1 . 055 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -160.07 -64.99 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.168 179.596 . . . . . . . . 2 2 . 1 . 055 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.1 mtp180 169.54 150.89 0.14 Allowed Pre-proline 0 N--CA 1.468 0.453 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.857 179.043 . . . . . . . . 1 1 . 1 . 055 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.44 ' HD3' ' CH2' ' A' ' 5' ' ' TRP . 40.6 Cg_endo -83.82 56.32 5.13 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 121.924 1.749 . . . . 0.0 112.613 179.87 . . . . . . . . 2 2 . 1 . 055 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.7 t70 59.52 40.58 20.31 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.634 179.989 . . . . . . . . 1 1 . 1 . 055 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.1 mmtp . . . . . 0 C--O 1.22 -0.469 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.514 -179.929 . . . . . . . . 0 0 . 1 stop_ save_